A0A3Q0KR16_SCHMA Loading...

IRS-type PTB domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KR16, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,175 aa.

						>A0A3Q0KR16_SCHMA|A0A3Q0KR16
MGAINSLIDTPGGYSVLQKNSETRHCRFCGSAYNDVCTKDIQTSRLEDHHPAELCGIWLGKLYSNQMKEIRLHGDFRALSASQSHCAQTEGNFESVGSPLVTLPKRSCAPTRSHVATLLRHSDTTKNQSTLKDFFSTMDIRNSSSVQYTELEGCHINGCLFVEHGNLVFQAVSKRSHVPFLLIDQQMLGPTSDCVAPIFHQTNKGRFFDNPKLHCPIQRPLPILSFPENGSHLGNSDTVGQKCSPSLVDNPYISTERCPEDVKPRLPPPPLRLSWPLVTLRRFGFYGNSLFKVETGRRAPRGEGLYLFRIKHLREFRKSFETCVHQHRDNLSVHQLSTAISESRSLLRSNNNGKLSLIMPFNKIFHKQSSISLSTTPMLHDSINEKIDRNLFNGRSDHKNITDNHDTFHHYNRPYPPVLSERNNLAFSFDDTEIDLLQSQTIKLTNNNKIQQKQEHHDRVSSNCLHWLQLQNSSNNFGNNENNQHANNDHTNSNHCTKLQNSFKYSCPQLSDIASVNPINCNDDAAATRSSINRECHHVGKGYCQRSGGSYFSVHRSNNHHSCCLDKDTKNDTVVDIDECIVNVNEDDEISNLPEAPLPPLYNNSSYCDIIQGQSVCCQRIYDNLIAVNNGVNNCASENDNDNCCCSTVRRSSPSMTTPATPTVCFPHQLSNEYSDNNNISNVAEIDKKASVDEQTLVDGVGTIVLAVERGDSTSSFGEQKLAHINACNSPPVLLKKSLSSDINLPEIIDKPSSIIPNNTTATTSTNSDNNNDGFNSSKEHDVMRKFRNKSQTLILSRLPSTSSKIYLHSRHASLPNPNTCSNTVIIGDGISSREHSYANTGVNHSRQENLSFRVNKKIPCDYLCKIHRNLSNSSDRKNSDMLDMITEYSPYYNLSTSPQTLTQIQCTGLCTSQTITSSLPGENNQKCIHSSSVSCLPTANYPVSGDNISRMSYCSSYSKESPIQTARNQPSPSVASSSVTISTNISVTTNNNTATTSPSIATSTTTTVPRRTGNLGCHNNFEKPTSMLHYATLDFGIITPETSQYRNESYSDMNAVRWNNNIHDIDNTHTGSSRNQKICSINNTVTNANNNNSHNNLNDSYCSRIYGTLTDTLHSHSIESPCHNHFSGHTVSSNNSVNCEDIIRDESDADLPSNYVAICQLQTLAMRAVLSATT
					

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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	37.5	Very low	37.3	Very low	213 Å²	213	108.5 Å²	108.5	100%	1.049	65%	0.654	S	S	*	*				0	-76.2	0	-58.1	-46.4	-107.4	0	0	111.7	A3 I4	M1-A3 PolarHBondContact O-N 3.46Å; M1-I4 PolarHBondContact O-N 3.33Å
2	G	37.1	Very low	36.6	Very low	70 Å²	70	105.6 Å²	105.6	72%	0.722	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	9.5	-170.5	0	0	0	0	0	119.5
3	A	37.9	Very low	35.9	Very low	81 Å²	81	101.8 Å²	101.8	67%	0.669	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	-10.4	175.7	0	0	0	0	0	113.7	M1	M1-A3 PolarHBondContact O-N 3.46Å
4	I	36.1	Very low	35.6	Very low	95 Å²	95	110.6 Å²	110.6	49%	0.487	67%	0.673	S	S	.	*	S	Bend	trans	-90.2	-36.7	-175.5	-60.1	176.7	0	0	0	111.8	M1 S6 L7 I8	M1-I4 PolarHBondContact O-N 3.33Å; I4-S6 VanDerWaalsContact C-N 3.27Å; I4-S6 PolarHBondContact O-N 2.85Å; I4-L7 WeakPolarHBondContact O-CB 3.45Å; I4-L7 PolarHBondContact O-N 3.29Å; I4-L7 VanDerWaalsContact O-N 3.11Å; I4-I8 HydrophobicContact CG2-CD1 4.5Å
5	N	35.1	Very low	35.1	Very low	109 Å²	109	110.5 Å²	110.5	58%	0.583	68%	0.679	S	S	*	*	H	α-helix	trans	-61.8	-36.3	-178.8	-63.2	32.6	0	0	0	112.1	L7 I8 D9	N5-L7 PolarHBondContact O-N 3.31Å; N5-I8 PolarHBondContact O-N 3.28Å; N5-D9 PolarHBondContact O-N 3.48Å
6	S	37.5	Very low	34.8	Very low	101 Å²	101	111.9 Å²	111.9	71%	0.706	69%	0.687	S	S	*	*	H	α-helix	trans	-66.5	2	177	-171.7	0	0	0	0	115.1	I4	I4-S6 VanDerWaalsContact C-N 3.27Å; I4-S6 PolarHBondContact O-N 2.85Å
7	L	41.2	Very low	34.7	Very low	80 Å²	80	114.6 Å²	114.6	42%	0.419	70%	0.695	S	S	.	*	H	α-helix	trans	-103.9	-18.9	170.2	-76.5	154.4	0	0	0	112.9	I4 N5 P300	I4-L7 WeakPolarHBondContact O-CB 3.45Å; I4-L7 PolarHBondContact O-N 3.29Å; I4-L7 VanDerWaalsContact O-N 3.11Å; N5-L7 PolarHBondContact O-N 3.31Å; L7-P300 HydrophobicContact CD2-CB 4.29Å
8	I	39.4	Very low	34.6	Very low	100 Å²	100	117.6 Å²	117.6	51%	0.513	70%	0.7	S	S	.	*	H	α-helix	trans	-93.8	-27.4	-175.1	-62.3	171.7	0	0	0	111.2	I4 N5 T10	I4-I8 HydrophobicContact CG2-CD1 4.5Å; N5-I8 PolarHBondContact O-N 3.28Å; I8-T10 VanDerWaalsContact C-N 3.34Å; I8-T10 PolarHBondContact O-N 3.3Å
9	D	33.1	Very low	34.5	Very low	130 Å²	130	122.5 Å²	122.5	70%	0.695	71%	0.711	S	S	*	*			trans	-67.9	86.8	177.5	-68.5	-32.4	0	0	0	112	N5	N5-D9 PolarHBondContact O-N 3.48Å
10	T	38.1	Very low	34.7	Very low	104 Å²	104	124.2 Å²	124.2	64%	0.638	72%	0.718	S	S	*	*			trans	-52.2	138.1	152.5	47.5	0	0	0	0	109.2	I8 G12	I8-T10 VanDerWaalsContact C-N 3.34Å; I8-T10 PolarHBondContact O-N 3.3Å; T10-G12 PolarHBondContact O-N 2.91Å
11	P	37.3	Very low	35.1	Very low	110 Å²	110	120.7 Å²	120.7	71%	0.714	70%	0.7	S	S	*	*	S	Bend	trans	-74.3	55.9	173.2	32	-36	0	0	0	111.8
12	G	28.7	Very low	35.4	Very low	74 Å²	74	116.7 Å²	116.7	76%	0.763	68%	0.679	S	S	*	*			trans	-104	65.9	173.5	0	0	0	0	0	110.1	T10	T10-G12 PolarHBondContact O-N 2.91Å
13	G	27.7	Very low	36.3	Very low	56 Å²	56	117.1 Å²	117.1	58%	0.577	67%	0.668	S	S	*	*			trans	-161.5	7.8	-171.7	0	0	0	0	0	116.9
14	Y	32.2	Very low	37.2	Very low	225 Å²	225	118.4 Å²	118.4	88%	0.882	66%	0.656	S	S	*	*			trans	-129.8	61.1	178.9	-65.1	-71	0	0	0	112.2
15	S	27.6	Very low	38.6	Very low	109 Å²	109	119.5 Å²	119.5	76%	0.762	66%	0.658	S	S	*	*			trans	-65.7	149.5	149.8	50.9	0	0	0	0	109.6
16	V	30	Very low	40.2	Very low	134 Å²	134	114.6 Å²	114.6	81%	0.812	63%	0.633	S	S	*	*			trans	76	89.1	-174.3	-168.2	0	0	0	0	114.1
17	L	32.7	Very low	41.4	Very low	157 Å²	157	121.4 Å²	121.4	82%	0.822	64%	0.643	S	S	*	*	S	Bend		-164.2	142	120.5	-102.3	166	0	0	0	110.4
18	Q	34.4	Very low	42.7	Very low	169 Å²	169	123.3 Å²	123.3	79%	0.79	65%	0.648	S	S	*	*			trans	51.1	98.3	174.3	-60	-167.7	-1.6	0	0	118.3	N20	Q18-N20 PolarHBondContact O-N 3.3Å
19	K	32.3	Very low	44.1	Very low	210 Å²	210	119.6 Å²	119.6	91%	0.913	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	12.3	-176.6	-155.8	176.5	179.6	180	0	115.7
20	N	38	Very low	45.6	Very low	156 Å²	156	115.7 Å²	115.7	83%	0.834	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.2	2.5	-159.8	-70.4	15	0	0	0	115.9	Q18	Q18-N20 PolarHBondContact O-N 3.3Å
21	S	43.4	Very low	46.9	Very low	51 Å²	51	112 Å²	112	36%	0.357	60%	0.599	S	S	.	*			trans	-88.8	130.7	176.2	52.8	0	0	0	0	112.1	T23	S21-T23 PolarHBondContact O-N 3.31Å; S21-T23 VanDerWaalsContact O-N 3.1Å
22	E	43.9	Very low	47.8	Very low	129 Å²	129	109.7 Å²	109.7	60%	0.603	59%	0.589	S	S	*	*			trans	-66.8	105.7	173.6	-176.3	-177.2	-110.8	0	0	109.8	R24	E22-R24 PolarHBondContact O-N 3.1Å; E22-R24 IonicContact OE2-CZ 2.76Å; E22-R24 VanDerWaalsContact OE2-CZ 3.23Å; E22-R24 IonicContact OE2-NE 3.32Å; E22-R24 PolarHBondContact OE2-NE 3.09Å; E22-R24 IonicContact OE2-NH2 2.84Å; E22-R24 PolarHBondContact OE2-NH2 3.42Å
23	T	55.2	Low	49.1	Very low	79 Å²	79	108.7 Å²	108.7	49%	0.485	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-69.4	99.2	-179	53.2	0	0	0	0	110.8	S21 H25	S21-T23 PolarHBondContact O-N 3.31Å; S21-T23 VanDerWaalsContact O-N 3.1Å; T23-H25 PolarHBondContact O-ND1 3.26Å; T23-H25 VanDerWaalsContact O-ND1 3.09Å
24	R	57.2	Low	49.8	Very low	109 Å²	109	109.7 Å²	109.7	41%	0.411	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.1	133.4	-178.3	-72.6	-177.5	173.6	179.5	-5.8	109.8	E22 A32 Y33 D35	E22-R24 PolarHBondContact O-N 3.1Å; E22-R24 IonicContact OE2-CZ 2.76Å; E22-R24 VanDerWaalsContact OE2-CZ 3.23Å; E22-R24 IonicContact OE2-NE 3.32Å; E22-R24 PolarHBondContact OE2-NE 3.09Å; E22-R24 IonicContact OE2-NH2 2.84Å; E22-R24 PolarHBondContact OE2-NH2 3.42Å; R24-A32 CarbonylContact O-C 3.56Å; R24-A32 WeakPolarHBondContact O-CA 3.36Å; R24-Y33 HydrophobicContact CB-CD1 4.41Å; R24-Y33 HydrophobicContact CB-CE1 3.87Å; R24-Y33 HydrophobicContact CB-CE2 4.08Å; R24-Y33 PolarHBondContact N-O 3.06Å; R24-Y33 VanDerWaalsContact N-O 3.08Å; R24-Y33 WeakPolarHBondContact O-CD1 3.46Å; R24-Y33 WeakPolarHBondContact O-CE1 3.47Å; R24-Y33 PolarHBondContact O-N 2.97Å; R24-D35 WeakPolarHBondContact CD-OD2 3.47Å; R24-D35 IonicContact CZ-OD2 2.67Å; R24-D35 VanDerWaalsContact CZ-OD2 3.32Å; R24-D35 IonicContact NE-OD2 2.63Å; R24-D35 IonicContact NH1-OD2 3.53Å; R24-D35 PolarHBondContact NH1-OD2 3.19Å
25	H	65.4	Low	50.4	Low	118 Å²	118	101.3 Å²	101.3	55%	0.546	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	125.9	179.3	-69.1	64	0	0	0	108.9	T23 R27 G30 S31	T23-H25 PolarHBondContact O-ND1 3.26Å; T23-H25 VanDerWaalsContact O-ND1 3.09Å; H25-R27 PolarHBondContact O-N 3.48Å; H25-R27 VanDerWaalsContact O-N 3.08Å; H25-G30 PolarHBondContact CD2-O 3.06Å; H25-S31 CarbonylContact C-O 3.38Å; H25-S31 WeakPolarHBondContact CA-O 3.45Å
26	C	68.2	Low	50.9	Low	6 Å²	6	100.5 Å²	100.5	4%	0.041	52%	0.516	C	S	.	.			trans	-58.8	115.8	175.8	175.4	0	0	0	0	109.7	F28 C29 G30 S31 Y33 H49	C26-F28 PolarHBondContact O-N 3.39Å; C26-F28 PolarHBondContact SG-N 2.82Å; C26-C29 PolarHBondContact O-N 2.91Å; C26-G30 WeakPolarHBondContact O-CA 3.33Å; C26-G30 PolarHBondContact O-N 3.01Å; C26-S31 PolarHBondContact N-O 3.49Å; C26-Y33 HydrophobicContact CB-CD1 4.42Å; C26-Y33 HydrophobicContact CB-CE1 4.37Å; C26-H49 HydrophobicContact CB-CB 4.13Å; C26-H49 WeakPolarHBondContact SG-CB 3.45Å
27	R	64.6	Low	50.8	Low	244 Å²	244	98.5 Å²	98.5	92%	0.921	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-12.4	-179.9	-68.5	-174.9	176.2	-174	-1.3	114.7	H25	H25-R27 PolarHBondContact O-N 3.48Å; H25-R27 VanDerWaalsContact O-N 3.08Å
28	F	67.4	Low	50.9	Low	120 Å²	120	94.6 Å²	94.6	53%	0.526	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-43.1	-176.2	-61.2	-75.1	0	0	0	113.4	C26 P51 C159 V172	C26-F28 PolarHBondContact O-N 3.39Å; C26-F28 PolarHBondContact SG-N 2.82Å; F28-P51 HydrophobicContact CD1-CB 4.48Å; F28-P51 HydrophobicContact CD1-CG 3.86Å; F28-P51 HydrophobicContact CD2-CG 3.66Å; F28-P51 HydrophobicContact CE1-CG 3.73Å; F28-P51 HydrophobicContact CE2-CG 3.52Å; F28-P51 HydrophobicContact CG-CG 3.83Å; F28-P51 HydrophobicContact CZ-CG 3.56Å; F28-C159 WeakPolarHBondContact CB-SG 3.47Å; F28-V172 WeakPolarHBondContact O-CG2 3.4Å
29	C	69.7	Low	50.7	Low	22 Å²	22	95.5 Å²	95.5	15%	0.149	49%	0.491	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-1.4	179.2	66.3	0	0	0	0	115.7	C26 S31 H49 C159 V172	C26-C29 PolarHBondContact O-N 2.91Å; C29-S31 PolarHBondContact O-N 2.94Å; C29-S31 VanDerWaalsContact O-N 3.15Å; C29-H49 PolarHBondContact SG-ND1 3.12Å; C29-C159 HydrophobicContact CB-CB 4.14Å; C29-V172 HydrophobicContact CB-CG2 4.04Å
30	G	64.8	Low	50.5	Low	48 Å²	48	91.8 Å²	91.8	50%	0.495	48%	0.481	S	S	.	.			trans	75.7	-11	178	0	0	0	0	0	115.5	H25 C26 A32	H25-G30 PolarHBondContact CD2-O 3.06Å; C26-G30 WeakPolarHBondContact O-CA 3.33Å; C26-G30 PolarHBondContact O-N 3.01Å; G30-A32 PolarHBondContact O-N 2.98Å
31	S	64.9	Low	50.3	Low	26 Å²	26	91.2 Å²	91.2	18%	0.182	48%	0.476	C	S	.	.			trans	-59.8	130.2	178.8	-61.8	0	0	0	0	112.2	H25 C26 C29 Q170	H25-S31 CarbonylContact C-O 3.38Å; H25-S31 WeakPolarHBondContact CA-O 3.45Å; C26-S31 PolarHBondContact N-O 3.49Å; C29-S31 PolarHBondContact O-N 2.94Å; C29-S31 VanDerWaalsContact O-N 3.15Å; S31-Q170 PolarHBondContact OG-NE2 2.82Å; S31-Q170 PolarHBondContact OG-OE1 2.87Å
32	A	55.6	Low	49.8	Very low	61 Å²	61	98.4 Å²	98.4	50%	0.504	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	135	162.7	0	0	0	0	0	109.7	R24 G30	R24-A32 CarbonylContact O-C 3.56Å; R24-A32 WeakPolarHBondContact O-CA 3.36Å; G30-A32 PolarHBondContact O-N 2.98Å
33	Y	56.7	Low	49.5	Very low	54 Å²	54	94.7 Å²	94.7	21%	0.212	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	156.3	169.9	68.5	-85.7	0	0	0	108.3	R24 C26 E47	R24-Y33 HydrophobicContact CB-CD1 4.41Å; R24-Y33 HydrophobicContact CB-CE1 3.87Å; R24-Y33 HydrophobicContact CB-CE2 4.08Å; R24-Y33 PolarHBondContact N-O 3.06Å; R24-Y33 VanDerWaalsContact N-O 3.08Å; R24-Y33 WeakPolarHBondContact O-CD1 3.46Å; R24-Y33 WeakPolarHBondContact O-CE1 3.47Å; R24-Y33 PolarHBondContact O-N 2.97Å; C26-Y33 HydrophobicContact CB-CD1 4.42Å; C26-Y33 HydrophobicContact CB-CE1 4.37Å; Y33-E47 WeakPolarHBondContact CB-OE2 3.42Å; Y33-E47 HydrophobicContact CD2-CB 3.82Å; Y33-E47 HydrophobicContact CE2-CB 4.38Å
34	N	42.9	Very low	48.6	Very low	76 Å²	76	94.9 Å²	94.9	41%	0.406	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	117.9	-172.6	-82.8	-24.7	0	0	0	108.7	V36 E47	N34-V36 HydrophobicContact CB-CG2 4.26Å; N34-V36 PolarHBondContact O-N 3.4Å; N34-E47 PolarHBondContact N-OE2 2.88Å; N34-E47 VanDerWaalsContact O-OE2 3.11Å
35	D	43.2	Very low	47.9	Very low	50 Å²	50	98.7 Å²	98.7	27%	0.267	51%	0.509	S	S	.	.			trans	-71.4	84.1	171.8	-151.2	-38.9	0	0	0	108.5	R24 C37	R24-D35 WeakPolarHBondContact CD-OD2 3.47Å; R24-D35 IonicContact CZ-OD2 2.67Å; R24-D35 VanDerWaalsContact CZ-OD2 3.32Å; R24-D35 IonicContact NE-OD2 2.63Å; R24-D35 IonicContact NH1-OD2 3.53Å; R24-D35 PolarHBondContact NH1-OD2 3.19Å; D35-C37 PolarHBondContact O-N 3Å
36	V	38.3	Very low	47.1	Very low	91 Å²	91	96 Å²	96	55%	0.552	50%	0.499	S	S	*	.			trans	-68.6	85.4	-177.7	-179.6	0	0	0	0	108.2	N34 T38	N34-V36 HydrophobicContact CB-CG2 4.26Å; N34-V36 PolarHBondContact O-N 3.4Å; V36-T38 HydrophobicContact CG1-CG2 4.27Å; V36-T38 PolarHBondContact O-N 2.92Å
37	C	27.7	Very low	46.6	Very low	92 Å²	92	98.2 Å²	98.2	62%	0.622	51%	0.508	S	S	*	.			trans	-78	60	-173.2	-157.5	0	0	0	0	111.6	D35 K39	D35-C37 PolarHBondContact O-N 3Å; C37-K39 PolarHBondContact O-N 2.71Å
38	T	34.7	Very low	47	Very low	76 Å²	76	89.8 Å²	89.8	47%	0.466	48%	0.481	S	S	.	.			trans	-62.5	103.6	159.5	50.2	0	0	0	0	107.3	V36 D40	V36-T38 HydrophobicContact CG1-CG2 4.27Å; V36-T38 PolarHBondContact O-N 2.92Å; T38-D40 PolarHBondContact O-N 2.75Å
39	K	29.9	Very low	47.8	Very low	188 Å²	188	85 Å²	85	82%	0.817	46%	0.461	S	S	*	.			trans	-68.4	-12.9	-176.9	-75.9	-176.8	173	178.8	0	113.7	C37	C37-K39 PolarHBondContact O-N 2.71Å
40	D	29.8	Very low	48.7	Very low	132 Å²	132	84.7 Å²	84.7	71%	0.706	46%	0.457	S	S	*	.	S	Bend	trans	-109.5	143.3	178.3	-58.9	-73.2	0	0	0	110.9	T38	T38-D40 PolarHBondContact O-N 2.75Å
41	I	32.7	Very low	49.8	Very low	143 Å²	143	83.5 Å²	83.5	73%	0.733	44%	0.441	S	S	*	.	S	Bend	trans	74	138.6	-175.9	-48.3	169.2	0	0	0	113.6	T43	I41-T43 HydrophobicContact CG2-CG2 4.12Å; I41-T43 PolarHBondContact O-N 3.39Å
42	Q	32.5	Very low	51	Low	203 Å²	203	82.5 Å²	82.5	95%	0.949	43%	0.434	S	S	*	.	S	Bend	trans	-76.9	43.4	-169.4	-60.8	-179.3	-9.6	0	0	114.6
43	T	38.7	Very low	52.6	Low	51 Å²	51	81.1 Å²	81.1	31%	0.313	42%	0.417	S	S	.	.			trans	-109.2	0.1	-168.5	36.7	0	0	0	0	115.6	I41 R45	I41-T43 HydrophobicContact CG2-CG2 4.12Å; I41-T43 PolarHBondContact O-N 3.39Å; T43-R45 PolarHBondContact O-N 2.91Å
44	S	34.7	Very low	54.2	Low	82 Å²	82	78.5 Å²	78.5	57%	0.573	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	45.4	-174.5	52	0	0	0	0	116
45	R	42.7	Very low	56.3	Low	189 Å²	189	75.3 Å²	75.3	71%	0.713	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140.8	21.7	169.4	-67.1	-163	-175.5	-161.7	0.6	113.3	T43 E47	T43-R45 PolarHBondContact O-N 2.91Å; R45-E47 VanDerWaalsContact C-N 3.33Å; R45-E47 PolarHBondContact O-N 2.77Å
46	L	49.7	Very low	58.2	Low	62 Å²	62	72.9 Å²	72.9	33%	0.325	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-22.9	-173	-127.1	72.5	0	0	0	113.6	T322	L46-T322 HydrophobicContact CD1-CG2 4.15Å
47	E	57.7	Low	60.4	Low	53 Å²	53	69 Å²	69	25%	0.248	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	28.7	-178.5	-57.2	-167.7	-178.3	0	0	113.4	Y33 N34 R45 H49	Y33-E47 WeakPolarHBondContact CB-OE2 3.42Å; Y33-E47 HydrophobicContact CD2-CB 3.82Å; Y33-E47 HydrophobicContact CE2-CB 4.38Å; N34-E47 PolarHBondContact N-OE2 2.88Å; N34-E47 VanDerWaalsContact O-OE2 3.11Å; R45-E47 VanDerWaalsContact C-N 3.33Å; R45-E47 PolarHBondContact O-N 2.77Å; E47-H49 PolarHBondContact O-CD2 3.48Å; E47-H49 PolarHBondContact O-N 3.34Å; E47-H49 VanDerWaalsContact O-N 3.17Å
48	D	72.4	Confident	62.9	Low	66 Å²	66	68 Å²	68	35%	0.353	34%	0.337	S	S	.	.			trans	-66.6	112.3	171.5	-84.8	-27.5	0	0	0	110.4	H50	D48-H50 PolarHBondContact O-CD2 3.49Å; D48-H50 PolarHBondContact O-N 2.89Å; D48-H50 PolarHBondContact O-NE2 3.29Å
49	H	85.1	Confident	64.7	Low	21 Å²	21	65.4 Å²	65.4	10%	0.097	32%	0.32	C	S	.	.			trans	-79.6	110.1	175.2	-82.4	-124.6	0	0	0	111.9	C26 C29 E47 F161	C26-H49 HydrophobicContact CB-CB 4.13Å; C26-H49 WeakPolarHBondContact SG-CB 3.45Å; C29-H49 PolarHBondContact SG-ND1 3.12Å; E47-H49 PolarHBondContact O-CD2 3.48Å; E47-H49 PolarHBondContact O-N 3.34Å; E47-H49 VanDerWaalsContact O-N 3.17Å; H49-F161 AromaticContact CE1-CD1 3.63Å; H49-F161 AromaticContact CE1-CD2 3.74Å; H49-F161 AromaticContact CE1-CE1 3.45Å; H49-F161 VanDerWaalsContact CE1-CE1 3.45Å; H49-F161 WeakPolarHBondContact CE1-CE1 3.35Å; H49-F161 AromaticContact CE1-CE2 3.54Å; H49-F161 AromaticContact CE1-CG 3.79Å; H49-F161 AromaticContact CE1-CZ 3.4Å; H49-F161 WeakPolarHBondContact CE1-CZ 3.37Å; H49-F161 AromaticContact ND1-CD1 3.53Å; H49-F161 AromaticContact ND1-CE1 3.64Å; H49-F161 AromaticContact ND1-CG 3.92Å; H49-F161 AromaticContact NE2-CD2 3.62Å; H49-F161 AromaticContact NE2-CE2 3.7Å; H49-F161 AromaticContact NE2-CG 3.89Å
50	H	87.6	Confident	66.3	Low	14 Å²	14	57.4 Å²	57.4	7%	0.065	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	128.7	-177.2	-62.1	-88.4	0	0	0	112.7	D48 A52 C159 L160 I310 F316 S319	D48-H50 PolarHBondContact O-CD2 3.49Å; D48-H50 PolarHBondContact O-N 2.89Å; D48-H50 PolarHBondContact O-NE2 3.29Å; H50-A52 PolarHBondContact O-N 3.27Å; H50-C159 CarbonylContact O-C 3.56Å; H50-C159 WeakPolarHBondContact O-CA 3.01Å; H50-L160 WeakPolarHBondContact CB-O 3.43Å; H50-L160 PolarHBondContact N-O 3.45Å; H50-L160 PolarHBondContact O-N 3.15Å; H50-I310 HydrophobicContact CB-CG2 4.08Å; H50-F316 HydrophobicContact CB-CB 4.23Å; H50-F316 HydrophobicContact CB-CD2 4.35Å; H50-F316 AromaticContact CD2-CD2 3.6Å; H50-F316 PolarHBondContact CE1-N 3.27Å; H50-F316 VanDerWaalsContact CE1-N 3.34Å; H50-S319 PolarHBondContact NE2-OG 3.3Å
51	P	88	Confident	67.2	Low	23 Å²	23	57.4 Å²	57.4	15%	0.149	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	123.3	174.8	-25.2	35	0	0	0	112.3	F28	F28-P51 HydrophobicContact CD1-CB 4.48Å; F28-P51 HydrophobicContact CD1-CG 3.86Å; F28-P51 HydrophobicContact CD2-CG 3.66Å; F28-P51 HydrophobicContact CE1-CG 3.73Å; F28-P51 HydrophobicContact CE2-CG 3.52Å; F28-P51 HydrophobicContact CG-CG 3.83Å; F28-P51 HydrophobicContact CZ-CG 3.56Å
52	A	90.8	Very high	67.9	Low	5 Å²	5	52.4 Å²	52.4	4%	0.041	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	138.6	-172.6	0	0	0	0	0	112.3	H50 G158 L160 F169 R309 I310	H50-A52 PolarHBondContact O-N 3.27Å; A52-G158 PolarHBondContact N-O 2.83Å; A52-G158 CarbonylContact O-C 3.6Å; A52-G158 WeakPolarHBondContact O-CA 3.39Å; A52-G158 PolarHBondContact O-N 3.37Å; A52-L160 HydrophobicContact CB-CB 3.67Å; A52-F169 HydrophobicContact CB-CD2 4.38Å; A52-F169 HydrophobicContact CB-CE2 4.15Å; A52-R309 CarbonylContact C-O 3.56Å; A52-R309 WeakPolarHBondContact CA-O 3.36Å; A52-I310 HydrophobicContact CB-CG1 4.07Å
53	E	89	Confident	68.6	Low	32 Å²	32	51.3 Å²	51.3	15%	0.15	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	111.8	172	170.5	-175	-152.9	0	0	107.8	C55 H155 I156 F308 R309	E53-C55 HydrophobicContact CG-CB 4.3Å; E53-C55 PolarHBondContact O-N 3.24Å; E53-C55 VanDerWaalsContact O-N 3.13Å; E53-H155 IonicContact OE1-CE1 2.96Å; E53-H155 IonicContact OE1-CG 3.76Å; E53-H155 IonicContact OE1-ND1 3.99Å; E53-H155 PolarHBondContact OE1-ND1 2.91Å; E53-I156 CarbonylContact C-O 3.58Å; E53-I156 WeakPolarHBondContact CA-O 3.35Å; E53-F308 CarbonylContact O-C 3.55Å; E53-F308 WeakPolarHBondContact O-CA 3.3Å; E53-R309 HydrophobicContact CB-CB 4.24Å; E53-R309 PolarHBondContact N-O 3.03Å; E53-R309 PolarHBondContact O-N 3.39Å; E53-R309 WeakPolarHBondContact OE2-CD 3.47Å; E53-R309 IonicContact OE2-CZ 2.92Å; E53-R309 IonicContact OE2-NE 3.26Å; E53-R309 IonicContact OE2-NH1 3.97Å; E53-R309 PolarHBondContact OE2-NH1 2.95Å
54	L	90	Very high	68.6	Low	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	102.4	171.8	174.1	60.1	0	0	0	107.4	I57 C154 H155 I156 F169 L182 L273 Y306 L307 F308	L54-I57 HydrophobicContact CD1-CD1 4.17Å; L54-I57 HydrophobicContact CD1-CG1 3.9Å; L54-I57 HydrophobicContact CD2-CD1 3.73Å; L54-I57 HydrophobicContact CD2-CG1 4.38Å; L54-I57 HydrophobicContact CG-CD1 4.02Å; L54-I57 HydrophobicContact CG-CG1 4.19Å; L54-C154 CarbonylContact O-C 3.48Å; L54-C154 PolarHBondContact O-SG 2.75Å; L54-C154 VanDerWaalsContact O-SG 3.39Å; L54-H155 WeakPolarHBondContact O-CA 3.44Å; L54-I156 HydrophobicContact CB-CB 4.29Å; L54-I156 HydrophobicContact CD2-CD1 4.29Å; L54-I156 PolarHBondContact N-O 2.96Å; L54-I156 PolarHBondContact O-N 2.97Å; L54-F169 HydrophobicContact CB-CE1 3.92Å; L54-F169 HydrophobicContact CB-CE2 4.02Å; L54-F169 HydrophobicContact CB-CZ 3.61Å; L54-F169 HydrophobicContact CD2-CD1 4.09Å; L54-F169 HydrophobicContact CD2-CE1 3.87Å; L54-F169 HydrophobicContact CD2-CZ 4.42Å; L54-L182 HydrophobicContact CD2-CD1 4.35Å; L54-L273 HydrophobicContact CD2-CD1 3.69Å; L54-Y306 HydrophobicContact CD1-CD1 4.26Å; L54-L307 CarbonylContact C-O 3.57Å; L54-L307 WeakPolarHBondContact CA-O 3.41Å; L54-L307 WeakPolarHBondContact CD1-O 3.2Å; L54-F308 HydrophobicContact CB-CD1 4.08Å; L54-F308 HydrophobicContact CB-CE1 4.14Å; L54-F308 HydrophobicContact CD1-CD1 3.97Å; L54-F308 HydrophobicContact CD1-CE1 3.63Å; L54-F308 HydrophobicContact CD1-CZ 4Å; L54-F308 HydrophobicContact CD2-CE1 4.47Å; L54-F308 HydrophobicContact CG-CE1 4.29Å
55	C	87.5	Confident	69	Low	8 Å²	8	55.7 Å²	55.7	5%	0.054	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	7.8	-162.8	62.8	0	0	0	0	114.5	E53 C154 L307	E53-C55 HydrophobicContact CG-CB 4.3Å; E53-C55 PolarHBondContact O-N 3.24Å; E53-C55 VanDerWaalsContact O-N 3.13Å; C55-C154 CarbonylContact C-O 3.57Å; C55-C154 WeakPolarHBondContact CA-O 3.49Å; C55-L307 PolarHBondContact N-O 2.9Å; C55-L307 PolarHBondContact SG-O 2.9Å; C55-L307 VanDerWaalsContact SG-O 3.33Å
56	G	83.5	Confident	69.1	Low	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.2	139.6	175	0	0	0	0	0	112.9	E152 L307	G56-E152 WeakPolarHBondContact CA-O 3.36Å; G56-L307 PolarHBondContact O-N 2.94Å
57	I	84.3	Confident	68.6	Low	9 Å²	9	51.9 Å²	51.9	5%	0.046	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	138	-178.6	-60.6	174.1	0	0	0	110.2	L54 L59 E152 L182 L305 Y306	L54-I57 HydrophobicContact CD1-CD1 4.17Å; L54-I57 HydrophobicContact CD1-CG1 3.9Å; L54-I57 HydrophobicContact CD2-CD1 3.73Å; L54-I57 HydrophobicContact CD2-CG1 4.38Å; L54-I57 HydrophobicContact CG-CD1 4.02Å; L54-I57 HydrophobicContact CG-CG1 4.19Å; I57-L59 HydrophobicContact CG2-CD2 3.94Å; I57-L59 HydrophobicContact CG2-CG 4.08Å; I57-E152 PolarHBondContact N-O 2.97Å; I57-E152 PolarHBondContact O-N 2.76Å; I57-L182 HydrophobicContact CD1-CD1 3.37Å; I57-L182 HydrophobicContact CD1-CD2 3.65Å; I57-L182 HydrophobicContact CD1-CG 3.96Å; I57-L305 WeakPolarHBondContact CA-O 3.1Å; I57-Y306 HydrophobicContact CD1-CD1 4.26Å; I57-Y306 HydrophobicContact CD1-CE1 4.36Å; I57-Y306 HydrophobicContact CG1-CD1 4Å; I57-Y306 HydrophobicContact CG1-CE1 4.42Å; I57-Y306 HydrophobicContact CG2-CD1 4.24Å; I57-Y306 HydrophobicContact CG2-CE1 4.03Å
58	W	80.5	Confident	67.6	Low	72 Å²	72	57.2 Å²	57.2	27%	0.273	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	105.3	170	-178.4	80.9	0	0	0	108.8	Y148 T149 L151 G304 L305	W58-Y148 AromaticContact CZ2-CD1 3.78Å; W58-Y148 HydrophobicContact CZ2-CD1 3.78Å; W58-Y148 HydrophobicContact CZ2-CE1 4.16Å; W58-T149 PolarHBondContact NE1-O 2.8Å; W58-L151 HydrophobicContact CB-CB 4.41Å; W58-L151 HydrophobicContact CB-CD1 4.15Å; W58-L151 HydrophobicContact CB-CG 4.05Å; W58-G304 CarbonylContact O-C 3.46Å; W58-G304 WeakPolarHBondContact O-CA 3.33Å; W58-L305 HydrophobicContact CB-CB 4.29Å; W58-L305 HydrophobicContact CD2-CD1 4.46Å; W58-L305 HydrophobicContact CE3-CB 4.41Å; W58-L305 HydrophobicContact CE3-CD1 3.77Å; W58-L305 HydrophobicContact CE3-CG 3.89Å; W58-L305 HydrophobicContact CZ3-CD1 4.26Å; W58-L305 HydrophobicContact CZ3-CG 4.43Å; W58-L305 PolarHBondContact N-O 2.87Å; W58-L305 PolarHBondContact O-N 2.93Å
59	L	72.7	Confident	66	Low	21 Å²	21	59.2 Å²	59.2	11%	0.11	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	143.1	172.8	-57.9	-179	0	0	0	109.2	I57 L62 L181 Y306	I57-L59 HydrophobicContact CG2-CD2 3.94Å; I57-L59 HydrophobicContact CG2-CG 4.08Å; L59-L62 HydrophobicContact CD1-CD2 4.18Å; L59-L181 HydrophobicContact CD1-CB 4.1Å; L59-L181 HydrophobicContact CD1-CD1 4.47Å; L59-Y306 WeakPolarHBondContact CD2-OH 3.11Å
60	G	62.2	Low	64.1	Low	19 Å²	19	61.7 Å²	61.7	20%	0.196	30%	0.302	C	S	.	.			trans	-66.2	-173.9	169.5	0	0	0	0	0	111.9	L62 E303	G60-L62 PolarHBondContact O-N 3.16Å; G60-E303 PolarHBondContact N-O 3.28Å
61	K	49.9	Very low	61.6	Low	132 Å²	132	71.8 Å²	71.8	57%	0.574	34%	0.339	S	S	*	.			trans	-54	104	-179.1	-66.2	-168.5	-178.8	-168.8	0	111.5	Y63 Q147	K61-Y63 PolarHBondContact O-N 3.43Å; K61-Q147 HydrophobicContact CD-CB 4.44Å
62	L	47.1	Very low	59.2	Low	39 Å²	39	77.4 Å²	77.4	20%	0.204	37%	0.367	C	S	.	.			trans	-55.4	134.6	167.4	-64.3	172.1	0	0	0	108.3	L59 G60 S64 I70 L181	L59-L62 HydrophobicContact CD1-CD2 4.18Å; G60-L62 PolarHBondContact O-N 3.16Å; L62-S64 PolarHBondContact O-N 3.43Å; L62-I70 HydrophobicContact CD1-CD1 4.04Å; L62-L181 HydrophobicContact CD1-CD2 3.91Å
63	Y	46.9	Very low	56.6	Low	180 Å²	180	85.5 Å²	85.5	71%	0.706	40%	0.404	S	S	*	.			trans	-64	138.9	177.6	-71.9	-85.7	0	0	0	109.2	K61 N65 Q66	K61-Y63 PolarHBondContact O-N 3.43Å; Y63-N65 PolarHBondContact O-N 3.1Å; Y63-Q66 WeakPolarHBondContact O-CB 3.49Å; Y63-Q66 PolarHBondContact O-N 2.95Å
64	S	38	Very low	53.7	Low	90 Å²	90	87.8 Å²	87.8	63%	0.629	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-20.5	-171.3	-48.8	0	0	0	0	114.8	L62 M67	L62-S64 PolarHBondContact O-N 3.43Å; S64-M67 PolarHBondContact O-N 3.41Å
65	N	42.6	Very low	50.9	Low	135 Å²	135	95.1 Å²	95.1	72%	0.722	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-43.6	173.9	-61.6	-2	0	0	0	111.4	Y63 M67 K68	Y63-N65 PolarHBondContact O-N 3.1Å; N65-M67 VanDerWaalsContact C-N 3.35Å; N65-M67 PolarHBondContact O-N 3.06Å; N65-K68 PolarHBondContact O-N 3.15Å
66	Q	45.7	Very low	48.3	Very low	79 Å²	79	104.2 Å²	104.2	37%	0.369	51%	0.514	S	S	.	.	H	α-helix	trans	-66.2	-36.9	176.1	-67.1	172.6	-41.2	0	0	111.3	Y63 K68 E69 I70	Y63-Q66 WeakPolarHBondContact O-CB 3.49Å; Y63-Q66 PolarHBondContact O-N 2.95Å; Q66-K68 PolarHBondContact O-N 3.04Å; Q66-K68 VanDerWaalsContact O-N 3.12Å; Q66-E69 PolarHBondContact O-N 2.86Å; Q66-I70 WeakPolarHBondContact O-CG1 3.49Å
67	M	39.8	Very low	45.7	Very low	91 Å²	91	115.2 Å²	115.2	45%	0.448	56%	0.555	S	S	.	*	H	α-helix	trans	-61.7	-18.5	176.7	-84.5	-166.3	168.6	0	0	114.7	S64 N65	S64-M67 PolarHBondContact O-N 3.41Å; N65-M67 VanDerWaalsContact C-N 3.35Å; N65-M67 PolarHBondContact O-N 3.06Å
68	K	37.1	Very low	43.2	Very low	165 Å²	165	119 Å²	119	72%	0.717	59%	0.588	S	S	*	*	H	α-helix	trans	-76.4	-37.2	178.5	-78.4	-172.5	172	-176.4	0	113.2	N65 Q66	N65-K68 PolarHBondContact O-N 3.15Å; Q66-K68 PolarHBondContact O-N 3.04Å; Q66-K68 VanDerWaalsContact O-N 3.12Å
69	E	37.7	Very low	40.9	Very low	108 Å²	108	124.1 Å²	124.1	51%	0.505	62%	0.62	S	S	.	*	H	α-helix	trans	-75.6	-34.1	179.3	-67.8	172.4	109	0	0	112.2	Q66 R71 L72 Q185	Q66-E69 PolarHBondContact O-N 2.86Å; E69-R71 PolarHBondContact O-N 3.12Å; E69-L72 PolarHBondContact O-N 3.47Å; E69-Q185 PolarHBondContact OE1-NE2 2.87Å; E69-Q185 PolarHBondContact OE2-NE2 3.48Å
70	I	45	Very low	38.7	Very low	73 Å²	73	128.4 Å²	128.4	37%	0.374	65%	0.651	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58.1	-20.6	-178.6	-64.3	173.5	0	0	0	112.8	L62 Q66 F180 L181	L62-I70 HydrophobicContact CD1-CD1 4.04Å; Q66-I70 WeakPolarHBondContact O-CG1 3.49Å; I70-F180 HydrophobicContact CB-CE2 4.46Å; I70-F180 HydrophobicContact CD1-CE2 4.04Å; I70-F180 HydrophobicContact CG1-CE2 3.84Å; I70-F180 HydrophobicContact CG2-CE2 3.93Å; I70-F180 HydrophobicContact CG2-CZ 3.82Å; I70-L181 HydrophobicContact CD1-CD2 4.13Å
71	R	35.2	Very low	37.2	Very low	226 Å²	226	131.8 Å²	131.8	85%	0.853	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	-3.4	179.3	-74.5	-176.2	170	173.4	-3	115.6	E69	E69-R71 PolarHBondContact O-N 3.12Å
72	L	38.6	Very low	36.3	Very low	141 Å²	141	130.2 Å²	130.2	74%	0.738	68%	0.684	S	S	*	*	S	Bend	trans	-104.2	-7.9	-170.1	-71.4	171	0	0	0	116.1	E69	E69-L72 PolarHBondContact O-N 3.47Å
73	H	35.2	Very low	35.4	Very low	176 Å²	176	138 Å²	138	82%	0.815	72%	0.719	S	S	*	*			trans	-112.4	68.9	173.1	-84.9	-75.6	0	0	0	112.4	D75	H73-D75 PolarHBondContact O-N 2.85Å; H73-D75 VanDerWaalsContact O-N 3.1Å
74	G	28	Very low	34.7	Very low	79 Å²	79	134.1 Å²	134.1	81%	0.814	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	78.5	176.6	0	0	0	0	0	113.6
75	D	31.2	Very low	34.2	Very low	154 Å²	154	138.4 Å²	138.4	82%	0.824	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.7	-8.1	168.7	-115.4	-31.2	0	0	0	114.4	H73 R77	H73-D75 PolarHBondContact O-N 2.85Å; H73-D75 VanDerWaalsContact O-N 3.1Å; D75-R77 PolarHBondContact O-N 3.4Å
76	F	33.6	Very low	33.5	Very low	200 Å²	200	137.6 Å²	137.6	88%	0.877	73%	0.731	S	S	*	*			trans	-77.2	95.2	168	-85.2	-86.3	0	0	0	110.3	A78	F76-A78 PolarHBondContact O-N 2.72Å
77	R	29.1	Very low	32.8	Very low	230 Å²	230	138.5 Å²	138.5	87%	0.868	75%	0.752	S	S	*	*			trans	-56.9	101.8	159.8	-79.7	-172.3	174.2	-162.4	-1	109.1	D75 L79	D75-R77 PolarHBondContact O-N 3.4Å; R77-L79 PolarHBondContact O-N 2.75Å
78	A	31.7	Very low	32.2	Very low	89 Å²	89	143.2 Å²	143.2	74%	0.736	77%	0.773	S	S	*	*			trans	-52.5	139.1	157.3	0	0	0	0	0	108.6	F76 S80	F76-A78 PolarHBondContact O-N 2.72Å; A78-S80 PolarHBondContact O-N 3.23Å
79	L	31.2	Very low	31.9	Very low	180 Å²	180	141.7 Å²	141.7	94%	0.942	78%	0.778	S	S	*	*			trans	-59.8	110.2	-176.9	-84.3	160.8	0	0	0	109.8	R77 A81	R77-L79 PolarHBondContact O-N 2.75Å; L79-A81 PolarHBondContact O-N 3.03Å
80	S	26.8	Very low	31.6	Very low	110 Å²	110	146.2 Å²	146.2	77%	0.769	80%	0.799	S	S	*	*			trans	-73.8	84.5	-170.6	55.8	0	0	0	0	111.6	A78 S82	A78-S80 PolarHBondContact O-N 3.23Å; S80-S82 PolarHBondContact O-N 3.35Å
81	A	30.9	Very low	30.9	Very low	91 Å²	91	145.4 Å²	145.4	75%	0.752	81%	0.808	S	S	*	*			trans	-69.6	92	169	0	0	0	0	0	110.1	L79	L79-A81 PolarHBondContact O-N 3.03Å
82	S	30.7	Very low	30.5	Very low	99 Å²	99	141.9 Å²	141.9	69%	0.692	81%	0.806	S	S	*	*			trans	45.9	80.9	163	57.6	0	0	0	0	116.9	S80 S84	S80-S82 PolarHBondContact O-N 3.35Å; S82-S84 PolarHBondContact O-N 3.05Å
83	Q	28.8	Very low	30.2	Very low	202 Å²	202	144.7 Å²	144.7	94%	0.944	81%	0.813	S	S	*	*			trans	-77.1	96.4	151.8	-174.2	178.1	35	0	0	108.1
84	S	32.4	Very low	30	Very low	99 Å²	99	144.2 Å²	144.2	69%	0.692	81%	0.811	S	S	*	*			trans	-108.1	138.8	177.3	55.3	0	0	0	0	112	S82	S82-S84 PolarHBondContact O-N 3.05Å
85	H	27.9	Very low	30.1	Very low	180 Å²	180	146.2 Å²	146.2	83%	0.833	81%	0.813	S	S	*	*			trans	-47.9	157.3	171.7	-51.2	-88.5	0	0	0	112.4
86	C	26.8	Very low	30.2	Very low	117 Å²	117	145.9 Å²	145.9	79%	0.791	82%	0.816	S	S	*	*			cis	-139.6	135.6	34.7	-69	0	0	0	0	111.1
87	A	30.3	Very low	30	Very low	98 Å²	98	139.6 Å²	139.6	81%	0.81	81%	0.808	S	S	*	*				87.3	148	86.6	0	0	0	0	0	113.7
88	Q	28.2	Very low	30	Very low	191 Å²	191	133.8 Å²	133.8	89%	0.893	80%	0.802	S	S	*	*			trans	-78.4	136.6	-175.7	-64.8	161.7	-57.5	0	0	111.6
89	T	31.3	Very low	30	Very low	132 Å²	132	135 Å²	135	81%	0.81	80%	0.803	S	S	*	*			trans	-140.7	109.6	152.6	-46.7	0	0	0	0	108.6	G91	T89-G91 PolarHBondContact O-N 3.5Å
90	E	29.7	Very low	29.7	Very low	204 Å²	204	133.6 Å²	133.6	95%	0.953	80%	0.795	S	S	*	*			trans	-71.9	111.4	161.8	-66.1	-179.3	146.1	0	0	107
91	G	31.2	Very low	29.9	Very low	55 Å²	55	134.6 Å²	134.6	57%	0.567	80%	0.796	S	S	*	*			trans	-157	101.5	-170.7	0	0	0	0	0	111.1	T89 F93	T89-G91 PolarHBondContact O-N 3.5Å; G91-F93 PolarHBondContact O-N 2.92Å
92	N	27	Very low	29.7	Very low	152 Å²	152	135.2 Å²	135.2	81%	0.813	79%	0.791	S	S	*	*			trans	-67.2	117.8	-178.3	-171.1	29.8	0	0	0	110.7
93	F	31.9	Very low	29.6	Very low	200 Å²	200	138 Å²	138	88%	0.877	80%	0.797	S	S	*	*			trans	-138.5	133.3	171.2	-99.6	-80.4	0	0	0	110.6	G91	G91-F93 PolarHBondContact O-N 2.92Å
94	E	32	Very low	29.7	Very low	167 Å²	167	134.3 Å²	134.3	78%	0.78	79%	0.791	S	S	*	*			trans	-89.4	149.7	-163.3	-61.4	166.1	111.7	0	0	113.5
95	S	29.2	Very low	29.6	Very low	121 Å²	121	138.5 Å²	138.5	85%	0.846	80%	0.797	S	S	*	*			trans	42.2	78.5	146.1	-176.9	0	0	0	0	118.4
96	V	33.8	Very low	29.5	Very low	147 Å²	147	142.5 Å²	142.5	89%	0.891	80%	0.804	S	S	*	*			trans	-117.4	124.4	149.3	-176.7	0	0	0	0	108.7
97	G	28.7	Very low	29.5	Very low	68 Å²	68	141.5 Å²	141.5	70%	0.701	80%	0.799	S	S	*	*			trans	-67	137.6	-162.1	0	0	0	0	0	115.4
98	S	30.3	Very low	29.2	Very low	107 Å²	107	142.9 Å²	142.9	75%	0.748	80%	0.801	S	S	*	*			trans	-58.4	134.9	169.6	53.6	0	0	0	0	111.7	L100	S98-L100 PolarHBondContact O-N 2.84Å
99	P	30.1	Very low	29.1	Very low	116 Å²	116	138.2 Å²	138.2	75%	0.753	80%	0.795	S	S	*	*			trans	-68.6	106.2	178.7	27.5	-33.8	0	0	0	111	V101	P99-V101 PolarHBondContact O-N 2.9Å
100	L	26.4	Very low	29.1	Very low	150 Å²	150	138 Å²	138	79%	0.785	80%	0.796	S	S	*	*			trans	-69.1	87.6	176.1	-175.1	76.4	0	0	0	110.7	S98 T102	S98-L100 PolarHBondContact O-N 2.84Å; L100-T102 HydrophobicContact CD2-CG2 3.97Å; L100-T102 HydrophobicContact CG-CG2 4.11Å; L100-T102 PolarHBondContact O-N 2.92Å
101	V	29.6	Very low	29	Very low	131 Å²	131	134 Å²	134	79%	0.794	79%	0.786	S	S	*	*			trans	-74.3	78.8	176	-173.4	0	0	0	0	110	P99 L103	P99-V101 PolarHBondContact O-N 2.9Å; V101-L103 PolarHBondContact O-N 2.73Å
102	T	26.8	Very low	29	Very low	104 Å²	104	143.8 Å²	143.8	64%	0.638	81%	0.806	S	S	*	*			trans	-59.1	129.1	170	46.5	0	0	0	0	110.8	L100	L100-T102 HydrophobicContact CD2-CG2 3.97Å; L100-T102 HydrophobicContact CG-CG2 4.11Å; L100-T102 PolarHBondContact O-N 2.92Å
103	L	29.8	Very low	29.4	Very low	158 Å²	158	139.6 Å²	139.6	83%	0.827	79%	0.788	S	S	*	*			trans	-56.8	133.7	171.8	-71.2	169.3	0	0	0	110.2	V101 K105	V101-L103 PolarHBondContact O-N 2.73Å; L103-K105 PolarHBondContact O-N 3.39Å
104	P	30.2	Very low	29.3	Very low	124 Å²	124	137.4 Å²	137.4	81%	0.805	78%	0.78	S	S	*	*			trans	-57.4	113.7	174.5	-25.9	35	0	0	0	111.2
105	K	29.6	Very low	29.2	Very low	187 Å²	187	135.6 Å²	135.6	81%	0.813	78%	0.78	S	S	*	*			trans	-59.6	144.3	173.8	-74.5	179.9	176.3	175.4	0	109.7	L103 S107	L103-K105 PolarHBondContact O-N 3.39Å; K105-S107 PolarHBondContact O-N 2.8Å; K105-S107 PolarHBondContact O-OG 3.43Å
106	R	27.6	Very low	29.3	Very low	263 Å²	263	132.2 Å²	132.2	99%	0.992	76%	0.759	S	S	*	*			trans	-65	97.4	175.2	-69.8	-175.8	175.5	-158.4	0	110.3
107	S	26.1	Very low	29.2	Very low	97 Å²	97	128.8 Å²	128.8	68%	0.678	74%	0.739	S	S	*	*			trans	-139.5	102.2	177.7	59	0	0	0	0	113	K105	K105-S107 PolarHBondContact O-N 2.8Å; K105-S107 PolarHBondContact O-OG 3.43Å
108	C	24.9	Very low	29.4	Very low	127 Å²	127	133.4 Å²	133.4	86%	0.858	75%	0.747	S	S	*	*			trans	63.3	161.5	160.6	-60.2	0	0	0	0	117.9	P110	C108-P110 WeakPolarHBondContact O-CD 3.11Å
109	A	25.6	Very low	29.6	Very low	93 Å²	93	135.2 Å²	135.2	77%	0.769	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-76.8	122	-170.2	0	0	0	0	0	112.6
110	P	30.4	Very low	29.7	Very low	126 Å²	126	139.1 Å²	139.1	82%	0.818	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-67.5	138.3	168.8	-17.6	32.6	0	0	0	110.7	C108	C108-P110 WeakPolarHBondContact O-CD 3.11Å
111	T	28.3	Very low	30	Very low	121 Å²	121	139.8 Å²	139.8	74%	0.742	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-71.1	153.1	-177.5	43	0	0	0	0	112.9	S113	T111-S113 PolarHBondContact O-N 3.47Å
112	R	31.1	Very low	30.1	Very low	261 Å²	261	138.6 Å²	138.6	99%	0.985	74%	0.744	S	S	*	*	S	Bend	trans	-59.3	91.9	175.5	-72	174.5	168.6	172.3	-5.5	111.2
113	S	34.4	Very low	30.1	Very low	64 Å²	64	139 Å²	139	45%	0.448	74%	0.742	S	S	.	*			trans	-154.1	-71.6	175.9	176.7	0	0	0	0	112.8	T111 V115 A116	T111-S113 PolarHBondContact O-N 3.47Å; S113-V115 PolarHBondContact O-N 2.98Å; S113-V115 VanDerWaalsContact O-N 3.15Å; S113-A116 WeakPolarHBondContact O-CB 3.4Å; S113-A116 PolarHBondContact O-N 3.39Å; S113-A116 VanDerWaalsContact O-N 3.15Å
114	H	30.1	Very low	30.2	Very low	154 Å²	154	137.7 Å²	137.7	71%	0.713	74%	0.74	S	S	*	*	G	3₁₀ helix	trans	-71.4	-18.9	-154.4	-74.4	-94.6	0	0	0	117.1	A116	H114-A116 VanDerWaalsContact C-N 3.3Å
115	V	31.2	Very low	30.2	Very low	128 Å²	128	137.9 Å²	137.9	78%	0.776	74%	0.74	S	S	*	*	G	3₁₀ helix	trans	-77.5	-17.7	177.6	-173.9	0	0	0	0	112	S113	S113-V115 PolarHBondContact O-N 2.98Å; S113-V115 VanDerWaalsContact O-N 3.15Å
116	A	30.3	Very low	30.2	Very low	50 Å²	50	138.2 Å²	138.2	41%	0.413	74%	0.741	S	S	.	*	G	3₁₀ helix	trans	-79.2	-15.2	-178.5	0	0	0	0	0	114.2	S113 H114 R120	S113-A116 WeakPolarHBondContact O-CB 3.4Å; S113-A116 PolarHBondContact O-N 3.39Å; S113-A116 VanDerWaalsContact O-N 3.15Å; H114-A116 VanDerWaalsContact C-N 3.3Å; A116-R120 WeakPolarHBondContact O-CG 3.37Å
117	T	32.2	Very low	30.3	Very low	76 Å²	76	132.8 Å²	132.8	47%	0.466	73%	0.731	S	S	.	*	S	Bend	trans	-77.7	-39.8	-171.1	-43.2	0	0	0	0	112.6	L119 R120	T117-L119 PolarHBondContact O-N 2.76Å; T117-L119 VanDerWaalsContact O-N 3.16Å; T117-R120 PolarHBondContact O-N 2.83Å
118	L	32.2	Very low	30.4	Very low	164 Å²	164	135.9 Å²	135.9	86%	0.859	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	-8.4	179.4	-70.9	169.6	0	0	0	114.1
119	L	34.4	Very low	30.6	Very low	145 Å²	145	134.7 Å²	134.7	76%	0.759	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.7	8.7	-179.7	-84.3	160	0	0	0	113.7	T117	T117-L119 PolarHBondContact O-N 2.76Å; T117-L119 VanDerWaalsContact O-N 3.16Å
120	R	31.5	Very low	31	Very low	198 Å²	198	135 Å²	135	75%	0.747	72%	0.721	S	S	*	*	S	Bend	trans	-115.3	0.3	-172.3	-79.2	-178	170.7	-164.4	-3.3	116.4	A116 T117 S122	A116-R120 WeakPolarHBondContact O-CG 3.37Å; T117-R120 PolarHBondContact O-N 2.83Å; R120-S122 VanDerWaalsContact C-N 3.31Å; R120-S122 PolarHBondContact O-N 3.23Å
121	H	33.4	Very low	31.3	Very low	164 Å²	164	133.9 Å²	133.9	76%	0.759	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	16.2	-178.7	-73.6	-76.8	0	0	0	114.9
122	S	31.8	Very low	31.6	Very low	107 Å²	107	136.6 Å²	136.6	75%	0.748	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112	7.7	-173.7	-51.4	0	0	0	0	115.1	R120	R120-S122 VanDerWaalsContact C-N 3.31Å; R120-S122 PolarHBondContact O-N 3.23Å
123	D	26.9	Very low	31.6	Very low	112 Å²	112	128.1 Å²	128.1	60%	0.599	68%	0.683	S	S	*	*			trans	-124.4	80	176.9	-75.4	-47.9	0	0	0	111	K354	D123-K354 IonicContact OD1-NZ 3.87Å; D123-K354 PolarHBondContact OD1-NZ 2.75Å
124	T	31.6	Very low	31.5	Very low	130 Å²	130	132.8 Å²	132.8	80%	0.798	70%	0.696	S	S	*	*			trans	-164.8	140.6	146.6	2.3	0	0	0	0	112.8
125	T	30.4	Very low	31.7	Very low	129 Å²	129	131.4 Å²	131.4	79%	0.791	69%	0.688	S	S	*	*			trans	47.6	125.1	155.1	50.7	0	0	0	0	121.5	N127	T125-N127 PolarHBondContact O-N 3.05Å
126	K	29.2	Very low	31.6	Very low	194 Å²	194	129.2 Å²	129.2	84%	0.843	68%	0.678	S	S	*	*			trans	-34	117.1	156.9	-55.5	169.7	178.5	-179.5	0	112.8
127	N	29.3	Very low	31.6	Very low	148 Å²	148	131.8 Å²	131.8	79%	0.791	69%	0.689	S	S	*	*				169	137	129.8	-84.6	-18.6	0	0	0	113.1	T125	T125-N127 PolarHBondContact O-N 3.05Å
128	Q	28.8	Very low	31.6	Very low	163 Å²	163	135.2 Å²	135.2	76%	0.762	70%	0.701	S	S	*	*	S	Bend	trans	50.8	137.8	152.6	-58.6	-175.6	-1.9	0	0	123.2	T130	Q128-T130 PolarHBondContact O-N 2.88Å; Q128-T130 VanDerWaalsContact O-N 3.09Å
129	S	28.5	Very low	31.4	Very low	101 Å²	101	132.2 Å²	132.2	71%	0.706	69%	0.686	S	S	*	*			trans	66	-9.1	143.3	54.4	0	0	0	0	124.6	L131	S129-L131 PolarHBondContact O-N 2.92Å
130	T	34.4	Very low	31.3	Very low	101 Å²	101	131.8 Å²	131.8	62%	0.62	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	3.9	-172.7	52.9	0	0	0	0	118.1	Q128 K132 D133	Q128-T130 PolarHBondContact O-N 2.88Å; Q128-T130 VanDerWaalsContact O-N 3.09Å; T130-K132 VanDerWaalsContact C-N 3.32Å; T130-K132 PolarHBondContact O-N 3.2Å; T130-D133 PolarHBondContact O-N 3.03Å
131	L	36.6	Very low	31	Very low	101 Å²	101	131.5 Å²	131.5	53%	0.529	68%	0.682	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.5	-18	176.5	-114.7	175.8	0	0	0	114	S129 F135	S129-L131 PolarHBondContact O-N 2.92Å; L131-F135 WeakPolarHBondContact O-CD2 3.37Å
132	K	34.7	Very low	31.1	Very low	178 Å²	178	130.7 Å²	130.7	77%	0.774	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	-39.1	171.1	-87.3	-172.7	170.7	-175.8	0	111.7	T130 F134 F135	T130-K132 VanDerWaalsContact C-N 3.32Å; T130-K132 PolarHBondContact O-N 3.2Å; K132-F134 VanDerWaalsContact C-N 3.27Å; K132-F134 PolarHBondContact O-N 3.3Å; K132-F135 PolarHBondContact O-N 3.38Å
133	D	31.7	Very low	30.9	Very low	83 Å²	83	131 Å²	131	44%	0.444	69%	0.686	S	S	.	*	H	α-helix	trans	-74.2	-20.8	-172.3	-50.1	-59.1	0	0	0	112.8	T130 F135 S136 T137	T130-D133 PolarHBondContact O-N 3.03Å; D133-F135 PolarHBondContact O-N 2.94Å; D133-S136 WeakPolarHBondContact CA-OG 3.44Å; D133-S136 PolarHBondContact O-N 3.46Å; D133-S136 PolarHBondContact O-OG 3.28Å; D133-T137 WeakPolarHBondContact O-CB 3.44Å; D133-T137 WeakPolarHBondContact O-CG2 3.39Å; D133-T137 PolarHBondContact O-N 3.19Å; D133-T137 PolarHBondContact O-OG1 3.35Å
134	F	33.1	Very low	31.2	Very low	162 Å²	162	131 Å²	131	71%	0.711	70%	0.695	S	S	*	*	H	α-helix	trans	-64.4	-20.8	171.9	-116.4	-82.7	0	0	0	114.1	K132	K132-F134 VanDerWaalsContact C-N 3.27Å; K132-F134 PolarHBondContact O-N 3.3Å
135	F	33.3	Very low	31	Very low	126 Å²	126	130.2 Å²	130.2	55%	0.553	69%	0.694	S	S	*	*	H	α-helix	trans	-96.9	-20.2	175.4	-70.3	-87.2	0	0	0	113.1	L131 K132 D133	L131-F135 WeakPolarHBondContact O-CD2 3.37Å; K132-F135 PolarHBondContact O-N 3.38Å; D133-F135 PolarHBondContact O-N 2.94Å
136	S	29.4	Very low	31	Very low	81 Å²	81	129.3 Å²	129.3	57%	0.566	69%	0.688	S	S	*	*	H	α-helix	trans	-93.3	-20.1	179.1	61.4	0	0	0	0	114.2	D133	D133-S136 WeakPolarHBondContact CA-OG 3.44Å; D133-S136 PolarHBondContact O-N 3.46Å; D133-S136 PolarHBondContact O-OG 3.28Å
137	T	31.3	Very low	31.3	Very low	104 Å²	104	125.6 Å²	125.6	64%	0.638	67%	0.674	S	S	*	*	S	Bend	trans	-91.8	-0.4	-176.5	51.6	0	0	0	0	114.8	D133 D139	D133-T137 WeakPolarHBondContact O-CB 3.44Å; D133-T137 WeakPolarHBondContact O-CG2 3.39Å; D133-T137 PolarHBondContact O-N 3.19Å; D133-T137 PolarHBondContact O-OG1 3.35Å; T137-D139 PolarHBondContact O-N 3.25Å
138	M	30.7	Very low	31.4	Very low	149 Å²	149	126.8 Å²	126.8	73%	0.734	67%	0.668	S	S	*	*			trans	-81.5	61.4	168.8	-159.8	166.2	-155.4	0	0	110.4	I140	M138-I140 WeakPolarHBondContact O-CG1 3.45Å; M138-I140 PolarHBondContact O-N 2.89Å
139	D	28.2	Very low	32	Very low	101 Å²	101	122.8 Å²	122.8	54%	0.54	66%	0.656	S	S	.	*			trans	-69.2	99.7	-173.1	-152.8	0.4	0	0	0	110	T137 R141	T137-D139 PolarHBondContact O-N 3.25Å; D139-R141 PolarHBondContact O-N 2.92Å; D139-R141 WeakPolarHBondContact OD1-CG 3.16Å; D139-R141 IonicContact OD1-CZ 3.8Å; D139-R141 IonicContact OD1-NE 2.83Å; D139-R141 PolarHBondContact OD1-NE 3.45Å; D139-R141 IonicContact OD1-NH2 3.83Å; D139-R141 PolarHBondContact OD1-NH2 3.3Å; D139-R141 IonicContact OD2-CZ 3.88Å; D139-R141 IonicContact OD2-NE 2.72Å; D139-R141 PolarHBondContact OD2-NE 3.28Å; D139-R141 IonicContact OD2-NH2 3.56Å; D139-R141 PolarHBondContact OD2-NH2 2.85Å
140	I	32.2	Very low	32.9	Very low	136 Å²	136	125.8 Å²	125.8	70%	0.697	66%	0.658	S	S	*	*			trans	-76.5	63.7	-176.8	-48.7	-176.3	0	0	0	110	M138	M138-I140 WeakPolarHBondContact O-CG1 3.45Å; M138-I140 PolarHBondContact O-N 2.89Å
141	R	26.5	Very low	33.8	Very low	192 Å²	192	124.5 Å²	124.5	73%	0.725	65%	0.647	S	S	*	*			trans	-114.4	78.6	178.2	-62.5	-171.7	-153.9	-153	8.2	111.3	D139	D139-R141 PolarHBondContact O-N 2.92Å; D139-R141 WeakPolarHBondContact OD1-CG 3.16Å; D139-R141 IonicContact OD1-CZ 3.8Å; D139-R141 IonicContact OD1-NE 2.83Å; D139-R141 PolarHBondContact OD1-NE 3.45Å; D139-R141 IonicContact OD1-NH2 3.83Å; D139-R141 PolarHBondContact OD1-NH2 3.3Å; D139-R141 IonicContact OD2-CZ 3.88Å; D139-R141 IonicContact OD2-NE 2.72Å; D139-R141 PolarHBondContact OD2-NE 3.28Å; D139-R141 IonicContact OD2-NH2 3.56Å; D139-R141 PolarHBondContact OD2-NH2 2.85Å
142	N	34.6	Very low	35	Very low	146 Å²	146	123.4 Å²	123.4	78%	0.781	64%	0.639	S	S	*	*			trans	-167.2	85.1	135.4	-95.6	-26.6	0	0	0	112.2	S144	N142-S144 PolarHBondContact O-N 3.15Å; N142-S144 VanDerWaalsContact O-N 3.15Å
143	S	27	Very low	36.5	Very low	114 Å²	114	117.3 Å²	117.3	80%	0.797	63%	0.627	S	S	*	*				38.4	67.8	122	49.2	0	0	0	0	118.2
144	S	32.9	Very low	38.4	Very low	113 Å²	113	113.8 Å²	113.8	79%	0.79	61%	0.609	S	S	*	*			trans	-131.7	131	132.7	50.9	0	0	0	0	108.6	N142	N142-S144 PolarHBondContact O-N 3.15Å; N142-S144 VanDerWaalsContact O-N 3.15Å
145	S	28.6	Very low	40.7	Very low	112 Å²	112	110.9 Å²	110.9	78%	0.783	60%	0.597	S	S	*	*			trans	-74.8	163.3	178.5	46.1	0	0	0	0	110.9
146	V	30.2	Very low	43.1	Very low	110 Å²	110	104.9 Å²	104.9	67%	0.667	57%	0.571	S	S	*	*	S	Bend	trans	87	116.6	173.5	-171	0	0	0	0	116.5
147	Q	34.7	Very low	45.8	Very low	116 Å²	116	105.1 Å²	105.1	54%	0.542	57%	0.566	S	S	.	*	S	Bend	trans	72.9	38.4	156.7	-70.2	172.5	15.2	0	0	120.4	K61	K61-Q147 HydrophobicContact CD-CB 4.44Å
148	Y	31.9	Very low	48.5	Very low	173 Å²	173	100.5 Å²	100.5	68%	0.678	54%	0.539	S	S	*	.			trans	-130.7	124.4	153.4	-61.7	-74	0	0	0	110.4	W58	W58-Y148 AromaticContact CZ2-CD1 3.78Å; W58-Y148 HydrophobicContact CZ2-CD1 3.78Å; W58-Y148 HydrophobicContact CZ2-CE1 4.16Å
149	T	41.7	Very low	51.4	Low	80 Å²	80	93.4 Å²	93.4	49%	0.491	50%	0.504	S	S	.	.			trans	-79.3	146.3	164	40.1	0	0	0	0	109.5	W58	W58-T149 PolarHBondContact NE1-O 2.8Å
150	E	47.9	Very low	54.4	Low	164 Å²	164	88.6 Å²	88.6	77%	0.766	48%	0.478	S	S	*	.			trans	-63.6	159.2	179.3	-64.9	169.7	167.2	0	0	111.2	E152	E150-E152 PolarHBondContact O-N 3.43Å
151	L	52.7	Low	57.1	Low	73 Å²	73	82.5 Å²	82.5	38%	0.382	45%	0.447	S	S	.	.			trans	-74	109.2	179.1	-171.2	153.6	0	0	0	108.7	W58 G153 L307	W58-L151 HydrophobicContact CB-CB 4.41Å; W58-L151 HydrophobicContact CB-CD1 4.15Å; W58-L151 HydrophobicContact CB-CG 4.05Å; L151-G153 PolarHBondContact O-N 3.4Å; L151-L307 HydrophobicContact CD1-CD1 4.4Å; L151-L307 HydrophobicContact CD2-CD1 4.49Å
152	E	62.4	Low	60.1	Low	78 Å²	78	74 Å²	74	36%	0.364	42%	0.416	S	S	.	.	B	Isolated β-bridge	trans	-71.9	116.1	-174.1	-168.4	-178.5	175.4	0	0	110	G56 I57 E150 C154 P179	G56-E152 WeakPolarHBondContact CA-O 3.36Å; I57-E152 PolarHBondContact N-O 2.97Å; I57-E152 PolarHBondContact O-N 2.76Å; E150-E152 PolarHBondContact O-N 3.43Å; E152-C154 PolarHBondContact O-N 3.4Å; E152-P179 WeakPolarHBondContact OE1-CB 3.34Å; E152-P179 WeakPolarHBondContact OE1-CG 3.43Å
153	G	65.9	Low	62.5	Low	51 Å²	51	69 Å²	69	53%	0.526	39%	0.388	S	S	.	.			trans	-74.1	61.5	176.5	0	0	0	0	0	112.7	L151	L151-G153 PolarHBondContact O-N 3.4Å
154	C	70.7	Confident	65.1	Low	8 Å²	8	71 Å²	71	5%	0.054	39%	0.385	C	S	.	.			trans	-67.9	149.3	170.6	69.1	0	0	0	0	110.7	L54 C55 E152 I156 P179	L54-C154 CarbonylContact O-C 3.48Å; L54-C154 PolarHBondContact O-SG 2.75Å; L54-C154 VanDerWaalsContact O-SG 3.39Å; C55-C154 CarbonylContact C-O 3.57Å; C55-C154 WeakPolarHBondContact CA-O 3.49Å; E152-C154 PolarHBondContact O-N 3.4Å; C154-I156 HydrophobicContact CB-CD1 4.48Å; C154-I156 HydrophobicContact CB-CG1 4.24Å; C154-P179 HydrophobicContact CB-CG 3.79Å
155	H	81.5	Confident	67.5	Low	101 Å²	101	66.4 Å²	66.4	47%	0.468	36%	0.355	S	S	.	.			trans	-131	73.3	174.3	-80.9	-94.8	0	0	0	110	E53 L54	E53-H155 IonicContact OE1-CE1 2.96Å; E53-H155 IonicContact OE1-CG 3.76Å; E53-H155 IonicContact OE1-ND1 3.99Å; E53-H155 PolarHBondContact OE1-ND1 2.91Å; L54-H155 WeakPolarHBondContact O-CA 3.44Å
156	I	84.1	Confident	70.3	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	113.8	-175.6	-46.9	178.8	0	0	0	109.1	E53 L54 C154 F169 A171 V178 L182 L271	E53-I156 CarbonylContact C-O 3.58Å; E53-I156 WeakPolarHBondContact CA-O 3.35Å; L54-I156 HydrophobicContact CB-CB 4.29Å; L54-I156 HydrophobicContact CD2-CD1 4.29Å; L54-I156 PolarHBondContact N-O 2.96Å; L54-I156 PolarHBondContact O-N 2.97Å; C154-I156 HydrophobicContact CB-CD1 4.48Å; C154-I156 HydrophobicContact CB-CG1 4.24Å; I156-F169 HydrophobicContact CB-CZ 4.49Å; I156-F169 HydrophobicContact CG2-CE1 4.25Å; I156-F169 HydrophobicContact CG2-CZ 4.37Å; I156-F169 WeakPolarHBondContact O-CZ 3.49Å; I156-A171 HydrophobicContact CG2-CB 3.59Å; I156-V178 HydrophobicContact CD1-CG1 4.47Å; I156-V178 HydrophobicContact CD1-CG2 4.42Å; I156-L182 HydrophobicContact CD1-CD1 3.55Å; I156-L271 HydrophobicContact CD1-CD2 4.12Å
157	N	86.7	Confident	73.3	Confident	86 Å²	86	57.7 Å²	57.7	46%	0.46	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	137.4	173.5	-71.2	-60.9	0	0	0	110.6	A171 V172 S173	N157-A171 CarbonylContact O-C 3.54Å; N157-A171 WeakPolarHBondContact O-CA 3.44Å; N157-V172 PolarHBondContact O-N 2.92Å; N157-S173 PolarHBondContact N-OG 2.85Å; N157-S173 PolarHBondContact O-N 2.99Å
158	G	87.7	Confident	75.9	Confident	7 Å²	7	52.2 Å²	52.2	7%	0.072	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.8	-168.6	-170.4	0	0	0	0	0	113.9	A52 Q170	A52-G158 PolarHBondContact N-O 2.83Å; A52-G158 CarbonylContact O-C 3.6Å; A52-G158 WeakPolarHBondContact O-CA 3.39Å; A52-G158 PolarHBondContact O-N 3.37Å; G158-Q170 CarbonylContact C-O 3.49Å; G158-Q170 WeakPolarHBondContact CA-O 3.3Å
159	C	90.3	Very high	78.7	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	143.4	167.4	-68.6	0	0	0	0	109.4	F28 C29 H50 F161 F169 Q170	F28-C159 WeakPolarHBondContact CB-SG 3.47Å; C29-C159 HydrophobicContact CB-CB 4.14Å; H50-C159 CarbonylContact O-C 3.56Å; H50-C159 WeakPolarHBondContact O-CA 3.01Å; C159-F161 HydrophobicContact CB-CD1 4.34Å; C159-F169 CarbonylContact O-C 3.59Å; C159-F169 VanDerWaalsContact O-CA 3.31Å; C159-F169 WeakPolarHBondContact O-CA 3.39Å; C159-F169 WeakPolarHBondContact O-CD2 3.16Å; C159-Q170 PolarHBondContact N-O 2.86Å; C159-Q170 PolarHBondContact O-N 2.77Å
160	L	91.4	Very high	80.9	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	128.9	174	-167.3	75.7	0	0	0	109.1	H50 A52 L167 V168 F169 F291 F308 I310 F316	H50-L160 WeakPolarHBondContact CB-O 3.43Å; H50-L160 PolarHBondContact N-O 3.45Å; H50-L160 PolarHBondContact O-N 3.15Å; A52-L160 HydrophobicContact CB-CB 3.67Å; L160-L167 HydrophobicContact CD1-CD1 3.79Å; L160-L167 HydrophobicContact CD1-CG 4.17Å; L160-L167 HydrophobicContact CD2-CD1 4.25Å; L160-L167 HydrophobicContact CG-CD1 3.87Å; L160-V168 WeakPolarHBondContact CA-O 3.49Å; L160-F169 HydrophobicContact CD1-CB 3.73Å; L160-F169 HydrophobicContact CD1-CD2 4.19Å; L160-F169 HydrophobicContact CD1-CG 4.46Å; L160-F291 HydrophobicContact CD2-CD1 3.66Å; L160-F291 HydrophobicContact CD2-CE1 3.88Å; L160-F308 HydrophobicContact CD1-CD1 4.17Å; L160-F308 HydrophobicContact CD1-CE1 3.93Å; L160-F308 HydrophobicContact CD1-CE2 4.47Å; L160-F308 HydrophobicContact CD1-CZ 4.09Å; L160-F308 HydrophobicContact CD2-CB 4.41Å; L160-F308 HydrophobicContact CD2-CD1 4.49Å; L160-F308 HydrophobicContact CD2-CD2 4.36Å; L160-F308 HydrophobicContact CD2-CG 4.18Å; L160-I310 HydrophobicContact CD2-CD1 3.54Å; L160-I310 HydrophobicContact CD2-CG1 4.47Å; L160-F316 HydrophobicContact CD2-CE1 3.83Å; L160-F316 HydrophobicContact CD2-CE2 3.79Å; L160-F316 HydrophobicContact CD2-CZ 3.41Å; L160-F316 VanDerWaalsContact CD2-CZ 3.41Å; L160-F316 HydrophobicContact CG-CE2 3.98Å; L160-F316 HydrophobicContact CG-CZ 4.03Å
161	F	90.4	Very high	82.7	Confident	8 Å²	8	33.1 Å²	33.1	4%	0.035	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	171.2	-175.2	54.3	-75.6	0	0	0	110.6	H49 C159 E163 V168 Q170	H49-F161 AromaticContact CE1-CD1 3.63Å; H49-F161 AromaticContact CE1-CD2 3.74Å; H49-F161 AromaticContact CE1-CE1 3.45Å; H49-F161 VanDerWaalsContact CE1-CE1 3.45Å; H49-F161 WeakPolarHBondContact CE1-CE1 3.35Å; H49-F161 AromaticContact CE1-CE2 3.54Å; H49-F161 AromaticContact CE1-CG 3.79Å; H49-F161 AromaticContact CE1-CZ 3.4Å; H49-F161 WeakPolarHBondContact CE1-CZ 3.37Å; H49-F161 AromaticContact ND1-CD1 3.53Å; H49-F161 AromaticContact ND1-CE1 3.64Å; H49-F161 AromaticContact ND1-CG 3.92Å; H49-F161 AromaticContact NE2-CD2 3.62Å; H49-F161 AromaticContact NE2-CE2 3.7Å; H49-F161 AromaticContact NE2-CG 3.89Å; C159-F161 HydrophobicContact CB-CD1 4.34Å; F161-E163 HydrophobicContact CD2-CB 4Å; F161-E163 HydrophobicContact CE2-CB 4.02Å; F161-E163 HydrophobicContact CE2-CG 4.3Å; F161-E163 WeakPolarHBondContact CE2-OE2 3.47Å; F161-V168 HydrophobicContact CD1-CB 4.42Å; F161-V168 HydrophobicContact CD2-CB 4.18Å; F161-V168 HydrophobicContact CE1-CB 4.14Å; F161-V168 HydrophobicContact CE1-CG1 3.8Å; F161-V168 HydrophobicContact CE2-CB 3.88Å; F161-V168 HydrophobicContact CE2-CG1 3.9Å; F161-V168 HydrophobicContact CE2-CG2 4.44Å; F161-V168 HydrophobicContact CG-CB 4.44Å; F161-V168 HydrophobicContact CZ-CB 3.86Å; F161-V168 HydrophobicContact CZ-CG1 3.43Å; F161-V168 VanDerWaalsContact CZ-CG1 3.43Å; F161-V168 PolarHBondContact N-O 3.44Å; F161-V168 PolarHBondContact O-N 2.84Å; F161-Q170 HydrophobicContact CE1-CB 4.04Å
162	V	89.1	Confident	83.8	Confident	14 Å²	14	33.6 Å²	33.6	9%	0.085	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	131.5	173.3	-176.6	0	0	0	0	108.5	N166 L167 L277 F320 C323	V162-N166 CarbonylContact C-O 3.57Å; V162-N166 VanDerWaalsContact CA-O 3.3Å; V162-N166 WeakPolarHBondContact CA-O 3.03Å; V162-N166 WeakPolarHBondContact CG1-O 3.2Å; V162-L167 HydrophobicContact CG2-CD1 4.41Å; V162-L277 HydrophobicContact CG1-CD1 4.17Å; V162-F320 HydrophobicContact CG2-CD2 3.66Å; V162-F320 HydrophobicContact CG2-CE2 4.31Å; V162-C323 HydrophobicContact CB-CB 4.33Å; V162-C323 HydrophobicContact CG1-CB 3.79Å; V162-C323 HydrophobicContact CG2-CB 4.38Å
163	E	84	Confident	83.8	Confident	40 Å²	40	31.2 Å²	31.2	19%	0.187	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	124.2	-169.7	-165.6	-147.5	131.7	0	0	109.4	F161 G165 N166 V168 R272	F161-E163 HydrophobicContact CD2-CB 4Å; F161-E163 HydrophobicContact CE2-CB 4.02Å; F161-E163 HydrophobicContact CE2-CG 4.3Å; F161-E163 WeakPolarHBondContact CE2-OE2 3.47Å; E163-G165 PolarHBondContact O-N 3.39Å; E163-N166 PolarHBondContact N-O 3.11Å; E163-N166 WeakPolarHBondContact O-CB 3.37Å; E163-N166 PolarHBondContact O-N 3.45Å; E163-N166 PolarHBondContact O-ND2 3.3Å; E163-N166 VanDerWaalsContact O-ND2 3.09Å; E163-V168 HydrophobicContact CB-CG2 3.92Å; E163-R272 IonicContact OE1-NH2 3.71Å; E163-R272 PolarHBondContact OE1-NH2 3.45Å; E163-R272 IonicContact OE2-CZ 3.05Å; E163-R272 IonicContact OE2-NE 2.76Å; E163-R272 IonicContact OE2-NH2 3.5Å; E163-R272 PolarHBondContact OE2-NH2 2.83Å
164	H	82.6	Confident	83.4	Confident	158 Å²	158	36.9 Å²	36.9	73%	0.731	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.3	34.9	178.2	-58.6	109.1	0	0	0	114.6	N166	H164-N166 PolarHBondContact O-ND2 2.67Å; H164-N166 VanDerWaalsContact O-ND2 3.12Å
165	G	83.5	Confident	82.8	Confident	15 Å²	15	41 Å²	41	16%	0.155	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.5	12.8	-177.7	0	0	0	0	0	115.9	E163 L277 H327	E163-G165 PolarHBondContact O-N 3.39Å; G165-L277 VanDerWaalsContact O-CG 3.31Å; G165-L277 WeakPolarHBondContact O-CG 3.48Å; G165-L277 PolarHBondContact O-N 2.78Å; G165-H327 VanDerWaalsContact CA-CD2 3.47Å; G165-H327 WeakPolarHBondContact CA-CD2 3.18Å
166	N	87.7	Confident	81.3	Confident	39 Å²	39	40.4 Å²	40.4	21%	0.209	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	140.9	175.9	-49.5	-85.5	0	0	0	110.6	V162 E163 H164 V168 S274 W275 P276	V162-N166 CarbonylContact C-O 3.57Å; V162-N166 VanDerWaalsContact CA-O 3.3Å; V162-N166 WeakPolarHBondContact CA-O 3.03Å; V162-N166 WeakPolarHBondContact CG1-O 3.2Å; E163-N166 PolarHBondContact N-O 3.11Å; E163-N166 WeakPolarHBondContact O-CB 3.37Å; E163-N166 PolarHBondContact O-N 3.45Å; E163-N166 PolarHBondContact O-ND2 3.3Å; E163-N166 VanDerWaalsContact O-ND2 3.09Å; H164-N166 PolarHBondContact O-ND2 2.67Å; H164-N166 VanDerWaalsContact O-ND2 3.12Å; N166-V168 HydrophobicContact CB-CG2 4.11Å; N166-S274 WeakPolarHBondContact CB-OG 3.37Å; N166-W275 CarbonylContact C-O 3.57Å; N166-W275 WeakPolarHBondContact CA-O 3.39Å; N166-P276 VanDerWaalsContact OD1-CA 3.25Å; N166-P276 WeakPolarHBondContact OD1-CA 3.38Å; N166-P276 WeakPolarHBondContact OD1-CB 3.34Å; N166-P276 WeakPolarHBondContact OD1-CG 3.31Å
167	L	91.9	Very high	80.1	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	122	159.6	177.1	64.8	0	0	0	107.9	L160 V162 W275 L277 L280 F291 V293 F316 F320	L160-L167 HydrophobicContact CD1-CD1 3.79Å; L160-L167 HydrophobicContact CD1-CG 4.17Å; L160-L167 HydrophobicContact CD2-CD1 4.25Å; L160-L167 HydrophobicContact CG-CD1 3.87Å; V162-L167 HydrophobicContact CG2-CD1 4.41Å; L167-W275 HydrophobicContact CB-CE3 4.42Å; L167-W275 HydrophobicContact CD2-CE3 4.15Å; L167-W275 HydrophobicContact CG-CE3 4.1Å; L167-W275 PolarHBondContact N-O 2.81Å; L167-W275 PolarHBondContact O-N 3.09Å; L167-L277 HydrophobicContact CB-CD2 4.21Å; L167-L280 HydrophobicContact CB-CD1 4.47Å; L167-L280 HydrophobicContact CD2-CD1 4.24Å; L167-F291 HydrophobicContact CD2-CE1 4Å; L167-F291 HydrophobicContact CD2-CZ 4.47Å; L167-V293 HydrophobicContact CD2-CG1 4.39Å; L167-V293 HydrophobicContact CD2-CG2 3.81Å; L167-F316 HydrophobicContact CD1-CE2 4.36Å; L167-F316 HydrophobicContact CD1-CZ 4.03Å; L167-F320 HydrophobicContact CB-CE2 4.33Å; L167-F320 HydrophobicContact CD1-CD2 4.07Å; L167-F320 HydrophobicContact CD1-CE2 3.87Å; L167-F320 HydrophobicContact CD2-CE2 4.22Å; L167-F320 HydrophobicContact CG-CE2 4.37Å
168	V	90.5	Very high	78.8	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.006	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	127.2	-177.5	-176.8	0	0	0	0	109.9	L160 F161 E163 N166 R272 L273	L160-V168 WeakPolarHBondContact CA-O 3.49Å; F161-V168 HydrophobicContact CD1-CB 4.42Å; F161-V168 HydrophobicContact CD2-CB 4.18Å; F161-V168 HydrophobicContact CE1-CB 4.14Å; F161-V168 HydrophobicContact CE1-CG1 3.8Å; F161-V168 HydrophobicContact CE2-CB 3.88Å; F161-V168 HydrophobicContact CE2-CG1 3.9Å; F161-V168 HydrophobicContact CE2-CG2 4.44Å; F161-V168 HydrophobicContact CG-CB 4.44Å; F161-V168 HydrophobicContact CZ-CB 3.86Å; F161-V168 HydrophobicContact CZ-CG1 3.43Å; F161-V168 VanDerWaalsContact CZ-CG1 3.43Å; F161-V168 PolarHBondContact N-O 3.44Å; F161-V168 PolarHBondContact O-N 2.84Å; E163-V168 HydrophobicContact CB-CG2 3.92Å; N166-V168 HydrophobicContact CB-CG2 4.11Å; V168-R272 HydrophobicContact CG1-CG 3.79Å; V168-L273 CarbonylContact C-O 3.33Å; V168-L273 WeakPolarHBondContact CA-O 3.45Å
169	F	90.9	Very high	77.6	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	128.2	165.6	175.1	-96.5	0	0	0	109.7	A52 L54 I156 C159 L160 A171 R272 L273 W275 F308	A52-F169 HydrophobicContact CB-CD2 4.38Å; A52-F169 HydrophobicContact CB-CE2 4.15Å; L54-F169 HydrophobicContact CB-CE1 3.92Å; L54-F169 HydrophobicContact CB-CE2 4.02Å; L54-F169 HydrophobicContact CB-CZ 3.61Å; L54-F169 HydrophobicContact CD2-CD1 4.09Å; L54-F169 HydrophobicContact CD2-CE1 3.87Å; L54-F169 HydrophobicContact CD2-CZ 4.42Å; I156-F169 HydrophobicContact CB-CZ 4.49Å; I156-F169 HydrophobicContact CG2-CE1 4.25Å; I156-F169 HydrophobicContact CG2-CZ 4.37Å; I156-F169 WeakPolarHBondContact O-CZ 3.49Å; C159-F169 CarbonylContact O-C 3.59Å; C159-F169 VanDerWaalsContact O-CA 3.31Å; C159-F169 WeakPolarHBondContact O-CA 3.39Å; C159-F169 WeakPolarHBondContact O-CD2 3.16Å; L160-F169 HydrophobicContact CD1-CB 3.73Å; L160-F169 HydrophobicContact CD1-CD2 4.19Å; L160-F169 HydrophobicContact CD1-CG 4.46Å; F169-A171 HydrophobicContact CE1-CB 4.32Å; F169-R272 CarbonylContact O-C 3.55Å; F169-R272 WeakPolarHBondContact O-CA 3.4Å; F169-L273 HydrophobicContact CB-CB 4.24Å; F169-L273 HydrophobicContact CB-CD1 4.42Å; F169-L273 HydrophobicContact CD1-CD1 3.76Å; F169-L273 HydrophobicContact CD1-CG 4.09Å; F169-L273 HydrophobicContact CG-CD1 4.48Å; F169-L273 PolarHBondContact N-O 3.03Å; F169-L273 PolarHBondContact O-N 2.86Å; F169-W275 HydrophobicContact CB-CH2 4.21Å; F169-W275 HydrophobicContact CB-CZ3 3.93Å; F169-F308 HydrophobicContact CB-CE1 3.82Å; F169-F308 HydrophobicContact CB-CZ 4.35Å; F169-F308 HydrophobicContact CD1-CE1 4.44Å; F169-F308 AromaticContact CD2-CD1 3.8Å; F169-F308 HydrophobicContact CD2-CD1 3.8Å; F169-F308 AromaticContact CD2-CE1 3.57Å; F169-F308 HydrophobicContact CD2-CE1 3.57Å; F169-F308 HydrophobicContact CE2-CD1 4.17Å; F169-F308 HydrophobicContact CE2-CE1 4.23Å; F169-F308 HydrophobicContact CG-CD1 4.37Å; F169-F308 AromaticContact CG-CE1 3.68Å; F169-F308 HydrophobicContact CG-CE1 3.68Å
170	Q	88.2	Confident	76.2	Confident	15 Å²	15	48.7 Å²	48.7	7%	0.07	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	119.2	179.9	-171.7	-179.7	-8.2	0	0	111.1	S31 G158 C159 F161 P270 L271	S31-Q170 PolarHBondContact OG-NE2 2.82Å; S31-Q170 PolarHBondContact OG-OE1 2.87Å; G158-Q170 CarbonylContact C-O 3.49Å; G158-Q170 WeakPolarHBondContact CA-O 3.3Å; C159-Q170 PolarHBondContact N-O 2.86Å; C159-Q170 PolarHBondContact O-N 2.77Å; F161-Q170 HydrophobicContact CE1-CB 4.04Å; Q170-P270 HydrophobicContact CG-CB 4.32Å; Q170-P270 HydrophobicContact CG-CG 4.27Å; Q170-L271 CarbonylContact C-O 3.13Å; Q170-L271 WeakPolarHBondContact CA-O 3.36Å
171	A	84.9	Confident	74.7	Confident	2 Å²	2	51.4 Å²	51.4	2%	0.017	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	142.3	-178.9	0	0	0	0	0	112.8	I156 N157 F169 P270 L271	I156-A171 HydrophobicContact CG2-CB 3.59Å; N157-A171 CarbonylContact O-C 3.54Å; N157-A171 WeakPolarHBondContact O-CA 3.44Å; F169-A171 HydrophobicContact CE1-CB 4.32Å; A171-P270 WeakPolarHBondContact O-CB 3.44Å; A171-L271 HydrophobicContact CB-CB 3.86Å; A171-L271 HydrophobicContact CB-CD2 4.48Å; A171-L271 PolarHBondContact N-O 3.46Å
172	V	76.3	Confident	73.5	Confident	82 Å²	82	51.1 Å²	51.1	50%	0.497	26%	0.259	S	S	.	.			trans	-95.4	-24.8	166.5	-168.3	0	0	0	0	110.6	F28 C29 N157	F28-V172 WeakPolarHBondContact O-CG2 3.4Å; C29-V172 HydrophobicContact CB-CG2 4.04Å; N157-V172 PolarHBondContact O-N 2.92Å
173	S	61.9	Low	72.2	Confident	29 Å²	29	52.6 Å²	52.6	20%	0.203	27%	0.266	C	S	.	.	S	Bend	trans	-61.4	140.4	178.3	-67.5	0	0	0	0	112.9	N157	N157-S173 PolarHBondContact N-OG 2.85Å; N157-S173 PolarHBondContact O-N 2.99Å
174	K	57.9	Low	70.8	Confident	170 Å²	170	52.8 Å²	52.8	74%	0.739	27%	0.268	S	S	*	.			trans	-56.9	148	167.7	-63.7	-179.8	179.6	179.6	0	110.4	S176 H177	K174-S176 PolarHBondContact O-N 3.28Å; K174-H177 PolarHBondContact O-N 2.98Å; K174-H177 VanDerWaalsContact O-N 3.15Å
175	R	56.9	Low	68.9	Low	94 Å²	94	49.9 Å²	49.9	36%	0.355	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-49.8	-25.6	-177.1	-83.3	-171.4	173.6	-162.3	-4.3	114.5	H177 V178 M187	R175-H177 PolarHBondContact O-N 2.79Å; R175-V178 PolarHBondContact O-N 3.09Å; R175-V178 VanDerWaalsContact O-N 3.1Å; R175-M187 PolarHBondContact NH1-O 2.86Å
176	S	51.6	Low	66.9	Low	88 Å²	88	53.8 Å²	53.8	62%	0.615	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-58.8	-13.1	177.5	54.2	0	0	0	0	116	K174	K174-S176 PolarHBondContact O-N 3.28Å
177	H	57.4	Low	64.4	Low	123 Å²	123	56.3 Å²	56.3	57%	0.569	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-115.4	13.4	178	-56.8	-75.5	0	0	0	113.4	K174 R175	K174-H177 PolarHBondContact O-N 2.98Å; K174-H177 VanDerWaalsContact O-N 3.15Å; R175-H177 PolarHBondContact O-N 2.79Å
178	V	60.9	Low	61.8	Low	16 Å²	16	61 Å²	61	10%	0.097	31%	0.305	C	S	.	.	S	Bend	trans	-100.5	120.9	178.6	177.4	0	0	0	0	108.8	I156 R175 F180 L182 I183 L271	I156-V178 HydrophobicContact CD1-CG1 4.47Å; I156-V178 HydrophobicContact CD1-CG2 4.42Å; R175-V178 PolarHBondContact O-N 3.09Å; R175-V178 VanDerWaalsContact O-N 3.1Å; V178-F180 PolarHBondContact O-N 2.82Å; V178-L182 HydrophobicContact CG1-CB 3.86Å; V178-L182 HydrophobicContact CG1-CD1 4.45Å; V178-I183 HydrophobicContact CB-CG1 4.44Å; V178-I183 HydrophobicContact CG1-CD1 4.39Å; V178-I183 HydrophobicContact CG1-CG1 3.78Å; V178-L271 HydrophobicContact CG1-CD1 4.26Å; V178-L271 HydrophobicContact CG1-CD2 3.74Å; V178-L271 HydrophobicContact CG1-CG 4.45Å; V178-L271 HydrophobicContact CG2-CB 4.41Å; V178-L271 HydrophobicContact CG2-CD2 4.18Å
179	P	62.4	Low	58.8	Low	14 Å²	14	63.2 Å²	63.2	9%	0.091	33%	0.329	C	S	.	.			trans	-53.7	138	171.2	-27	35.9	0	0	0	111.3	E152 C154 L181 L182	E152-P179 WeakPolarHBondContact OE1-CB 3.34Å; E152-P179 WeakPolarHBondContact OE1-CG 3.43Å; C154-P179 HydrophobicContact CB-CG 3.79Å; P179-L181 PolarHBondContact O-N 2.91Å; P179-L181 VanDerWaalsContact O-N 3.12Å; P179-L182 HydrophobicContact CB-CG 4.44Å; P179-L182 HydrophobicContact CG-CD1 4.4Å; P179-L182 WeakPolarHBondContact O-CB 3.37Å; P179-L182 PolarHBondContact O-N 2.84Å
180	F	59.7	Low	55.7	Low	115 Å²	115	68.7 Å²	68.7	50%	0.504	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-58.1	-29.8	-178.6	70.4	-88.9	0	0	0	112.1	I70 V178 L182 I183	I70-F180 HydrophobicContact CB-CE2 4.46Å; I70-F180 HydrophobicContact CD1-CE2 4.04Å; I70-F180 HydrophobicContact CG1-CE2 3.84Å; I70-F180 HydrophobicContact CG2-CE2 3.93Å; I70-F180 HydrophobicContact CG2-CZ 3.82Å; V178-F180 PolarHBondContact O-N 2.82Å; F180-L182 PolarHBondContact O-N 3.33Å; F180-I183 PolarHBondContact O-N 2.77Å
181	L	60.3	Low	53	Low	56 Å²	56	73.5 Å²	73.5	29%	0.293	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-58.3	-15	172.6	-66.1	175.1	0	0	0	114	L59 L62 I70 P179	L59-L181 HydrophobicContact CD1-CB 4.1Å; L59-L181 HydrophobicContact CD1-CD1 4.47Å; L62-L181 HydrophobicContact CD1-CD2 3.91Å; I70-L181 HydrophobicContact CD1-CD2 4.13Å; P179-L181 PolarHBondContact O-N 2.91Å; P179-L181 VanDerWaalsContact O-N 3.12Å
182	L	64.7	Low	50.3	Low	2 Å²	2	77.9 Å²	77.9	1%	0.01	43%	0.425	C	S	.	.	G	3₁₀ helix	trans	-106.1	-9.5	174.7	-53.1	-179.3	0	0	0	113.7	L54 I57 I156 V178 P179 F180 L271 R301	L54-L182 HydrophobicContact CD2-CD1 4.35Å; I57-L182 HydrophobicContact CD1-CD1 3.37Å; I57-L182 HydrophobicContact CD1-CD2 3.65Å; I57-L182 HydrophobicContact CD1-CG 3.96Å; I156-L182 HydrophobicContact CD1-CD1 3.55Å; V178-L182 HydrophobicContact CG1-CB 3.86Å; V178-L182 HydrophobicContact CG1-CD1 4.45Å; P179-L182 HydrophobicContact CB-CG 4.44Å; P179-L182 HydrophobicContact CG-CD1 4.4Å; P179-L182 WeakPolarHBondContact O-CB 3.37Å; P179-L182 PolarHBondContact O-N 2.84Å; F180-L182 PolarHBondContact O-N 3.33Å; L182-L271 HydrophobicContact CB-CD1 4.15Å; L182-L271 HydrophobicContact CB-CD2 4.2Å; L182-L271 HydrophobicContact CD1-CD2 4.07Å; L182-L271 WeakPolarHBondContact O-CD1 3.38Å; L182-R301 VanDerWaalsContact C-NH1 3.33Å; L182-R301 VanDerWaalsContact O-CZ 3.25Å; L182-R301 PolarHBondContact O-NH1 3.13Å; L182-R301 PolarHBondContact O-NH2 2.83Å
183	I	62.5	Low	48	Very low	45 Å²	45	81 Å²	81	23%	0.231	44%	0.439	C	S	.	.	S	Bend	trans	-85.2	121.2	174.7	-56.1	-178.2	0	0	0	106.5	V178 F180 Q185 L188	V178-I183 HydrophobicContact CB-CG1 4.44Å; V178-I183 HydrophobicContact CG1-CD1 4.39Å; V178-I183 HydrophobicContact CG1-CG1 3.78Å; F180-I183 PolarHBondContact O-N 2.77Å; I183-Q185 PolarHBondContact O-N 2.88Å; I183-L188 HydrophobicContact CG2-CG 4.42Å
184	D	54.3	Low	46.3	Very low	44 Å²	44	85.7 Å²	85.7	24%	0.235	47%	0.471	C	S	.	.			trans	-65.3	132.6	175.3	-156.9	-55.8	0	0	0	109.1	Q186 M187 L188	D184-Q186 PolarHBondContact O-N 3.08Å; D184-Q186 WeakPolarHBondContact OD1-CB 3.35Å; D184-Q186 PolarHBondContact OD1-N 2.95Å; D184-M187 HydrophobicContact CB-CB 4.13Å; D184-M187 HydrophobicContact CB-CG 4.06Å; D184-M187 WeakPolarHBondContact O-CA 3.35Å; D184-M187 WeakPolarHBondContact O-CB 3.31Å; D184-M187 PolarHBondContact O-N 2.79Å; D184-L188 PolarHBondContact O-N 3.44Å
185	Q	42.9	Very low	45	Very low	98 Å²	98	83.8 Å²	83.8	46%	0.458	47%	0.473	S	S	.	.	G	3₁₀ helix	trans	-61.5	-28	177	-70.8	173.2	-56.2	0	0	111.1	E69 I183 M187 L188	E69-Q185 PolarHBondContact OE1-NE2 2.87Å; E69-Q185 PolarHBondContact OE2-NE2 3.48Å; I183-Q185 PolarHBondContact O-N 2.88Å; Q185-M187 PolarHBondContact O-N 2.96Å; Q185-L188 WeakPolarHBondContact O-CB 3.4Å; Q185-L188 PolarHBondContact O-N 2.85Å; Q185-L188 VanDerWaalsContact O-N 3.16Å
186	Q	40.1	Very low	43.5	Very low	97 Å²	97	83.4 Å²	83.4	45%	0.453	49%	0.49	S	S	.	.	G	3₁₀ helix	trans	-72.5	-17.6	174.2	-59.4	-178.5	-14.4	0	0	112.8	D184	D184-Q186 PolarHBondContact O-N 3.08Å; D184-Q186 WeakPolarHBondContact OD1-CB 3.35Å; D184-Q186 PolarHBondContact OD1-N 2.95Å
187	M	36.5	Very low	42.5	Very low	91 Å²	91	84 Å²	84	45%	0.448	49%	0.491	S	S	.	.	G	3₁₀ helix	trans	-90.1	1	172	-75.2	-82.5	-179.9	0	0	113.4	R175 D184 Q185 P269	R175-M187 PolarHBondContact NH1-O 2.86Å; D184-M187 HydrophobicContact CB-CB 4.13Å; D184-M187 HydrophobicContact CB-CG 4.06Å; D184-M187 WeakPolarHBondContact O-CA 3.35Å; D184-M187 WeakPolarHBondContact O-CB 3.31Å; D184-M187 PolarHBondContact O-N 2.79Å; Q185-M187 PolarHBondContact O-N 2.96Å; M187-P269 HydrophobicContact CE-CG 4.36Å; M187-P269 HydrophobicContact SD-CG 4.22Å
188	L	36.5	Very low	41.1	Very low	98 Å²	98	85.8 Å²	85.8	51%	0.513	50%	0.504	S	S	.	.	S	Bend	trans	-94.9	77.1	156.9	-73.3	157.9	0	0	0	107.5	I183 D184 Q185	I183-L188 HydrophobicContact CG2-CG 4.42Å; D184-L188 PolarHBondContact O-N 3.44Å; Q185-L188 WeakPolarHBondContact O-CB 3.4Å; Q185-L188 PolarHBondContact O-N 2.85Å; Q185-L188 VanDerWaalsContact O-N 3.16Å
189	G	27.1	Very low	39.7	Very low	49 Å²	49	94.2 Å²	94.2	51%	0.505	54%	0.539	S	S	.	.			trans	-51.6	144.5	167.8	0	0	0	0	0	109.9	T191	G189-T191 PolarHBondContact O-N 2.91Å
190	P	26.2	Very low	38.2	Very low	115 Å²	115	101.8 Å²	101.8	75%	0.747	57%	0.573	S	S	*	*			trans	-54.7	111	-153.7	19.9	-33.6	0	0	0	112.3	S192	P190-S192 PolarHBondContact O-N 2.74Å
191	T	32.2	Very low	36.8	Very low	116 Å²	116	104.9 Å²	104.9	71%	0.712	59%	0.589	S	S	*	*			trans	-78.4	43	170.7	56.5	0	0	0	0	110.6	G189 D193	G189-T191 PolarHBondContact O-N 2.91Å; T191-D193 PolarHBondContact O-N 3.21Å
192	S	27.9	Very low	35.4	Very low	94 Å²	94	107.8 Å²	107.8	66%	0.657	61%	0.609	S	S	*	*			trans	-94.3	43.5	172.6	64.4	0	0	0	0	110.5	P190	P190-S192 PolarHBondContact O-N 2.74Å
193	D	27.9	Very low	33.9	Very low	148 Å²	148	115.7 Å²	115.7	79%	0.791	65%	0.652	S	S	*	*	S	Bend	trans	-158.5	139.6	162.3	-94.9	-39.1	0	0	0	107.6	T191	T191-D193 PolarHBondContact O-N 3.21Å
194	C	27.2	Very low	32.5	Very low	127 Å²	127	123 Å²	123	86%	0.858	68%	0.682	S	S	*	*	S	Bend	trans	61.2	54.1	177.9	-59.5	0	0	0	0	117.3
195	V	29.4	Very low	31.4	Very low	130 Å²	130	124.5 Å²	124.5	79%	0.788	71%	0.707	S	S	*	*				-169.3	110.3	109.4	169	0	0	0	0	107.7
196	A	25.4	Very low	30.9	Very low	85 Å²	85	130.3 Å²	130.3	70%	0.702	73%	0.725	S	S	*	*			trans	-88.4	121.2	163.1	0	0	0	0	0	108.8	I198	A196-I198 PolarHBondContact O-N 2.86Å
197	P	30.9	Very low	30.5	Very low	101 Å²	101	133.3 Å²	133.3	66%	0.656	74%	0.737	S	S	*	*			trans	-66.9	120.9	168.1	-12.5	27.5	0	0	0	108.4	F199	P197-F199 VanDerWaalsContact C-N 3.28Å; P197-F199 HydrophobicContact CB-CD2 4.26Å; P197-F199 PolarHBondContact O-N 3.47Å
198	I	28.4	Very low	30.4	Very low	161 Å²	161	138 Å²	138	83%	0.826	76%	0.755	S	S	*	*			trans	-74.7	84.9	179.4	-56.7	177	0	0	0	109.1	A196	A196-I198 PolarHBondContact O-N 2.86Å
199	F	30.6	Very low	30.3	Very low	192 Å²	192	139.3 Å²	139.3	84%	0.842	76%	0.763	S	S	*	*			trans	-108.6	60.3	167.1	-89.7	-76.5	0	0	0	110.5	P197	P197-F199 VanDerWaalsContact C-N 3.28Å; P197-F199 HydrophobicContact CB-CD2 4.26Å; P197-F199 PolarHBondContact O-N 3.47Å
200	H	30.8	Very low	30.6	Very low	174 Å²	174	144.5 Å²	144.5	81%	0.806	78%	0.779	S	S	*	*			trans	-102.2	148.4	158.6	-98	-63	0	0	0	109.5
201	Q	31.5	Very low	31.2	Very low	179 Å²	179	143.7 Å²	143.7	84%	0.836	77%	0.773	S	S	*	*			trans	70.3	134.9	-168.5	-47	-174.7	5.7	0	0	112.9
202	T	29.9	Very low	31.3	Very low	118 Å²	118	147.4 Å²	147.4	72%	0.724	78%	0.78	S	S	*	*			cis	-126.5	132.4	2.2	52.9	0	0	0	0	112
203	N	32.9	Very low	31.7	Very low	168 Å²	168	151.5 Å²	151.5	90%	0.898	79%	0.793	S	S	*	*			trans	-139	123.5	150.8	-145.2	-18.4	0	0	0	108.7	G205	N203-G205 PolarHBondContact O-N 3.29Å
204	K	33.5	Very low	32	Very low	199 Å²	199	152.1 Å²	152.1	87%	0.865	79%	0.791	S	S	*	*			trans	-85	105.1	-163.2	-70.3	176.7	177.9	175.2	0	110.5
205	G	31.7	Very low	32.2	Very low	74 Å²	74	152.1 Å²	152.1	76%	0.763	79%	0.791	S	S	*	*			trans	-120.2	21.1	-158.3	0	0	0	0	0	119.3	N203	N203-G205 PolarHBondContact O-N 3.29Å
206	R	31.9	Very low	32.4	Very low	220 Å²	220	150.8 Å²	150.8	83%	0.83	79%	0.785	S	S	*	*			trans	59.3	111.9	160.6	-76.5	-169.2	-176.8	-152	2.4	120.2
207	F	32	Very low	32.9	Very low	161 Å²	161	154.5 Å²	154.5	71%	0.706	79%	0.792	S	S	*	*			trans	64.3	149.6	153.7	-64.8	-104.4	0	0	0	116.7
208	F	34	Very low	33.1	Very low	189 Å²	189	157.7 Å²	157.7	83%	0.829	80%	0.797	S	S	*	*			cis	-130	155.1	14.5	-90	-90.2	0	0	0	113.8
209	D	35.3	Very low	33.2	Very low	126 Å²	126	161.3 Å²	161.3	67%	0.674	80%	0.801	S	S	*	*			trans	-82.7	146.6	171	-46.6	-96.1	0	0	0	113.3
210	N	33.6	Very low	33.6	Very low	158 Å²	158	158.1 Å²	158.1	85%	0.845	80%	0.799	S	S	*	*				-174.9	129.6	103	-118	-60.2	0	0	0	113.6
211	P	37.4	Very low	33.6	Very low	97 Å²	97	157 Å²	157	63%	0.63	80%	0.799	S	S	*	*			trans	-106	148.3	168.8	37.4	-30.1	0	0	0	112.9
212	K	35.8	Very low	34.1	Very low	195 Å²	195	154 Å²	154	85%	0.848	80%	0.795	S	S	*	*			trans	156.1	117.5	139.9	-88.2	160	-176.9	176	0	111.9
213	L	35.6	Very low	34.1	Very low	180 Å²	180	155.7 Å²	155.7	94%	0.942	80%	0.798	S	S	*	*			trans	-137	129.1	140.6	-104.5	171.4	0	0	0	108.1
214	H	34.6	Very low	34.2	Very low	161 Å²	161	154.9 Å²	154.9	75%	0.745	79%	0.792	S	S	*	*			trans	-83.8	142.2	178.6	-109.4	-124	0	0	0	110.2
215	C	30.1	Very low	34.3	Very low	127 Å²	127	150.4 Å²	150.4	86%	0.858	79%	0.786	S	S	*	*				-176.8	124.4	119.9	-107.1	0	0	0	0	112.2
216	P	34	Very low	34.4	Very low	102 Å²	102	156.2 Å²	156.2	66%	0.662	79%	0.791	S	S	*	*			trans	-93.3	160.3	166.3	37.3	-33.2	0	0	0	111.8
217	I	37.4	Very low	34.8	Very low	163 Å²	163	151.4 Å²	151.4	84%	0.836	79%	0.788	S	S	*	*			trans	-165.5	166.6	154	-105.4	151.4	0	0	0	110.7
218	Q	34.9	Very low	34.9	Very low	167 Å²	167	151.7 Å²	151.7	78%	0.78	79%	0.792	S	S	*	*			trans	-75.1	161.9	-156.3	-61.8	108.7	-67.4	0	0	119.3
219	R	29.7	Very low	35	Very low	238 Å²	238	150.1 Å²	150.1	90%	0.898	79%	0.792	S	S	*	*			trans	-28.2	159.8	142.6	-67.8	178.1	-177	171.1	0.2	114.7
220	P	38.2	Very low	34.9	Very low	124 Å²	124	147.4 Å²	147.4	81%	0.805	79%	0.793	S	S	*	*			cis	-146.3	-170.1	37.6	42.6	-21.6	0	0	0	118.2
221	L	31.1	Very low	35	Very low	152 Å²	152	144.8 Å²	144.8	80%	0.796	79%	0.788	S	S	*	*			trans	-67.1	157.5	175	-62.4	162.8	0	0	0	113.6
222	P	41.8	Very low	35	Very low	116 Å²	116	148 Å²	148	75%	0.753	79%	0.794	S	S	*	*			trans	-110.2	126.9	144.8	34	-24.6	0	0	0	111.7
223	I	31.1	Very low	35.1	Very low	153 Å²	153	146.4 Å²	146.4	79%	0.785	79%	0.794	S	S	*	*			trans	-98.7	127.9	155.3	-62.4	170.8	0	0	0	105.8
224	L	35	Very low	35.1	Very low	151 Å²	151	140.9 Å²	140.9	79%	0.791	78%	0.78	S	S	*	*			trans	-137.7	109	168.9	-90.2	172.1	0	0	0	110.6
225	S	35.1	Very low	35.3	Very low	105 Å²	105	140.8 Å²	140.8	73%	0.734	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-73.6	145.7	158.8	36.9	0	0	0	0	110
226	F	34.4	Very low	35.7	Very low	196 Å²	196	138.9 Å²	138.9	86%	0.86	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-86.2	153.1	166.7	-83.4	-89	0	0	0	110.6
227	P	39.6	Very low	35.9	Very low	119 Å²	119	140.4 Å²	140.4	77%	0.773	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-88	162.6	-160.7	34.9	-37.3	0	0	0	114.7
228	E	34.3	Very low	36.1	Very low	167 Å²	167	138.2 Å²	138.2	78%	0.78	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-73.8	161.8	165.5	-61.6	179	99.6	0	0	112.8
229	N	35.3	Very low	36.3	Very low	156 Å²	156	136.9 Å²	136.9	83%	0.834	77%	0.773	S	S	*	*			trans	69.2	142.7	160.1	-57.7	-51	0	0	0	117.5
230	G	34.8	Very low	36.6	Very low	68 Å²	68	128.8 Å²	128.8	70%	0.701	76%	0.764	S	S	*	*			trans	140.4	28.4	165	0	0	0	0	0	120.4
231	S	35.2	Very low	36.6	Very low	104 Å²	104	131.9 Å²	131.9	73%	0.727	77%	0.768	S	S	*	*			trans	36	140.1	144.2	65.2	0	0	0	0	123.2
232	H	37.3	Very low	36.7	Very low	163 Å²	163	134.2 Å²	134.2	76%	0.755	77%	0.771	S	S	*	*			trans	83.6	114	150	-72.9	-65.2	0	0	0	122.5
233	L	37.6	Very low	36.3	Very low	163 Å²	163	134.8 Å²	134.8	85%	0.853	78%	0.777	S	S	*	*				74.3	143.3	127.6	-63.6	168.3	0	0	0	121.8
234	G	36.5	Very low	36.3	Very low	63 Å²	63	133.2 Å²	133.2	65%	0.649	78%	0.779	S	S	*	*			trans	104.7	113.7	177.4	0	0	0	0	0	111.4
235	N	38.2	Very low	36.5	Very low	159 Å²	159	131.3 Å²	131.3	85%	0.85	78%	0.776	S	S	*	*			cis	54.4	127.8	38.7	-54.4	26.7	0	0	0	111.5
236	S	37.3	Very low	36.4	Very low	88 Å²	88	131.2 Å²	131.2	62%	0.615	78%	0.775	S	S	*	*			cis	-166	171.2	2.3	-126.9	0	0	0	0	110.1
237	D	38.5	Very low	36.6	Very low	134 Å²	134	129.5 Å²	129.5	72%	0.717	77%	0.774	S	S	*	*			trans	38.6	140.3	138.3	-57.6	-50.1	0	0	0	121.2
238	T	42.5	Very low	36.6	Very low	117 Å²	117	129.8 Å²	129.8	72%	0.718	77%	0.773	S	S	*	*			cis	-170.9	161.4	10.5	16.4	0	0	0	0	111.8
239	V	39.3	Very low	36.7	Very low	139 Å²	139	129 Å²	129	84%	0.842	77%	0.774	S	S	*	*			trans	47.9	130.7	143.4	177.1	0	0	0	0	121.4
240	G	35.8	Very low	36.6	Very low	68 Å²	68	128.1 Å²	128.1	70%	0.701	77%	0.77	S	S	*	*			trans	163.1	73.3	150.4	0	0	0	0	0	122.6
241	Q	37.3	Very low	36.9	Very low	189 Å²	189	130.1 Å²	130.1	88%	0.883	77%	0.77	S	S	*	*			trans	40.7	109.9	146.1	-54.2	-172.2	17.5	0	0	123.3
242	K	33.7	Very low	36.8	Very low	201 Å²	201	136.1 Å²	136.1	87%	0.874	78%	0.779	S	S	*	*			trans	21.3	126.5	136.6	-61.5	-178.1	175.6	-173.7	0	121.5
243	C	32.7	Very low	36.8	Very low	128 Å²	128	136.1 Å²	136.1	87%	0.865	78%	0.782	S	S	*	*				-172.9	170.5	107.3	-104.4	0	0	0	0	113.1
244	S	31.3	Very low	36.6	Very low	120 Å²	120	133.6 Å²	133.6	84%	0.839	78%	0.779	S	S	*	*			trans	-84	146.5	-161.3	-40	0	0	0	0	117
245	P	40.3	Very low	36.6	Very low	111 Å²	111	136.8 Å²	136.8	72%	0.721	79%	0.785	S	S	*	*				-130	153.8	120.8	35	-24.7	0	0	0	110.9
246	S	33.4	Very low	36.6	Very low	103 Å²	103	137.8 Å²	137.8	72%	0.72	79%	0.785	S	S	*	*			cis	87.1	119.9	28.4	84.9	0	0	0	0	116.3
247	L	38.5	Very low	36.5	Very low	160 Å²	160	144.7 Å²	144.7	84%	0.838	80%	0.798	S	S	*	*			trans	75.1	115.2	164.5	-89.3	63.9	0	0	0	120.4
248	V	38.3	Very low	36	Very low	125 Å²	125	143.4 Å²	143.4	76%	0.758	80%	0.798	S	S	*	*				56.9	104.8	129.9	-174.8	0	0	0	0	119.8
249	D	36.3	Very low	35.9	Very low	149 Å²	149	143.4 Å²	143.4	80%	0.797	80%	0.8	S	S	*	*				-141.7	124.4	124.6	-100.1	-48.2	0	0	0	106.4
250	N	34	Very low	35.9	Very low	138 Å²	138	145.3 Å²	145.3	74%	0.738	80%	0.8	S	S	*	*				74.3	119.8	78.2	-154.5	22.2	0	0	0	112.2
251	P	39.9	Very low	35.9	Very low	110 Å²	110	149.8 Å²	149.8	71%	0.714	81%	0.808	S	S	*	*	S	Bend	trans	-97.9	121.7	-153.3	35.1	-32.3	0	0	0	114.9
252	Y	34.2	Very low	36.1	Very low	231 Å²	231	146.7 Å²	146.7	91%	0.906	80%	0.801	S	S	*	*			trans	-168.5	43.9	147	-115.6	-69.6	0	0	0	114.1
253	I	37.8	Very low	36.4	Very low	162 Å²	162	145 Å²	145	83%	0.831	79%	0.794	S	S	*	*	S	Bend	trans	-126.4	140.8	169.3	-83.7	96.8	0	0	0	110.5	T255	I253-T255 PolarHBondContact O-N 3.22Å
254	S	33.3	Very low	36.4	Very low	111 Å²	111	144 Å²	144	78%	0.776	79%	0.786	S	S	*	*			trans	-58.1	118.1	179.2	-53.8	0	0	0	0	112	E256	S254-E256 PolarHBondContact O-N 2.69Å
255	T	36.6	Very low	36.8	Very low	129 Å²	129	149.6 Å²	149.6	79%	0.791	79%	0.788	S	S	*	*			trans	-81.5	110.7	155.6	-39.3	0	0	0	0	107.4	I253 R257	I253-T255 PolarHBondContact O-N 3.22Å; T255-R257 PolarHBondContact O-N 3.42Å
256	E	36.7	Very low	36.8	Very low	181 Å²	181	151 Å²	151	85%	0.846	79%	0.789	S	S	*	*			trans	-60.9	101.1	165.2	-66.2	-174.4	147.4	0	0	108	S254 C258	S254-E256 PolarHBondContact O-N 2.69Å; E256-C258 PolarHBondContact O-N 3.07Å
257	R	35.2	Very low	37.3	Very low	232 Å²	232	151.4 Å²	151.4	88%	0.875	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-68.3	118.1	157.3	-65.1	-173.4	-174.8	-172.5	2.5	105.1	T255	T255-R257 PolarHBondContact O-N 3.42Å
258	C	29.3	Very low	37.5	Very low	108 Å²	108	147.3 Å²	147.3	73%	0.73	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-46.1	139.7	168	-59.9	0	0	0	0	108.4	E256 E260	E256-C258 PolarHBondContact O-N 3.07Å; C258-E260 PolarHBondContact O-N 3.47Å; C258-E260 VanDerWaalsContact O-N 3.09Å
259	P	38.9	Very low	38.4	Very low	117 Å²	117	144.9 Å²	144.9	76%	0.76	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-54.4	125	166.6	25.5	-32.6	0	0	0	106.8	D261	P259-D261 PolarHBondContact O-N 2.81Å
260	E	39.9	Very low	39.8	Very low	178 Å²	178	140.9 Å²	140.9	83%	0.832	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-52.2	140.3	168.6	-71	-167.9	146.8	0	0	107.7	C258 V262	C258-E260 PolarHBondContact O-N 3.47Å; C258-E260 VanDerWaalsContact O-N 3.09Å; E260-V262 WeakPolarHBondContact O-CG2 3.35Å; E260-V262 PolarHBondContact O-N 3.09Å
261	D	35.6	Very low	41.8	Very low	163 Å²	163	135.5 Å²	135.5	87%	0.872	71%	0.712	S	S	*	*			trans	-47.5	108.5	177.6	-100.7	-53.5	0	0	0	108.9	P259 K263	P259-D261 PolarHBondContact O-N 2.81Å; D261-K263 PolarHBondContact O-N 3.3Å
262	V	43.1	Very low	43.9	Very low	123 Å²	123	135.3 Å²	135.3	75%	0.745	70%	0.698	S	S	*	*			trans	-76.4	61.8	173.5	-171.2	0	0	0	0	106.8	E260 P264	E260-V262 WeakPolarHBondContact O-CG2 3.35Å; E260-V262 PolarHBondContact O-N 3.09Å; V262-P264 WeakPolarHBondContact O-CA 3.21Å
263	K	39	Very low	46.4	Very low	166 Å²	166	124.3 Å²	124.3	72%	0.722	65%	0.654	S	S	*	*			trans	-46.1	109.8	176.3	-177.4	174.8	-174.2	172.7	0	105.6	D261 R265	D261-K263 PolarHBondContact O-N 3.3Å; K263-R265 PolarHBondContact O-N 3.3Å
264	P	33.5	Very low	48.8	Very low	106 Å²	106	118.7 Å²	118.7	69%	0.688	63%	0.63	S	S	*	*			trans	-55.9	114.6	-158.9	17.4	-31.6	0	0	0	108	V262 L266	V262-P264 WeakPolarHBondContact O-CA 3.21Å; P264-L266 PolarHBondContact O-N 2.85Å
265	R	38.7	Very low	51.6	Low	238 Å²	238	113.5 Å²	113.5	90%	0.898	59%	0.593	S	S	*	*			trans	-54.8	101.5	-165.7	-78.1	-174.7	175.1	-177.9	-1.9	108.4	K263	K263-R265 PolarHBondContact O-N 3.3Å
266	L	39.8	Very low	54	Low	140 Å²	140	109.2 Å²	109.2	73%	0.733	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-54.6	134.8	-174.1	-73	170.5	0	0	0	107.7	P264	P264-L266 PolarHBondContact O-N 2.85Å
267	P	44	Very low	56.4	Low	112 Å²	112	100.9 Å²	100.9	73%	0.727	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-54.1	119.8	-179.7	22.5	-32.6	0	0	0	107.5
268	P	44.5	Very low	58.8	Low	74 Å²	74	94 Å²	94	48%	0.481	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-60.7	139.6	-167.2	23.3	-34.3	0	0	0	109.2
269	P	55.8	Low	61.4	Low	75 Å²	75	89.5 Å²	89.5	49%	0.487	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-55.2	142.1	-162.4	18.3	-31.7	0	0	0	111.8	M187	M187-P269 HydrophobicContact CE-CG 4.36Å; M187-P269 HydrophobicContact SD-CG 4.22Å
270	P	66.1	Low	63.7	Low	64 Å²	64	84.3 Å²	84.3	42%	0.416	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-55.1	144.8	177.8	22.5	-33.2	0	0	0	110.4	Q170 A171 R272	Q170-P270 HydrophobicContact CG-CB 4.32Å; Q170-P270 HydrophobicContact CG-CG 4.27Å; A171-P270 WeakPolarHBondContact O-CB 3.44Å; P270-R272 PolarHBondContact O-N 3.48Å
271	L	75.5	Confident	65.9	Low	25 Å²	25	80 Å²	80	13%	0.131	42%	0.423	C	S	.	.			trans	-55.5	108.6	178.8	174.9	75.9	0	0	0	109.7	I156 Q170 A171 V178 L182 L273	I156-L271 HydrophobicContact CD1-CD2 4.12Å; Q170-L271 CarbonylContact C-O 3.13Å; Q170-L271 WeakPolarHBondContact CA-O 3.36Å; A171-L271 HydrophobicContact CB-CB 3.86Å; A171-L271 HydrophobicContact CB-CD2 4.48Å; A171-L271 PolarHBondContact N-O 3.46Å; V178-L271 HydrophobicContact CG1-CD1 4.26Å; V178-L271 HydrophobicContact CG1-CD2 3.74Å; V178-L271 HydrophobicContact CG1-CG 4.45Å; V178-L271 HydrophobicContact CG2-CB 4.41Å; V178-L271 HydrophobicContact CG2-CD2 4.18Å; L182-L271 HydrophobicContact CB-CD1 4.15Å; L182-L271 HydrophobicContact CB-CD2 4.2Å; L182-L271 HydrophobicContact CD1-CD2 4.07Å; L182-L271 WeakPolarHBondContact O-CD1 3.38Å; L271-L273 HydrophobicContact CD1-CD2 3.85Å; L271-L273 HydrophobicContact CD2-CD2 4.19Å; L271-L273 HydrophobicContact CD2-CG 4.41Å; L271-L273 HydrophobicContact CG-CD2 3.94Å; L271-L273 HydrophobicContact CG-CG 4.3Å
272	R	84.4	Confident	68.4	Low	107 Å²	107	78 Å²	78	40%	0.404	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	113.1	174.9	-169.2	174.1	176.4	-165	-2.5	108.5	E163 V168 F169 P270	E163-R272 IonicContact OE1-NH2 3.71Å; E163-R272 PolarHBondContact OE1-NH2 3.45Å; E163-R272 IonicContact OE2-CZ 3.05Å; E163-R272 IonicContact OE2-NE 2.76Å; E163-R272 IonicContact OE2-NH2 3.5Å; E163-R272 PolarHBondContact OE2-NH2 2.83Å; V168-R272 HydrophobicContact CG1-CG 3.79Å; F169-R272 CarbonylContact O-C 3.55Å; F169-R272 WeakPolarHBondContact O-CA 3.4Å; P270-R272 PolarHBondContact O-N 3.48Å
273	L	86.7	Confident	70.7	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	131.8	170.8	-48.1	180	0	0	0	107.2	L54 V168 F169 L271 W275 R301	L54-L273 HydrophobicContact CD2-CD1 3.69Å; V168-L273 CarbonylContact C-O 3.33Å; V168-L273 WeakPolarHBondContact CA-O 3.45Å; F169-L273 HydrophobicContact CB-CB 4.24Å; F169-L273 HydrophobicContact CB-CD1 4.42Å; F169-L273 HydrophobicContact CD1-CD1 3.76Å; F169-L273 HydrophobicContact CD1-CG 4.09Å; F169-L273 HydrophobicContact CG-CD1 4.48Å; F169-L273 PolarHBondContact N-O 3.03Å; F169-L273 PolarHBondContact O-N 2.86Å; L271-L273 HydrophobicContact CD1-CD2 3.85Å; L271-L273 HydrophobicContact CD2-CD2 4.19Å; L271-L273 HydrophobicContact CD2-CG 4.41Å; L271-L273 HydrophobicContact CG-CD2 3.94Å; L271-L273 HydrophobicContact CG-CG 4.3Å; L273-W275 HydrophobicContact CB-CH2 3.39Å; L273-W275 HydrophobicContact CB-CZ2 3.65Å; L273-W275 HydrophobicContact CB-CZ3 3.87Å; L273-W275 HydrophobicContact CD1-CH2 3.51Å; L273-W275 HydrophobicContact CD1-CZ2 3.82Å; L273-W275 HydrophobicContact CG-CH2 4.07Å; L273-W275 HydrophobicContact CG-CZ2 4.31Å; L273-R301 VanDerWaalsContact CD2-CZ 3.46Å
274	S	88.7	Confident	73.1	Confident	44 Å²	44	64.4 Å²	64.4	31%	0.308	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	132.6	177.5	-174.4	0	0	0	0	109.9	N166	N166-S274 WeakPolarHBondContact CB-OG 3.37Å
275	W	90.6	Very high	75.9	Confident	2 Å²	2	60.4 Å²	60.4	1%	0.008	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	109.4	177	-55.9	-76.4	0	0	0	109	N166 L167 F169 L273 L277 L280 T295 Y306 F308	N166-W275 CarbonylContact C-O 3.57Å; N166-W275 WeakPolarHBondContact CA-O 3.39Å; L167-W275 HydrophobicContact CB-CE3 4.42Å; L167-W275 HydrophobicContact CD2-CE3 4.15Å; L167-W275 HydrophobicContact CG-CE3 4.1Å; L167-W275 PolarHBondContact N-O 2.81Å; L167-W275 PolarHBondContact O-N 3.09Å; F169-W275 HydrophobicContact CB-CH2 4.21Å; F169-W275 HydrophobicContact CB-CZ3 3.93Å; L273-W275 HydrophobicContact CB-CH2 3.39Å; L273-W275 HydrophobicContact CB-CZ2 3.65Å; L273-W275 HydrophobicContact CB-CZ3 3.87Å; L273-W275 HydrophobicContact CD1-CH2 3.51Å; L273-W275 HydrophobicContact CD1-CZ2 3.82Å; L273-W275 HydrophobicContact CG-CH2 4.07Å; L273-W275 HydrophobicContact CG-CZ2 4.31Å; W275-L277 PolarHBondContact O-N 3.08Å; W275-L280 HydrophobicContact CB-CD2 3.73Å; W275-L280 HydrophobicContact CG-CD2 4.34Å; W275-T295 HydrophobicContact CG-CG2 4.08Å; W275-Y306 HydrophobicContact CH2-CD1 4.19Å; W275-Y306 HydrophobicContact CH2-CE1 4.46Å; W275-Y306 HydrophobicContact CH2-CG 4.39Å; W275-Y306 AromaticContact CZ2-CD1 3.73Å; W275-Y306 HydrophobicContact CZ2-CD1 3.73Å; W275-Y306 HydrophobicContact CZ2-CD2 4.1Å; W275-Y306 AromaticContact CZ2-CE1 3.63Å; W275-Y306 HydrophobicContact CZ2-CE1 3.63Å; W275-Y306 HydrophobicContact CZ2-CE2 4.03Å; W275-Y306 AromaticContact CZ2-CG 3.96Å; W275-Y306 HydrophobicContact CZ2-CG 3.96Å; W275-Y306 AromaticContact CZ2-CZ 3.79Å; W275-Y306 AromaticContact NE1-CE2 3.93Å; W275-F308 HydrophobicContact CH2-CE1 4.39Å; W275-F308 AromaticContact CH2-CZ 3.64Å; W275-F308 HydrophobicContact CH2-CZ 3.64Å; W275-F308 AromaticContact CZ3-CZ 3.74Å; W275-F308 HydrophobicContact CZ3-CZ 3.74Å
276	P	88.3	Confident	78.1	Confident	38 Å²	38	51.7 Å²	51.7	25%	0.247	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.2	135	172.5	-19.4	28.4	0	0	0	109.2	N166 V278 T279	N166-P276 VanDerWaalsContact OD1-CA 3.25Å; N166-P276 WeakPolarHBondContact OD1-CA 3.38Å; N166-P276 WeakPolarHBondContact OD1-CB 3.34Å; N166-P276 WeakPolarHBondContact OD1-CG 3.31Å; P276-V278 HydrophobicContact CB-CG2 4.07Å; P276-V278 PolarHBondContact O-N 2.82Å; P276-T279 HydrophobicContact CB-CG2 4.05Å; P276-T279 HydrophobicContact CG-CG2 4.07Å; P276-T279 WeakPolarHBondContact O-CB 3.49Å; P276-T279 PolarHBondContact O-N 2.96Å; P276-T279 PolarHBondContact O-OG1 3.49Å
277	L	87.7	Confident	80.3	Confident	6 Å²	6	48.3 Å²	48.3	3%	0.031	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-57.1	-29.8	-172	-70	172.9	0	0	0	112.4	V162 G165 L167 W275 T279 L280 F320 C323 V324 H327 F361	V162-L277 HydrophobicContact CG1-CD1 4.17Å; G165-L277 VanDerWaalsContact O-CG 3.31Å; G165-L277 WeakPolarHBondContact O-CG 3.48Å; G165-L277 PolarHBondContact O-N 2.78Å; L167-L277 HydrophobicContact CB-CD2 4.21Å; W275-L277 PolarHBondContact O-N 3.08Å; L277-T279 PolarHBondContact O-N 3.49Å; L277-L280 HydrophobicContact CD2-CD1 3.97Å; L277-L280 PolarHBondContact O-N 2.62Å; L277-F320 HydrophobicContact CD2-CE2 3.66Å; L277-F320 HydrophobicContact CD2-CZ 4Å; L277-C323 HydrophobicContact CD1-CB 4.35Å; L277-V324 HydrophobicContact CD1-CG2 4.27Å; L277-V324 HydrophobicContact CD2-CG2 4.16Å; L277-H327 HydrophobicContact CD1-CB 4.38Å; L277-F361 WeakPolarHBondContact O-CZ 3.4Å
278	V	83.8	Confident	82.2	Confident	87 Å²	87	50.2 Å²	50.2	53%	0.527	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-68.5	-9.8	174.1	-59.6	0	0	0	0	115.4	P276 L331	P276-V278 HydrophobicContact CB-CG2 4.07Å; P276-V278 PolarHBondContact O-N 2.82Å; V278-L331 HydrophobicContact CG1-CD1 3.98Å
279	T	85.2	Confident	84.3	Confident	15 Å²	15	48.7 Å²	48.7	9%	0.092	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-96.6	-10.8	176.6	67.7	0	0	0	0	113.1	P276 L277 G296 R298	P276-T279 HydrophobicContact CB-CG2 4.05Å; P276-T279 HydrophobicContact CG-CG2 4.07Å; P276-T279 WeakPolarHBondContact O-CB 3.49Å; P276-T279 PolarHBondContact O-N 2.96Å; P276-T279 PolarHBondContact O-OG1 3.49Å; L277-T279 PolarHBondContact O-N 3.49Å; T279-G296 PolarHBondContact O-N 2.88Å; T279-R298 HydrophobicContact CG2-CB 4.15Å; T279-R298 WeakPolarHBondContact CG2-O 3.47Å
280	L	87.8	Confident	86	Confident	8 Å²	8	47.8 Å²	47.8	4%	0.042	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	133.5	176.3	-52	-172.6	0	0	0	109.3	L167 W275 L277 V293 T295 F320 F361	L167-L280 HydrophobicContact CB-CD1 4.47Å; L167-L280 HydrophobicContact CD2-CD1 4.24Å; W275-L280 HydrophobicContact CB-CD2 3.73Å; W275-L280 HydrophobicContact CG-CD2 4.34Å; L277-L280 HydrophobicContact CD2-CD1 3.97Å; L277-L280 PolarHBondContact O-N 2.62Å; L280-V293 HydrophobicContact CD1-CG1 4.25Å; L280-V293 HydrophobicContact CD2-CG1 3.56Å; L280-V293 HydrophobicContact CG-CG1 4.4Å; L280-T295 HydrophobicContact CD2-CG2 4.01Å; L280-F320 HydrophobicContact CD1-CZ 4.12Å; L280-F361 HydrophobicContact CB-CE2 3.53Å; L280-F361 HydrophobicContact CB-CZ 3.77Å; L280-F361 WeakPolarHBondContact O-CD2 3.36Å; L280-F361 WeakPolarHBondContact O-CE2 3.34Å
281	R	86.1	Confident	87.3	Confident	87 Å²	87	44.7 Å²	44.7	33%	0.328	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	-42.5	177.3	-73.6	175.7	173	164.8	3.5	112.4	E294 E303 F361	R281-E294 HydrophobicContact CB-CG 4.23Å; R281-E294 WeakPolarHBondContact CD-OE1 3.34Å; R281-E294 IonicContact CZ-OE1 2.76Å; R281-E294 PolarHBondContact N-O 2.9Å; R281-E294 IonicContact NE-OE1 2.88Å; R281-E294 IonicContact NH1-OE1 3.43Å; R281-E294 PolarHBondContact NH1-OE1 2.91Å; R281-E303 IonicContact CZ-OE1 2.7Å; R281-E303 VanDerWaalsContact CZ-OE1 3.26Å; R281-E303 IonicContact CZ-OE2 2.71Å; R281-E303 VanDerWaalsContact NH1-CD 3.29Å; R281-E303 IonicContact NH1-OE1 2.73Å; R281-E303 PolarHBondContact NH1-OE1 3.43Å; R281-E303 IonicContact NH1-OE2 2.93Å; R281-E303 IonicContact NH2-OE1 3.15Å; R281-E303 PolarHBondContact NH2-OE1 3.45Å; R281-E303 IonicContact NH2-OE2 3.79Å; R281-E303 PolarHBondContact NH2-OE2 2.83Å; R281-F361 WeakPolarHBondContact O-CD2 3.48Å; R281-F361 PolarHBondContact O-N 2.81Å; R281-F361 VanDerWaalsContact O-N 3.16Å
282	R	86.7	Confident	88.1	Confident	121 Å²	121	46.8 Å²	46.8	46%	0.457	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	149.1	-174.6	-46.2	-166.6	176.1	-179.3	-3	109.1	E294 M359 P360	R282-E294 HydrophobicContact CB-CB 4.05Å; R282-E294 WeakPolarHBondContact CD-OE2 3.27Å; R282-E294 HydrophobicContact CG-CB 4.49Å; R282-E294 VanDerWaalsContact CG-OE2 3.27Å; R282-E294 WeakPolarHBondContact CG-OE2 3.45Å; R282-E294 IonicContact NE-OE2 3.23Å; R282-E294 PolarHBondContact O-N 3.28Å; R282-M359 WeakPolarHBondContact CA-O 3.43Å; R282-P360 HydrophobicContact CG-CB 3.98Å
283	F	91.9	Very high	88.5	Confident	4 Å²	4	41.7 Å²	41.7	2%	0.018	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	166.8	164.2	56.7	-92.9	0	0	0	110.6	F285 F291 K292 F320 V324 M359 F361 I364	F283-F285 AromaticContact CD2-CE2 3.93Å; F283-F285 HydrophobicContact CD2-CE2 3.93Å; F283-F285 HydrophobicContact CD2-CZ 4.39Å; F283-F285 AromaticContact CE2-CE2 3.92Å; F283-F285 HydrophobicContact CE2-CE2 3.92Å; F283-F285 HydrophobicContact CE2-CZ 4.47Å; F283-F291 HydrophobicContact CB-CE2 3.97Å; F283-F291 HydrophobicContact CB-CZ 4.29Å; F283-F291 HydrophobicContact CD2-CE2 4.2Å; F283-F291 HydrophobicContact CG-CE2 4.4Å; F283-K292 CarbonylContact C-O 3.58Å; F283-K292 WeakPolarHBondContact CA-O 3.08Å; F283-K292 WeakPolarHBondContact CB-O 3.38Å; F283-F320 AromaticContact CD1-CE1 3.93Å; F283-F320 HydrophobicContact CD1-CE1 3.93Å; F283-F320 HydrophobicContact CD1-CZ 4.29Å; F283-F320 HydrophobicContact CD2-CD1 4.47Å; F283-F320 AromaticContact CD2-CE1 3.8Å; F283-F320 HydrophobicContact CD2-CE1 3.8Å; F283-F320 AromaticContact CE1-CE1 3.78Å; F283-F320 HydrophobicContact CE1-CE1 3.78Å; F283-F320 HydrophobicContact CE1-CZ 4.35Å; F283-F320 HydrophobicContact CE2-CD1 4.14Å; F283-F320 AromaticContact CE2-CE1 3.64Å; F283-F320 HydrophobicContact CE2-CE1 3.64Å; F283-F320 AromaticContact CG-CE1 3.94Å; F283-F320 HydrophobicContact CG-CE1 3.94Å; F283-F320 HydrophobicContact CG-CZ 4.49Å; F283-F320 HydrophobicContact CZ-CD1 4.34Å; F283-F320 AromaticContact CZ-CE1 3.62Å; F283-F320 HydrophobicContact CZ-CE1 3.62Å; F283-V324 HydrophobicContact CZ-CG1 4.47Å; F283-M359 HydrophobicContact CD2-CE 4.35Å; F283-M359 HydrophobicContact CE2-CE 3.67Å; F283-M359 HydrophobicContact CZ-CE 4.38Å; F283-M359 PolarHBondContact N-O 2.9Å; F283-M359 PolarHBondContact O-N 3.23Å; F283-F361 HydrophobicContact CD1-CD2 4.22Å; F283-F361 AromaticContact CD1-CE2 3.59Å; F283-F361 HydrophobicContact CD1-CE2 3.59Å; F283-F361 HydrophobicContact CD1-CZ 4.24Å; F283-F361 HydrophobicContact CE1-CD2 4.13Å; F283-F361 AromaticContact CE1-CE2 3.58Å; F283-F361 HydrophobicContact CE1-CE2 3.58Å; F283-F361 AromaticContact CE1-CZ 3.9Å; F283-F361 HydrophobicContact CE1-CZ 3.9Å; F283-I364 HydrophobicContact CE1-CD1 3.6Å; F283-I364 HydrophobicContact CE2-CD1 4.09Å; F283-I364 HydrophobicContact CZ-CD1 3.27Å
284	G	89.4	Confident	88.6	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	144.5	177.2	0	0	0	0	0	112.2	Y286 F291 K292	G284-Y286 VanDerWaalsContact C-CE2 3.49Å; G284-Y286 WeakPolarHBondContact O-CD2 3.41Å; G284-Y286 WeakPolarHBondContact O-CE2 3.03Å; G284-F291 WeakPolarHBondContact O-CA 3.26Å; G284-K292 PolarHBondContact N-O 2.91Å; G284-K292 PolarHBondContact O-N 2.86Å
285	F	91.4	Very high	88.6	Confident	21 Å²	21	41.4 Å²	41.4	9%	0.092	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	126.5	174.4	-56.7	-83.6	0	0	0	108.1	F283 F291 L313 F316 R317 F320 E321 M359	F283-F285 AromaticContact CD2-CE2 3.93Å; F283-F285 HydrophobicContact CD2-CE2 3.93Å; F283-F285 HydrophobicContact CD2-CZ 4.39Å; F283-F285 AromaticContact CE2-CE2 3.92Å; F283-F285 HydrophobicContact CE2-CE2 3.92Å; F283-F285 HydrophobicContact CE2-CZ 4.47Å; F285-F291 AromaticContact CD1-CD2 3.58Å; F285-F291 HydrophobicContact CD1-CD2 3.58Å; F285-F291 HydrophobicContact CD1-CE2 4.15Å; F285-F291 HydrophobicContact CD1-CG 4.46Å; F285-F291 AromaticContact CE1-CD2 3.38Å; F285-F291 HydrophobicContact CE1-CD2 3.38Å; F285-F291 AromaticContact CE1-CE2 3.55Å; F285-F291 HydrophobicContact CE1-CE2 3.55Å; F285-F291 HydrophobicContact CE1-CG 4.31Å; F285-F291 HydrophobicContact CE2-CE2 4.41Å; F285-F291 HydrophobicContact CG-CD2 4.33Å; F285-F291 HydrophobicContact CZ-CD2 4Å; F285-F291 AromaticContact CZ-CE2 3.7Å; F285-F291 HydrophobicContact CZ-CE2 3.7Å; F285-L313 HydrophobicContact CB-CD2 4.34Å; F285-L313 HydrophobicContact CD1-CD1 3.95Å; F285-L313 HydrophobicContact CD1-CG 4.17Å; F285-F316 HydrophobicContact CE1-CD1 4.01Å; F285-F316 HydrophobicContact CE1-CE1 4.01Å; F285-R317 HydrophobicContact CD1-CB 4.02Å; F285-R317 HydrophobicContact CD1-CG 4.26Å; F285-R317 HydrophobicContact CD2-CG 4.02Å; F285-R317 HydrophobicContact CE1-CB 3.71Å; F285-R317 HydrophobicContact CE1-CG 4Å; F285-R317 HydrophobicContact CE2-CB 4.38Å; F285-R317 HydrophobicContact CE2-CG 3.74Å; F285-R317 HydrophobicContact CG-CB 4.5Å; F285-R317 HydrophobicContact CG-CG 4.28Å; F285-R317 HydrophobicContact CZ-CB 3.91Å; F285-R317 HydrophobicContact CZ-CG 3.73Å; F285-F320 AromaticContact CZ-CD1 3.99Å; F285-F320 HydrophobicContact CZ-CD1 3.99Å; F285-E321 HydrophobicContact CE2-CG 4.4Å; F285-M359 HydrophobicContact CE2-CE 4.48Å
286	Y	86.2	Confident	88.1	Confident	56 Å²	56	41.7 Å²	41.7	22%	0.22	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	124	-173.1	-54.9	-108.6	0	0	0	110.2	G284 L290 K292 I358	G284-Y286 VanDerWaalsContact C-CE2 3.49Å; G284-Y286 WeakPolarHBondContact O-CD2 3.41Å; G284-Y286 WeakPolarHBondContact O-CE2 3.03Å; Y286-L290 PolarHBondContact N-O 2.87Å; Y286-L290 PolarHBondContact O-N 2.99Å; Y286-L290 VanDerWaalsContact O-N 3.11Å; Y286-K292 HydrophobicContact CD2-CB 4.39Å; Y286-K292 HydrophobicContact CE2-CB 3.65Å; Y286-K292 HydrophobicContact CE2-CD 4.4Å; Y286-I358 HydrophobicContact CE1-CD1 4.3Å; Y286-I358 HydrophobicContact CE1-CG1 4.1Å; Y286-I358 WeakPolarHBondContact OH-CD1 3.41Å; Y286-I358 WeakPolarHBondContact OH-CG1 3.49Å
287	G	84.7	Confident	87.6	Confident	69 Å²	69	49 Å²	49	71%	0.711	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	56	-145.6	-172.7	0	0	0	0	0	111.9	L313	G287-L313 WeakPolarHBondContact O-CD2 3.49Å
288	N	84.4	Confident	87	Confident	152 Å²	152	59.4 Å²	59.4	81%	0.813	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	1.6	-176.2	-62.8	4	0	0	0	113.5	L313	N288-L313 WeakPolarHBondContact O-CB 3.46Å
289	S	88.8	Confident	86.8	Confident	41 Å²	41	55.5 Å²	55.5	29%	0.287	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-146.7	-10.2	-177	61.4	0	0	0	0	117.9	R309 I310	S289-R309 CarbonylContact O-C 3.53Å; S289-R309 VanDerWaalsContact O-CA 3.26Å; S289-R309 WeakPolarHBondContact O-CA 3.37Å; S289-I310 VanDerWaalsContact CA-O 3.28Å; S289-I310 WeakPolarHBondContact CA-O 3.5Å; S289-I310 WeakPolarHBondContact CB-O 3.25Å; S289-I310 PolarHBondContact O-N 2.73Å
290	L	91.3	Very high	86.1	Confident	56 Å²	56	58 Å²	58	29%	0.293	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	129.2	-176.3	-173.9	72.9	0	0	0	112.1	Y286 L307	Y286-L290 PolarHBondContact N-O 2.87Å; Y286-L290 PolarHBondContact O-N 2.99Å; Y286-L290 VanDerWaalsContact O-N 3.11Å; L290-L307 HydrophobicContact CD1-CB 4.43Å; L290-L307 HydrophobicContact CD1-CD2 4.35Å; L290-L307 HydrophobicContact CD2-CD2 4.49Å
291	F	93.3	Very high	85.2	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	129.4	172.1	178.3	-124.8	0	0	0	109.5	L160 L167 F283 G284 F285 V293 F308 I310 L313 F316 F320	L160-F291 HydrophobicContact CD2-CD1 3.66Å; L160-F291 HydrophobicContact CD2-CE1 3.88Å; L167-F291 HydrophobicContact CD2-CE1 4Å; L167-F291 HydrophobicContact CD2-CZ 4.47Å; F283-F291 HydrophobicContact CB-CE2 3.97Å; F283-F291 HydrophobicContact CB-CZ 4.29Å; F283-F291 HydrophobicContact CD2-CE2 4.2Å; F283-F291 HydrophobicContact CG-CE2 4.4Å; G284-F291 WeakPolarHBondContact O-CA 3.26Å; F285-F291 AromaticContact CD1-CD2 3.58Å; F285-F291 HydrophobicContact CD1-CD2 3.58Å; F285-F291 HydrophobicContact CD1-CE2 4.15Å; F285-F291 HydrophobicContact CD1-CG 4.46Å; F285-F291 AromaticContact CE1-CD2 3.38Å; F285-F291 HydrophobicContact CE1-CD2 3.38Å; F285-F291 AromaticContact CE1-CE2 3.55Å; F285-F291 HydrophobicContact CE1-CE2 3.55Å; F285-F291 HydrophobicContact CE1-CG 4.31Å; F285-F291 HydrophobicContact CE2-CE2 4.41Å; F285-F291 HydrophobicContact CG-CD2 4.33Å; F285-F291 HydrophobicContact CZ-CD2 4Å; F285-F291 AromaticContact CZ-CE2 3.7Å; F285-F291 HydrophobicContact CZ-CE2 3.7Å; F291-V293 HydrophobicContact CD1-CG2 3.89Å; F291-V293 HydrophobicContact CE1-CG2 3.28Å; F291-V293 HydrophobicContact CE2-CG2 4.42Å; F291-V293 HydrophobicContact CZ-CG2 3.61Å; F291-F308 HydrophobicContact CB-CB 4.38Å; F291-F308 HydrophobicContact CD1-CB 4.48Å; F291-F308 AromaticContact CD1-CD2 3.82Å; F291-F308 HydrophobicContact CD1-CD2 3.82Å; F291-F308 HydrophobicContact CD1-CG 4.49Å; F291-F308 HydrophobicContact CE1-CD2 4.46Å; F291-F308 PolarHBondContact N-O 2.7Å; F291-F308 PolarHBondContact O-N 3.18Å; F291-I310 HydrophobicContact CB-CD1 3.77Å; F291-I310 HydrophobicContact CD1-CD1 4.2Å; F291-I310 HydrophobicContact CG-CD1 4.27Å; F291-L313 HydrophobicContact CB-CD1 3.93Å; F291-F316 AromaticContact CD1-CE1 3.64Å; F291-F316 HydrophobicContact CD1-CE1 3.64Å; F291-F316 HydrophobicContact CD1-CZ 4.14Å; F291-F316 HydrophobicContact CD2-CE1 4.09Å; F291-F316 AromaticContact CE1-CE1 3.58Å; F291-F316 HydrophobicContact CE1-CE1 3.58Å; F291-F316 AromaticContact CE1-CZ 3.73Å; F291-F316 HydrophobicContact CE1-CZ 3.73Å; F291-F316 HydrophobicContact CE2-CE1 4.04Å; F291-F316 AromaticContact CG-CE1 3.9Å; F291-F316 HydrophobicContact CG-CE1 3.9Å; F291-F316 AromaticContact CZ-CE1 3.79Å; F291-F316 HydrophobicContact CZ-CE1 3.79Å; F291-F316 HydrophobicContact CZ-CZ 4.06Å; F291-F320 HydrophobicContact CE2-CE1 4.36Å; F291-F320 HydrophobicContact CZ-CD1 4.35Å; F291-F320 HydrophobicContact CZ-CE1 4.04Å; F291-F320 HydrophobicContact CZ-CE2 4.24Å; F291-F320 AromaticContact CZ-CZ 3.99Å; F291-F320 HydrophobicContact CZ-CZ 3.99Å
292	K	93.4	Very high	84.5	Confident	68 Å²	68	58 Å²	58	30%	0.296	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	137.8	177.6	-173.6	174.3	179.7	171.6	0	110.2	F283 G284 Y286 Y306 L307	F283-K292 CarbonylContact C-O 3.58Å; F283-K292 WeakPolarHBondContact CA-O 3.08Å; F283-K292 WeakPolarHBondContact CB-O 3.38Å; G284-K292 PolarHBondContact N-O 2.91Å; G284-K292 PolarHBondContact O-N 2.86Å; Y286-K292 HydrophobicContact CD2-CB 4.39Å; Y286-K292 HydrophobicContact CE2-CB 3.65Å; Y286-K292 HydrophobicContact CE2-CD 4.4Å; K292-Y306 WeakPolarHBondContact CA-O 3.49Å; K292-L307 HydrophobicContact CB-CD2 3.84Å; K292-L307 HydrophobicContact CD-CD2 3.91Å; K292-L307 HydrophobicContact CG-CD2 3.68Å
293	V	91.8	Very high	84.1	Confident	1 Å²	1	55 Å²	55	1%	0.006	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	133.7	176.2	-177.8	0	0	0	0	109.6	L167 L280 F291 T295 L305 Y306 F308	L167-V293 HydrophobicContact CD2-CG1 4.39Å; L167-V293 HydrophobicContact CD2-CG2 3.81Å; L280-V293 HydrophobicContact CD1-CG1 4.25Å; L280-V293 HydrophobicContact CD2-CG1 3.56Å; L280-V293 HydrophobicContact CG-CG1 4.4Å; F291-V293 HydrophobicContact CD1-CG2 3.89Å; F291-V293 HydrophobicContact CE1-CG2 3.28Å; F291-V293 HydrophobicContact CE2-CG2 4.42Å; F291-V293 HydrophobicContact CZ-CG2 3.61Å; V293-T295 HydrophobicContact CG1-CG2 4.21Å; V293-L305 WeakPolarHBondContact O-CA 3.48Å; V293-Y306 PolarHBondContact N-O 2.95Å; V293-Y306 PolarHBondContact O-N 2.84Å; V293-F308 HydrophobicContact CB-CE2 4.42Å; V293-F308 HydrophobicContact CG2-CD2 4.32Å; V293-F308 HydrophobicContact CG2-CE2 3.93Å
294	E	89.6	Confident	83.7	Confident	38 Å²	38	55 Å²	55	18%	0.178	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	119.3	166.8	-176.2	-171.4	149.3	0	0	109.4	R281 R282 L305	R281-E294 HydrophobicContact CB-CG 4.23Å; R281-E294 WeakPolarHBondContact CD-OE1 3.34Å; R281-E294 IonicContact CZ-OE1 2.76Å; R281-E294 PolarHBondContact N-O 2.9Å; R281-E294 IonicContact NE-OE1 2.88Å; R281-E294 IonicContact NH1-OE1 3.43Å; R281-E294 PolarHBondContact NH1-OE1 2.91Å; R282-E294 HydrophobicContact CB-CB 4.05Å; R282-E294 WeakPolarHBondContact CD-OE2 3.27Å; R282-E294 HydrophobicContact CG-CB 4.49Å; R282-E294 VanDerWaalsContact CG-OE2 3.27Å; R282-E294 WeakPolarHBondContact CG-OE2 3.45Å; R282-E294 IonicContact NE-OE2 3.23Å; R282-E294 PolarHBondContact O-N 3.28Å; E294-L305 HydrophobicContact CB-CD2 3.65Å; E294-L305 HydrophobicContact CG-CD2 3.72Å
295	T	87.3	Confident	83.7	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	137.9	176.3	65.6	0	0	0	0	110.5	W275 L280 V293 A299 G302 E303 G304 Y306	W275-T295 HydrophobicContact CG-CG2 4.08Å; L280-T295 HydrophobicContact CD2-CG2 4.01Å; V293-T295 HydrophobicContact CG1-CG2 4.21Å; T295-A299 HydrophobicContact CG2-CB 4.27Å; T295-G302 PolarHBondContact OG1-O 3.19Å; T295-E303 WeakPolarHBondContact O-CA 3.32Å; T295-G304 PolarHBondContact N-O 2.92Å; T295-G304 PolarHBondContact O-N 2.93Å; T295-G304 PolarHBondContact OG1-N 2.71Å; T295-G304 VanDerWaalsContact OG1-N 3.09Å; T295-G304 PolarHBondContact OG1-O 2.94Å; T295-Y306 HydrophobicContact CG2-CD2 3.93Å; T295-Y306 HydrophobicContact CG2-CE2 3.7Å
296	G	80.9	Confident	83.6	Confident	7 Å²	7	55.6 Å²	55.6	7%	0.072	28%	0.283	C	S	.	.			trans	-84	170.8	171.9	0	0	0	0	0	112.6	T279 R298 A299	T279-G296 PolarHBondContact O-N 2.88Å; G296-R298 PolarHBondContact O-N 3.27Å; G296-A299 WeakPolarHBondContact O-CB 3.49Å; G296-A299 PolarHBondContact O-N 2.86Å
297	R	77.9	Confident	83.9	Confident	191 Å²	191	54.4 Å²	54.4	72%	0.721	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-9.8	178	-57	-178.7	-170.9	170.9	3.1	115.9	E303	R297-E303 HydrophobicContact CG-CB 3.97Å; R297-E303 WeakPolarHBondContact CG-OE2 3.48Å; R297-E303 IonicContact CZ-OE2 3.74Å; R297-E303 IonicContact NE-OE2 2.93Å; R297-E303 PolarHBondContact NE-OE2 2.92Å; R297-E303 IonicContact NH2-OE2 3.55Å
298	R	76.1	Confident	84.3	Confident	225 Å²	225	51.1 Å²	51.1	85%	0.849	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-9	175.7	-68.6	-175.1	177	178.9	-1.5	113.7	T279 G296	T279-R298 HydrophobicContact CG2-CB 4.15Å; T279-R298 WeakPolarHBondContact CG2-O 3.47Å; G296-R298 PolarHBondContact O-N 3.27Å
299	A	79.3	Confident	84.7	Confident	6 Å²	6	49.4 Å²	49.4	5%	0.05	23%	0.229	C	C	.	.	S	Bend	trans	-68.7	149.7	172.8	0	0	0	0	0	110.6	T295 G296 R301 G302	T295-A299 HydrophobicContact CG2-CB 4.27Å; G296-A299 WeakPolarHBondContact O-CB 3.49Å; G296-A299 PolarHBondContact O-N 2.86Å; A299-R301 PolarHBondContact O-N 2.8Å; A299-G302 PolarHBondContact O-N 2.76Å
300	P	70.1	Confident	84.9	Confident	68 Å²	68	47.5 Å²	47.5	44%	0.442	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-23.9	-175.5	-27.7	36	0	0	0	114.9	L7	L7-P300 HydrophobicContact CD2-CB 4.29Å
301	R	69.5	Low	84.6	Confident	67 Å²	67	53 Å²	53	25%	0.253	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.3	21	180	-62.7	-177.9	169.3	-140.2	-11.6	113.2	L182 L273 A299	L182-R301 VanDerWaalsContact C-NH1 3.33Å; L182-R301 VanDerWaalsContact O-CZ 3.25Å; L182-R301 PolarHBondContact O-NH1 3.13Å; L182-R301 PolarHBondContact O-NH2 2.83Å; L273-R301 VanDerWaalsContact CD2-CZ 3.46Å; A299-R301 PolarHBondContact O-N 2.8Å
302	G	69.8	Low	84.1	Confident	27 Å²	27	57.7 Å²	57.7	28%	0.278	26%	0.258	S	S	.	.			trans	70.5	-161.3	-179.1	0	0	0	0	0	114.3	T295 A299	T295-G302 PolarHBondContact OG1-O 3.19Å; A299-G302 PolarHBondContact O-N 2.76Å
303	E	79.1	Confident	83.9	Confident	59 Å²	59	54.9 Å²	54.9	28%	0.276	25%	0.246	S	C	.	.	S	Bend	trans	-80.5	128	-178.7	178.9	167.9	178.5	0	0	110.7	G60 R281 T295 R297	G60-E303 PolarHBondContact N-O 3.28Å; R281-E303 IonicContact CZ-OE1 2.7Å; R281-E303 VanDerWaalsContact CZ-OE1 3.26Å; R281-E303 IonicContact CZ-OE2 2.71Å; R281-E303 VanDerWaalsContact NH1-CD 3.29Å; R281-E303 IonicContact NH1-OE1 2.73Å; R281-E303 PolarHBondContact NH1-OE1 3.43Å; R281-E303 IonicContact NH1-OE2 2.93Å; R281-E303 IonicContact NH2-OE1 3.15Å; R281-E303 PolarHBondContact NH2-OE1 3.45Å; R281-E303 IonicContact NH2-OE2 3.79Å; R281-E303 PolarHBondContact NH2-OE2 2.83Å; T295-E303 WeakPolarHBondContact O-CA 3.32Å; R297-E303 HydrophobicContact CG-CB 3.97Å; R297-E303 WeakPolarHBondContact CG-OE2 3.48Å; R297-E303 IonicContact CZ-OE2 3.74Å; R297-E303 IonicContact NE-OE2 2.93Å; R297-E303 PolarHBondContact NE-OE2 2.92Å; R297-E303 IonicContact NH2-OE2 3.55Å
304	G	84.3	Confident	83.6	Confident	2 Å²	2	64.7 Å²	64.7	2%	0.021	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.9	168.3	-177.3	0	0	0	0	0	114.6	W58 T295	W58-G304 CarbonylContact O-C 3.46Å; W58-G304 WeakPolarHBondContact O-CA 3.33Å; T295-G304 PolarHBondContact N-O 2.92Å; T295-G304 PolarHBondContact O-N 2.93Å; T295-G304 PolarHBondContact OG1-N 2.71Å; T295-G304 VanDerWaalsContact OG1-N 3.09Å; T295-G304 PolarHBondContact OG1-O 2.94Å
305	L	87.6	Confident	83.5	Confident	34 Å²	34	67.3 Å²	67.3	18%	0.178	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	134.4	175.2	-62.2	173.1	0	0	0	109.8	I57 W58 V293 E294	I57-L305 WeakPolarHBondContact CA-O 3.1Å; W58-L305 HydrophobicContact CB-CB 4.29Å; W58-L305 HydrophobicContact CD2-CD1 4.46Å; W58-L305 HydrophobicContact CE3-CB 4.41Å; W58-L305 HydrophobicContact CE3-CD1 3.77Å; W58-L305 HydrophobicContact CE3-CG 3.89Å; W58-L305 HydrophobicContact CZ3-CD1 4.26Å; W58-L305 HydrophobicContact CZ3-CG 4.43Å; W58-L305 PolarHBondContact N-O 2.87Å; W58-L305 PolarHBondContact O-N 2.93Å; V293-L305 WeakPolarHBondContact O-CA 3.48Å; E294-L305 HydrophobicContact CB-CD2 3.65Å; E294-L305 HydrophobicContact CG-CD2 3.72Å
306	Y	91.2	Very high	83.6	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	135	177.7	-58.8	-96	0	0	0	109.5	L54 I57 L59 W275 K292 V293 T295	L54-Y306 HydrophobicContact CD1-CD1 4.26Å; I57-Y306 HydrophobicContact CD1-CD1 4.26Å; I57-Y306 HydrophobicContact CD1-CE1 4.36Å; I57-Y306 HydrophobicContact CG1-CD1 4Å; I57-Y306 HydrophobicContact CG1-CE1 4.42Å; I57-Y306 HydrophobicContact CG2-CD1 4.24Å; I57-Y306 HydrophobicContact CG2-CE1 4.03Å; L59-Y306 WeakPolarHBondContact CD2-OH 3.11Å; W275-Y306 HydrophobicContact CH2-CD1 4.19Å; W275-Y306 HydrophobicContact CH2-CE1 4.46Å; W275-Y306 HydrophobicContact CH2-CG 4.39Å; W275-Y306 AromaticContact CZ2-CD1 3.73Å; W275-Y306 HydrophobicContact CZ2-CD1 3.73Å; W275-Y306 HydrophobicContact CZ2-CD2 4.1Å; W275-Y306 AromaticContact CZ2-CE1 3.63Å; W275-Y306 HydrophobicContact CZ2-CE1 3.63Å; W275-Y306 HydrophobicContact CZ2-CE2 4.03Å; W275-Y306 AromaticContact CZ2-CG 3.96Å; W275-Y306 HydrophobicContact CZ2-CG 3.96Å; W275-Y306 AromaticContact CZ2-CZ 3.79Å; W275-Y306 AromaticContact NE1-CE2 3.93Å; K292-Y306 WeakPolarHBondContact CA-O 3.49Å; V293-Y306 PolarHBondContact N-O 2.95Å; V293-Y306 PolarHBondContact O-N 2.84Å; T295-Y306 HydrophobicContact CG2-CD2 3.93Å; T295-Y306 HydrophobicContact CG2-CE2 3.7Å
307	L	92.1	Very high	84	Confident	31 Å²	31	71.8 Å²	71.8	16%	0.162	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	122.2	178.9	-68	168.3	0	0	0	109.9	L54 C55 G56 L151 L290 K292	L54-L307 CarbonylContact C-O 3.57Å; L54-L307 WeakPolarHBondContact CA-O 3.41Å; L54-L307 WeakPolarHBondContact CD1-O 3.2Å; C55-L307 PolarHBondContact N-O 2.9Å; C55-L307 PolarHBondContact SG-O 2.9Å; C55-L307 VanDerWaalsContact SG-O 3.33Å; G56-L307 PolarHBondContact O-N 2.94Å; L151-L307 HydrophobicContact CD1-CD1 4.4Å; L151-L307 HydrophobicContact CD2-CD1 4.49Å; L290-L307 HydrophobicContact CD1-CB 4.43Å; L290-L307 HydrophobicContact CD1-CD2 4.35Å; L290-L307 HydrophobicContact CD2-CD2 4.49Å; K292-L307 HydrophobicContact CB-CD2 3.84Å; K292-L307 HydrophobicContact CD-CD2 3.91Å; K292-L307 HydrophobicContact CG-CD2 3.68Å
308	F	93.6	Very high	84.4	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	133.6	178.5	-54.9	-88.2	0	0	0	110.4	E53 L54 L160 F169 W275 F291 V293 I310	E53-F308 CarbonylContact O-C 3.55Å; E53-F308 WeakPolarHBondContact O-CA 3.3Å; L54-F308 HydrophobicContact CB-CD1 4.08Å; L54-F308 HydrophobicContact CB-CE1 4.14Å; L54-F308 HydrophobicContact CD1-CD1 3.97Å; L54-F308 HydrophobicContact CD1-CE1 3.63Å; L54-F308 HydrophobicContact CD1-CZ 4Å; L54-F308 HydrophobicContact CD2-CE1 4.47Å; L54-F308 HydrophobicContact CG-CE1 4.29Å; L160-F308 HydrophobicContact CD1-CD1 4.17Å; L160-F308 HydrophobicContact CD1-CE1 3.93Å; L160-F308 HydrophobicContact CD1-CE2 4.47Å; L160-F308 HydrophobicContact CD1-CZ 4.09Å; L160-F308 HydrophobicContact CD2-CB 4.41Å; L160-F308 HydrophobicContact CD2-CD1 4.49Å; L160-F308 HydrophobicContact CD2-CD2 4.36Å; L160-F308 HydrophobicContact CD2-CG 4.18Å; F169-F308 HydrophobicContact CB-CE1 3.82Å; F169-F308 HydrophobicContact CB-CZ 4.35Å; F169-F308 HydrophobicContact CD1-CE1 4.44Å; F169-F308 AromaticContact CD2-CD1 3.8Å; F169-F308 HydrophobicContact CD2-CD1 3.8Å; F169-F308 AromaticContact CD2-CE1 3.57Å; F169-F308 HydrophobicContact CD2-CE1 3.57Å; F169-F308 HydrophobicContact CE2-CD1 4.17Å; F169-F308 HydrophobicContact CE2-CE1 4.23Å; F169-F308 HydrophobicContact CG-CD1 4.37Å; F169-F308 AromaticContact CG-CE1 3.68Å; F169-F308 HydrophobicContact CG-CE1 3.68Å; W275-F308 HydrophobicContact CH2-CE1 4.39Å; W275-F308 AromaticContact CH2-CZ 3.64Å; W275-F308 HydrophobicContact CH2-CZ 3.64Å; W275-F308 AromaticContact CZ3-CZ 3.74Å; W275-F308 HydrophobicContact CZ3-CZ 3.74Å; F291-F308 HydrophobicContact CB-CB 4.38Å; F291-F308 HydrophobicContact CD1-CB 4.48Å; F291-F308 AromaticContact CD1-CD2 3.82Å; F291-F308 HydrophobicContact CD1-CD2 3.82Å; F291-F308 HydrophobicContact CD1-CG 4.49Å; F291-F308 HydrophobicContact CE1-CD2 4.46Å; F291-F308 PolarHBondContact N-O 2.7Å; F291-F308 PolarHBondContact O-N 3.18Å; V293-F308 HydrophobicContact CB-CE2 4.42Å; V293-F308 HydrophobicContact CG2-CD2 4.32Å; V293-F308 HydrophobicContact CG2-CE2 3.93Å; F308-I310 HydrophobicContact CB-CD1 4.39Å; F308-I310 HydrophobicContact CB-CG1 4.16Å
309	R	92.3	Very high	84.8	Confident	117 Å²	117	60.2 Å²	60.2	44%	0.442	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	112.7	170.6	-170.2	-160.7	-170.9	-172.2	3.1	109.4	A52 E53 S289	A52-R309 CarbonylContact C-O 3.56Å; A52-R309 WeakPolarHBondContact CA-O 3.36Å; E53-R309 HydrophobicContact CB-CB 4.24Å; E53-R309 PolarHBondContact N-O 3.03Å; E53-R309 PolarHBondContact O-N 3.39Å; E53-R309 WeakPolarHBondContact OE2-CD 3.47Å; E53-R309 IonicContact OE2-CZ 2.92Å; E53-R309 IonicContact OE2-NE 3.26Å; E53-R309 IonicContact OE2-NH1 3.97Å; E53-R309 PolarHBondContact OE2-NH1 2.95Å; S289-R309 CarbonylContact O-C 3.53Å; S289-R309 VanDerWaalsContact O-CA 3.26Å; S289-R309 WeakPolarHBondContact O-CA 3.37Å
310	I	92.1	Very high	85.2	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.005	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	127	-171.4	-50.4	176.5	0	0	0	108	H50 A52 L160 S289 F291 F308 H312 L313 F316	H50-I310 HydrophobicContact CB-CG2 4.08Å; A52-I310 HydrophobicContact CB-CG1 4.07Å; L160-I310 HydrophobicContact CD2-CD1 3.54Å; L160-I310 HydrophobicContact CD2-CG1 4.47Å; S289-I310 VanDerWaalsContact CA-O 3.28Å; S289-I310 WeakPolarHBondContact CA-O 3.5Å; S289-I310 WeakPolarHBondContact CB-O 3.25Å; S289-I310 PolarHBondContact O-N 2.73Å; F291-I310 HydrophobicContact CB-CD1 3.77Å; F291-I310 HydrophobicContact CD1-CD1 4.2Å; F291-I310 HydrophobicContact CG-CD1 4.27Å; F308-I310 HydrophobicContact CB-CD1 4.39Å; F308-I310 HydrophobicContact CB-CG1 4.16Å; I310-H312 VanDerWaalsContact C-N 3.32Å; I310-H312 PolarHBondContact O-N 2.79Å; I310-L313 HydrophobicContact CB-CD1 4.11Å; I310-L313 HydrophobicContact CD1-CD1 4.03Å; I310-L313 HydrophobicContact CG1-CD1 4.39Å; I310-F316 HydrophobicContact CD1-CD1 3.45Å; I310-F316 VanDerWaalsContact CD1-CD1 3.45Å; I310-F316 HydrophobicContact CD1-CE1 3.77Å; I310-F316 HydrophobicContact CD1-CG 3.94Å; I310-F316 HydrophobicContact CD1-CZ 4.48Å; I310-F316 HydrophobicContact CG2-CB 4.27Å
311	K	85.4	Confident	85.9	Confident	171 Å²	171	59.1 Å²	59.1	74%	0.743	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-33.7	-178.6	-69.2	-176.7	179.3	179.3	0	113
312	H	83.7	Confident	86.5	Confident	98 Å²	98	58.6 Å²	58.6	45%	0.454	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.5	57.9	-175.3	-61.1	-69	0	0	0	110	I310 R314 E315 F316	I310-H312 VanDerWaalsContact C-N 3.32Å; I310-H312 PolarHBondContact O-N 2.79Å; H312-R314 VanDerWaalsContact C-N 3.28Å; H312-R314 PolarHBondContact O-N 2.83Å; H312-E315 VanDerWaalsContact CA-OE2 3.25Å; H312-E315 WeakPolarHBondContact CA-OE2 3.37Å; H312-E315 HydrophobicContact CB-CB 4.25Å; H312-E315 HydrophobicContact CB-CG 4.34Å; H312-E315 WeakPolarHBondContact CB-OE2 3.3Å; H312-E315 PolarHBondContact O-N 3.36Å; H312-F316 PolarHBondContact O-N 2.93Å
313	L	88.2	Confident	87	Confident	9 Å²	9	57.7 Å²	57.7	5%	0.047	26%	0.255	C	S	.	.	H	α-helix	trans	-64.3	-32	-173.5	-169.5	74.1	0	0	0	112.5	F285 G287 N288 F291 I310 R317	F285-L313 HydrophobicContact CB-CD2 4.34Å; F285-L313 HydrophobicContact CD1-CD1 3.95Å; F285-L313 HydrophobicContact CD1-CG 4.17Å; G287-L313 WeakPolarHBondContact O-CD2 3.49Å; N288-L313 WeakPolarHBondContact O-CB 3.46Å; F291-L313 HydrophobicContact CB-CD1 3.93Å; I310-L313 HydrophobicContact CB-CD1 4.11Å; I310-L313 HydrophobicContact CD1-CD1 4.03Å; I310-L313 HydrophobicContact CG1-CD1 4.39Å; L313-R317 WeakPolarHBondContact O-CB 3.43Å; L313-R317 PolarHBondContact O-N 3.16Å
314	R	86.5	Confident	87.1	Confident	208 Å²	208	55.3 Å²	55.3	79%	0.785	24%	0.244	S	C	*	.	H	α-helix	trans	-69.2	-38.3	-179.7	-176.4	-176.3	-172.3	-178.7	2	111.2	H312 K318	H312-R314 VanDerWaalsContact C-N 3.28Å; H312-R314 PolarHBondContact O-N 2.83Å; R314-K318 PolarHBondContact O-N 3.33Å
315	E	86.4	Confident	86.7	Confident	93 Å²	93	59.5 Å²	59.5	44%	0.435	26%	0.264	S	S	.	.	H	α-helix	trans	-72	-52.1	179.8	-62.1	61.8	-136.8	0	0	109.5	H312 R317 K318 S319	H312-E315 VanDerWaalsContact CA-OE2 3.25Å; H312-E315 WeakPolarHBondContact CA-OE2 3.37Å; H312-E315 HydrophobicContact CB-CB 4.25Å; H312-E315 HydrophobicContact CB-CG 4.34Å; H312-E315 WeakPolarHBondContact CB-OE2 3.3Å; H312-E315 PolarHBondContact O-N 3.36Å; E315-R317 VanDerWaalsContact C-N 3.29Å; E315-R317 PolarHBondContact O-N 3.32Å; E315-K318 PolarHBondContact O-N 2.87Å; E315-K318 VanDerWaalsContact O-N 3.08Å; E315-S319 PolarHBondContact O-N 3.41Å; E315-S319 PolarHBondContact O-OG 3.01Å
316	F	89.5	Confident	86.1	Confident	1 Å²	1	61 Å²	61	0%	0.004	27%	0.27	C	S	.	.	H	α-helix	trans	-57.9	-40	174	172.7	-105.2	0	0	0	112.3	H50 L160 L167 F285 F291 I310 H312 K318 S319 F320	H50-F316 HydrophobicContact CB-CB 4.23Å; H50-F316 HydrophobicContact CB-CD2 4.35Å; H50-F316 AromaticContact CD2-CD2 3.6Å; H50-F316 PolarHBondContact CE1-N 3.27Å; H50-F316 VanDerWaalsContact CE1-N 3.34Å; L160-F316 HydrophobicContact CD2-CE1 3.83Å; L160-F316 HydrophobicContact CD2-CE2 3.79Å; L160-F316 HydrophobicContact CD2-CZ 3.41Å; L160-F316 VanDerWaalsContact CD2-CZ 3.41Å; L160-F316 HydrophobicContact CG-CE2 3.98Å; L160-F316 HydrophobicContact CG-CZ 4.03Å; L167-F316 HydrophobicContact CD1-CE2 4.36Å; L167-F316 HydrophobicContact CD1-CZ 4.03Å; F285-F316 HydrophobicContact CE1-CD1 4.01Å; F285-F316 HydrophobicContact CE1-CE1 4.01Å; F291-F316 AromaticContact CD1-CE1 3.64Å; F291-F316 HydrophobicContact CD1-CE1 3.64Å; F291-F316 HydrophobicContact CD1-CZ 4.14Å; F291-F316 HydrophobicContact CD2-CE1 4.09Å; F291-F316 AromaticContact CE1-CE1 3.58Å; F291-F316 HydrophobicContact CE1-CE1 3.58Å; F291-F316 AromaticContact CE1-CZ 3.73Å; F291-F316 HydrophobicContact CE1-CZ 3.73Å; F291-F316 HydrophobicContact CE2-CE1 4.04Å; F291-F316 AromaticContact CG-CE1 3.9Å; F291-F316 HydrophobicContact CG-CE1 3.9Å; F291-F316 AromaticContact CZ-CE1 3.79Å; F291-F316 HydrophobicContact CZ-CE1 3.79Å; F291-F316 HydrophobicContact CZ-CZ 4.06Å; I310-F316 HydrophobicContact CD1-CD1 3.45Å; I310-F316 VanDerWaalsContact CD1-CD1 3.45Å; I310-F316 HydrophobicContact CD1-CE1 3.77Å; I310-F316 HydrophobicContact CD1-CG 3.94Å; I310-F316 HydrophobicContact CD1-CZ 4.48Å; I310-F316 HydrophobicContact CG2-CB 4.27Å; H312-F316 PolarHBondContact O-N 2.93Å; F316-K318 VanDerWaalsContact C-N 3.31Å; F316-K318 PolarHBondContact O-N 3.49Å; F316-S319 PolarHBondContact O-N 3.02Å; F316-S319 PolarHBondContact O-OG 3.08Å; F316-S319 VanDerWaalsContact O-OG 3.07Å; F316-F320 HydrophobicContact CE1-CB 4.17Å; F316-F320 HydrophobicContact CE1-CG 4.32Å; F316-F320 HydrophobicContact CE2-CB 4.14Å; F316-F320 HydrophobicContact CE2-CD2 4.31Å; F316-F320 HydrophobicContact CZ-CB 3.9Å; F316-F320 AromaticContact CZ-CD2 3.77Å; F316-F320 HydrophobicContact CZ-CD2 3.77Å; F316-F320 AromaticContact CZ-CG 3.96Å; F316-F320 HydrophobicContact CZ-CG 3.96Å; F316-F320 WeakPolarHBondContact O-CB 3.45Å; F316-F320 PolarHBondContact O-N 3.26Å
317	R	90.2	Very high	84.8	Confident	100 Å²	100	64 Å²	64	38%	0.377	28%	0.283	S	S	.	.	H	α-helix	trans	-59.2	-43.4	176	175.3	171.1	-178	-167.8	-2.3	111.3	F285 L313 E315 E321	F285-R317 HydrophobicContact CD1-CB 4.02Å; F285-R317 HydrophobicContact CD1-CG 4.26Å; F285-R317 HydrophobicContact CD2-CG 4.02Å; F285-R317 HydrophobicContact CE1-CB 3.71Å; F285-R317 HydrophobicContact CE1-CG 4Å; F285-R317 HydrophobicContact CE2-CB 4.38Å; F285-R317 HydrophobicContact CE2-CG 3.74Å; F285-R317 HydrophobicContact CG-CB 4.5Å; F285-R317 HydrophobicContact CG-CG 4.28Å; F285-R317 HydrophobicContact CZ-CB 3.91Å; F285-R317 HydrophobicContact CZ-CG 3.73Å; L313-R317 WeakPolarHBondContact O-CB 3.43Å; L313-R317 PolarHBondContact O-N 3.16Å; E315-R317 VanDerWaalsContact C-N 3.29Å; E315-R317 PolarHBondContact O-N 3.32Å; R317-E321 HydrophobicContact CG-CG 4.17Å; R317-E321 WeakPolarHBondContact CG-OE2 3.32Å; R317-E321 IonicContact CZ-OE1 3.23Å; R317-E321 VanDerWaalsContact CZ-OE1 3.23Å; R317-E321 IonicContact CZ-OE2 3.88Å; R317-E321 VanDerWaalsContact NE-CD 3.26Å; R317-E321 IonicContact NE-OE1 2.78Å; R317-E321 PolarHBondContact NE-OE1 3.45Å; R317-E321 IonicContact NE-OE2 3.22Å; R317-E321 PolarHBondContact NE-OE2 2.82Å; R317-E321 IonicContact NH2-OE1 2.79Å; R317-E321 PolarHBondContact NH2-OE1 3.17Å; R317-E321 IonicContact NH2-OE2 3.71Å; R317-E321 VanDerWaalsContact O-CB 3.27Å; R317-E321 WeakPolarHBondContact O-CB 3.34Å; R317-E321 WeakPolarHBondContact O-CG 3.44Å; R317-E321 PolarHBondContact O-N 3.03Å
318	K	85.8	Confident	83.3	Confident	156 Å²	156	66.2 Å²	66.2	68%	0.678	29%	0.29	S	S	*	.	H	α-helix	trans	-64.7	-46.7	-179.7	-170	-177.9	177.7	-174.1	0	111.5	R314 E315 F316 T322	R314-K318 PolarHBondContact O-N 3.33Å; E315-K318 PolarHBondContact O-N 2.87Å; E315-K318 VanDerWaalsContact O-N 3.08Å; F316-K318 VanDerWaalsContact C-N 3.31Å; F316-K318 PolarHBondContact O-N 3.49Å; K318-T322 PolarHBondContact O-N 2.88Å; K318-T322 VanDerWaalsContact O-N 3.17Å; K318-T322 PolarHBondContact O-OG1 3.42Å
319	S	83.5	Confident	81.3	Confident	16 Å²	16	72.4 Å²	72.4	11%	0.112	32%	0.323	C	S	.	.	H	α-helix	trans	-65	-48.3	177.2	52.3	0	0	0	0	111.5	H50 E315 F316 E321 T322 C323	H50-S319 PolarHBondContact NE2-OG 3.3Å; E315-S319 PolarHBondContact O-N 3.41Å; E315-S319 PolarHBondContact O-OG 3.01Å; F316-S319 PolarHBondContact O-N 3.02Å; F316-S319 PolarHBondContact O-OG 3.08Å; F316-S319 VanDerWaalsContact O-OG 3.07Å; S319-E321 PolarHBondContact O-N 2.85Å; S319-T322 WeakPolarHBondContact O-CB 3.39Å; S319-T322 PolarHBondContact O-N 3.02Å; S319-C323 PolarHBondContact O-N 3.38Å; S319-C323 PolarHBondContact O-SG 3.36Å
320	F	88.4	Confident	79.2	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-61.1	-45.4	179.7	-174.8	-95.3	0	0	0	113.1	V162 L167 L277 L280 F283 F285 F291 F316 T322 C323 V324	V162-F320 HydrophobicContact CG2-CD2 3.66Å; V162-F320 HydrophobicContact CG2-CE2 4.31Å; L167-F320 HydrophobicContact CB-CE2 4.33Å; L167-F320 HydrophobicContact CD1-CD2 4.07Å; L167-F320 HydrophobicContact CD1-CE2 3.87Å; L167-F320 HydrophobicContact CD2-CE2 4.22Å; L167-F320 HydrophobicContact CG-CE2 4.37Å; L277-F320 HydrophobicContact CD2-CE2 3.66Å; L277-F320 HydrophobicContact CD2-CZ 4Å; L280-F320 HydrophobicContact CD1-CZ 4.12Å; F283-F320 AromaticContact CD1-CE1 3.93Å; F283-F320 HydrophobicContact CD1-CE1 3.93Å; F283-F320 HydrophobicContact CD1-CZ 4.29Å; F283-F320 HydrophobicContact CD2-CD1 4.47Å; F283-F320 AromaticContact CD2-CE1 3.8Å; F283-F320 HydrophobicContact CD2-CE1 3.8Å; F283-F320 AromaticContact CE1-CE1 3.78Å; F283-F320 HydrophobicContact CE1-CE1 3.78Å; F283-F320 HydrophobicContact CE1-CZ 4.35Å; F283-F320 HydrophobicContact CE2-CD1 4.14Å; F283-F320 AromaticContact CE2-CE1 3.64Å; F283-F320 HydrophobicContact CE2-CE1 3.64Å; F283-F320 AromaticContact CG-CE1 3.94Å; F283-F320 HydrophobicContact CG-CE1 3.94Å; F283-F320 HydrophobicContact CG-CZ 4.49Å; F283-F320 HydrophobicContact CZ-CD1 4.34Å; F283-F320 AromaticContact CZ-CE1 3.62Å; F283-F320 HydrophobicContact CZ-CE1 3.62Å; F285-F320 AromaticContact CZ-CD1 3.99Å; F285-F320 HydrophobicContact CZ-CD1 3.99Å; F291-F320 HydrophobicContact CE2-CE1 4.36Å; F291-F320 HydrophobicContact CZ-CD1 4.35Å; F291-F320 HydrophobicContact CZ-CE1 4.04Å; F291-F320 HydrophobicContact CZ-CE2 4.24Å; F291-F320 AromaticContact CZ-CZ 3.99Å; F291-F320 HydrophobicContact CZ-CZ 3.99Å; F316-F320 HydrophobicContact CE1-CB 4.17Å; F316-F320 HydrophobicContact CE1-CG 4.32Å; F316-F320 HydrophobicContact CE2-CB 4.14Å; F316-F320 HydrophobicContact CE2-CD2 4.31Å; F316-F320 HydrophobicContact CZ-CB 3.9Å; F316-F320 AromaticContact CZ-CD2 3.77Å; F316-F320 HydrophobicContact CZ-CD2 3.77Å; F316-F320 AromaticContact CZ-CG 3.96Å; F316-F320 HydrophobicContact CZ-CG 3.96Å; F316-F320 WeakPolarHBondContact O-CB 3.45Å; F316-F320 PolarHBondContact O-N 3.26Å; F320-T322 VanDerWaalsContact C-N 3.33Å; F320-T322 PolarHBondContact O-N 2.83Å; F320-C323 PolarHBondContact O-N 3.09Å; F320-V324 HydrophobicContact CD1-CG2 4.16Å; F320-V324 HydrophobicContact CE1-CG2 3.75Å; F320-V324 HydrophobicContact CE2-CG2 4.39Å; F320-V324 HydrophobicContact CZ-CG2 3.87Å; F320-V324 WeakPolarHBondContact O-CG2 3.34Å; F320-V324 PolarHBondContact O-N 3.12Å
321	E	84.9	Confident	76.8	Confident	51 Å²	51	76 Å²	76	24%	0.238	35%	0.351	C	S	.	.	H	α-helix	trans	-62.6	-39	176.1	-74.4	178	158	0	0	111.3	F285 R317 S319 V324 H325	F285-E321 HydrophobicContact CE2-CG 4.4Å; R317-E321 HydrophobicContact CG-CG 4.17Å; R317-E321 WeakPolarHBondContact CG-OE2 3.32Å; R317-E321 IonicContact CZ-OE1 3.23Å; R317-E321 VanDerWaalsContact CZ-OE1 3.23Å; R317-E321 IonicContact CZ-OE2 3.88Å; R317-E321 VanDerWaalsContact NE-CD 3.26Å; R317-E321 IonicContact NE-OE1 2.78Å; R317-E321 PolarHBondContact NE-OE1 3.45Å; R317-E321 IonicContact NE-OE2 3.22Å; R317-E321 PolarHBondContact NE-OE2 2.82Å; R317-E321 IonicContact NH2-OE1 2.79Å; R317-E321 PolarHBondContact NH2-OE1 3.17Å; R317-E321 IonicContact NH2-OE2 3.71Å; R317-E321 VanDerWaalsContact O-CB 3.27Å; R317-E321 WeakPolarHBondContact O-CB 3.34Å; R317-E321 WeakPolarHBondContact O-CG 3.44Å; R317-E321 PolarHBondContact O-N 3.03Å; S319-E321 PolarHBondContact O-N 2.85Å; E321-V324 PolarHBondContact O-N 2.7Å; E321-H325 PolarHBondContact O-N 3.28Å; E321-H325 PolarHBondContact O-ND1 3.35Å
322	T	81.8	Confident	74.4	Confident	56 Å²	56	71.5 Å²	71.5	34%	0.344	34%	0.34	S	S	.	.	H	α-helix	trans	-61.5	-46.5	174	-62.5	0	0	0	0	112.1	L46 K318 S319 F320 V324 H325 Q326	L46-T322 HydrophobicContact CD1-CG2 4.15Å; K318-T322 PolarHBondContact O-N 2.88Å; K318-T322 VanDerWaalsContact O-N 3.17Å; K318-T322 PolarHBondContact O-OG1 3.42Å; S319-T322 WeakPolarHBondContact O-CB 3.39Å; S319-T322 PolarHBondContact O-N 3.02Å; F320-T322 VanDerWaalsContact C-N 3.33Å; F320-T322 PolarHBondContact O-N 2.83Å; T322-V324 PolarHBondContact O-N 2.8Å; T322-H325 PolarHBondContact O-N 3.03Å; T322-Q326 HydrophobicContact CG2-CG 4.49Å; T322-Q326 WeakPolarHBondContact O-CG 3.28Å; T322-Q326 PolarHBondContact O-N 2.99Å
323	C	80.6	Confident	72.1	Confident	8 Å²	8	72.8 Å²	72.8	5%	0.054	36%	0.355	C	S	.	.	H	α-helix	trans	-60.9	-43.4	179	-60.4	0	0	0	0	112.3	V162 L277 S319 F320 H325 Q326 H327	V162-C323 HydrophobicContact CB-CB 4.33Å; V162-C323 HydrophobicContact CG1-CB 3.79Å; V162-C323 HydrophobicContact CG2-CB 4.38Å; L277-C323 HydrophobicContact CD1-CB 4.35Å; S319-C323 PolarHBondContact O-N 3.38Å; S319-C323 PolarHBondContact O-SG 3.36Å; F320-C323 PolarHBondContact O-N 3.09Å; C323-H325 VanDerWaalsContact C-N 3.29Å; C323-H325 PolarHBondContact O-N 2.99Å; C323-Q326 PolarHBondContact O-N 3.2Å; C323-H327 WeakPolarHBondContact O-CB 3.32Å; C323-H327 PolarHBondContact O-N 3.4Å
324	V	81.2	Confident	69.5	Low	9 Å²	9	80.5 Å²	80.5	6%	0.055	39%	0.39	C	S	.	.	H	α-helix	trans	-65.2	-31.6	179	171	0	0	0	0	112.1	L277 F283 F320 E321 T322 R328 F361	L277-V324 HydrophobicContact CD1-CG2 4.27Å; L277-V324 HydrophobicContact CD2-CG2 4.16Å; F283-V324 HydrophobicContact CZ-CG1 4.47Å; F320-V324 HydrophobicContact CD1-CG2 4.16Å; F320-V324 HydrophobicContact CE1-CG2 3.75Å; F320-V324 HydrophobicContact CE2-CG2 4.39Å; F320-V324 HydrophobicContact CZ-CG2 3.87Å; F320-V324 WeakPolarHBondContact O-CG2 3.34Å; F320-V324 PolarHBondContact O-N 3.12Å; E321-V324 PolarHBondContact O-N 2.7Å; T322-V324 PolarHBondContact O-N 2.8Å; V324-R328 PolarHBondContact O-N 2.83Å; V324-F361 HydrophobicContact CG1-CE1 4.34Å
325	H	75.5	Confident	67	Low	91 Å²	91	77.7 Å²	77.7	42%	0.421	39%	0.386	S	S	.	.	H	α-helix	trans	-72.1	-52	173.4	-75.8	78.2	0	0	0	111.7	E321 T322 C323 H327 R328 D329	E321-H325 PolarHBondContact O-N 3.28Å; E321-H325 PolarHBondContact O-ND1 3.35Å; T322-H325 PolarHBondContact O-N 3.03Å; C323-H325 VanDerWaalsContact C-N 3.29Å; C323-H325 PolarHBondContact O-N 2.99Å; H325-H327 VanDerWaalsContact C-N 3.28Å; H325-H327 PolarHBondContact O-N 3.16Å; H325-R328 WeakPolarHBondContact O-CA 3.27Å; H325-R328 VanDerWaalsContact O-CB 3.29Å; H325-R328 WeakPolarHBondContact O-CB 2.95Å; H325-R328 PolarHBondContact O-N 3.36Å; H325-D329 PolarHBondContact O-N 3.39Å
326	Q	74.4	Confident	64.4	Low	65 Å²	65	76.5 Å²	76.5	30%	0.304	38%	0.382	S	S	.	.	H	α-helix	trans	-56.2	-42	178.8	-70.6	173.2	-19	0	0	112.3	T322 C323 R328 D329 N330	T322-Q326 HydrophobicContact CG2-CG 4.49Å; T322-Q326 WeakPolarHBondContact O-CG 3.28Å; T322-Q326 PolarHBondContact O-N 2.99Å; C323-Q326 PolarHBondContact O-N 3.2Å; Q326-R328 PolarHBondContact O-N 3.36Å; Q326-D329 PolarHBondContact O-N 2.8Å; Q326-N330 PolarHBondContact O-N 3.36Å
327	H	65.9	Low	61.6	Low	63 Å²	63	80 Å²	80	29%	0.292	41%	0.407	S	S	.	.	H	α-helix	trans	-70.6	-18.2	179.3	-150.8	-46.4	0	0	0	113.4	G165 L277 C323 H325 L331	G165-H327 VanDerWaalsContact CA-CD2 3.47Å; G165-H327 WeakPolarHBondContact CA-CD2 3.18Å; L277-H327 HydrophobicContact CD1-CB 4.38Å; C323-H327 WeakPolarHBondContact O-CB 3.32Å; C323-H327 PolarHBondContact O-N 3.4Å; H325-H327 VanDerWaalsContact C-N 3.28Å; H325-H327 PolarHBondContact O-N 3.16Å; H327-L331 WeakPolarHBondContact O-CD1 3.25Å; H327-L331 WeakPolarHBondContact O-CG 3.17Å
328	R	58.7	Low	58.9	Low	77 Å²	77	79 Å²	79	29%	0.291	41%	0.412	S	S	.	.	H	α-helix	trans	-77.1	-42.2	171.4	-170.8	-164.8	-177.2	-165.9	-0.5	111.5	V324 H325 Q326 N330 L331 L336	V324-R328 PolarHBondContact O-N 2.83Å; H325-R328 WeakPolarHBondContact O-CA 3.27Å; H325-R328 VanDerWaalsContact O-CB 3.29Å; H325-R328 WeakPolarHBondContact O-CB 2.95Å; H325-R328 PolarHBondContact O-N 3.36Å; Q326-R328 PolarHBondContact O-N 3.36Å; R328-N330 PolarHBondContact O-N 3.45Å; R328-L331 WeakPolarHBondContact O-CB 3.42Å; R328-L331 PolarHBondContact O-N 3.04Å; R328-L336 HydrophobicContact CG-CD1 4.31Å
329	D	52.8	Low	56.3	Low	131 Å²	131	74.4 Å²	74.4	70%	0.701	40%	0.403	S	S	*	.	H	α-helix	trans	-69.1	-27.2	-177.5	-61.1	-31.2	0	0	0	111.5	H325 Q326	H325-D329 PolarHBondContact O-N 3.39Å; Q326-D329 PolarHBondContact O-N 2.8Å
330	N	48.5	Very low	53.9	Low	139 Å²	139	79.3 Å²	79.3	74%	0.743	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-11.8	169.6	-70	-18	0	0	0	114.5	Q326 R328 S332	Q326-N330 PolarHBondContact O-N 3.36Å; R328-N330 PolarHBondContact O-N 3.45Å; N330-S332 PolarHBondContact O-N 2.67Å
331	L	41.4	Very low	51.2	Low	55 Å²	55	84.7 Å²	84.7	29%	0.288	47%	0.465	S	S	.	.	S	Bend	trans	-84.9	103.4	172.9	-80	164.8	0	0	0	109.2	V278 H327 R328	V278-L331 HydrophobicContact CG1-CD1 3.98Å; H327-L331 WeakPolarHBondContact O-CD1 3.25Å; H327-L331 WeakPolarHBondContact O-CG 3.17Å; R328-L331 WeakPolarHBondContact O-CB 3.42Å; R328-L331 PolarHBondContact O-N 3.04Å
332	S	34.9	Very low	48.7	Very low	75 Å²	75	89.2 Å²	89.2	52%	0.524	49%	0.486	S	S	.	.			trans	-52.6	142.8	-174.1	69.3	0	0	0	0	112.9	N330 H334 Q335	N330-S332 PolarHBondContact O-N 2.67Å; S332-H334 PolarHBondContact O-N 3Å; S332-Q335 PolarHBondContact O-N 2.9Å
333	V	34.9	Very low	46.3	Very low	125 Å²	125	90.9 Å²	90.9	76%	0.758	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-49.7	-28.4	-169.5	-179.4	0	0	0	0	113.5	Q335 L336	V333-Q335 VanDerWaalsContact C-N 3.28Å; V333-Q335 PolarHBondContact O-N 3.11Å; V333-L336 PolarHBondContact O-N 2.81Å
334	H	34.2	Very low	43.9	Very low	171 Å²	171	101.4 Å²	101.4	79%	0.792	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-58.2	-27.1	176.2	-84	-78.9	0	0	0	115.6	S332	S332-H334 PolarHBondContact O-N 3Å
335	Q	33.9	Very low	41.8	Very low	149 Å²	149	105.8 Å²	105.8	70%	0.696	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-89.1	-12.4	179.1	-65	-163.7	9.1	0	0	114.3	S332 V333	S332-Q335 PolarHBondContact O-N 2.9Å; V333-Q335 VanDerWaalsContact C-N 3.28Å; V333-Q335 PolarHBondContact O-N 3.11Å
336	L	32.2	Very low	39.7	Very low	68 Å²	68	109.3 Å²	109.3	36%	0.356	59%	0.59	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.8	-5.9	-177.5	-78.1	161.6	0	0	0	114	R328 V333 T338	R328-L336 HydrophobicContact CG-CD1 4.31Å; V333-L336 PolarHBondContact O-N 2.81Å; L336-T338 VanDerWaalsContact C-N 3.33Å; L336-T338 PolarHBondContact O-N 2.9Å
337	S	30.5	Very low	37.6	Very low	76 Å²	76	114.2 Å²	114.2	53%	0.531	62%	0.618	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.1	-2.5	-169.8	-169.4	0	0	0	0	116.1
338	T	32.8	Very low	35.9	Very low	78 Å²	78	123 Å²	123	48%	0.479	65%	0.649	S	S	.	*	T	Hydrogen-bonded Turn	trans	-106.7	3.5	-164.8	-37.7	0	0	0	0	114.4	L336 Q900	L336-T338 VanDerWaalsContact C-N 3.33Å; L336-T338 PolarHBondContact O-N 2.9Å; T338-Q900 PolarHBondContact OG1-NE2 3.31Å; T338-Q900 VanDerWaalsContact OG1-NE2 3.12Å; T338-Q900 PolarHBondContact OG1-OE1 3.22Å
339	A	31	Very low	34.5	Very low	60 Å²	60	124.3 Å²	124.3	50%	0.496	67%	0.669	S	S	.	*	S	Bend	trans	-125.9	19.4	-173	0	0	0	0	0	114.7
340	I	33.7	Very low	33.6	Very low	118 Å²	118	125.1 Å²	125.1	61%	0.605	67%	0.674	S	S	*	*			trans	-101	-12.2	-165	-61.1	177.7	0	0	0	113.5
341	S	31.3	Very low	32.7	Very low	114 Å²	114	125.5 Å²	125.5	80%	0.797	68%	0.676	S	S	*	*	S	Bend	trans	-81.6	-29.6	-170	-62.4	0	0	0	0	116
342	E	32.8	Very low	32.1	Very low	145 Å²	145	131 Å²	131	68%	0.678	71%	0.705	S	S	*	*	S	Bend	trans	-99.3	-16.5	-163.6	-71.5	160.9	140.6	0	0	114.5	R344	E342-R344 VanDerWaalsContact C-N 3.25Å; E342-R344 PolarHBondContact O-N 3.33Å
343	S	31.1	Very low	31.8	Very low	91 Å²	91	130.5 Å²	130.5	64%	0.636	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	12.8	-169.1	-45.6	0	0	0	0	116.4
344	R	30.9	Very low	31.5	Very low	230 Å²	230	133 Å²	133	87%	0.868	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.9	-0.4	-170.4	-71.4	-170.6	174.5	-162	-1.2	116.2	E342	E342-R344 VanDerWaalsContact C-N 3.25Å; E342-R344 PolarHBondContact O-N 3.33Å
345	S	35.9	Very low	31.3	Very low	100 Å²	100	132 Å²	132	70%	0.699	71%	0.713	S	S	*	*	S	Bend	trans	-97	-15.9	-166.5	57.7	0	0	0	0	117
346	L	32.4	Very low	31.2	Very low	165 Å²	165	128.9 Å²	128.9	86%	0.864	71%	0.707	S	S	*	*			trans	-123.7	65.1	-167.7	-70.7	179	0	0	0	114
347	L	30.8	Very low	31.4	Very low	169 Å²	169	130 Å²	130	89%	0.885	71%	0.714	S	S	*	*			trans	-129.2	73.4	178.1	-118	168	0	0	0	111.9
348	R	30.1	Very low	31.7	Very low	247 Å²	247	131 Å²	131	93%	0.932	71%	0.712	S	S	*	*			trans	-154.1	121.4	170	-116.2	178.9	-174.5	-144.7	-1.1	114.3
349	S	29.1	Very low	31.9	Very low	104 Å²	104	128.2 Å²	128.2	73%	0.727	69%	0.693	S	S	*	*			trans	51	103.2	156.9	-159.5	0	0	0	0	119.4
350	N	33.7	Very low	32.2	Very low	148 Å²	148	126.6 Å²	126.6	79%	0.791	68%	0.678	S	S	*	*				-165.5	142.2	100.1	-97.7	-5.3	0	0	0	112.2
351	N	30	Very low	32.4	Very low	147 Å²	147	122.6 Å²	122.6	79%	0.786	66%	0.657	S	S	*	*			trans	-86.9	165.4	167.5	-63.6	-11	0	0	0	109.9
352	N	28.8	Very low	32.7	Very low	170 Å²	170	123 Å²	123	91%	0.909	65%	0.65	S	S	*	*			trans	80.9	113.3	174.4	-45.3	-17.6	0	0	0	115.7
353	G	28.6	Very low	32.8	Very low	66 Å²	66	124 Å²	124	68%	0.68	65%	0.652	S	S	*	*			trans	148.8	134.5	167.5	0	0	0	0	0	114.1	L355	G353-L355 PolarHBondContact O-N 3.36Å
354	K	27.5	Very low	33.1	Very low	176 Å²	176	121.1 Å²	121.1	77%	0.765	63%	0.629	S	S	*	*			trans	-62.1	114.6	174.4	-65.8	164.7	-178.7	164.6	0	109.6	D123	D123-K354 IonicContact OD1-NZ 3.87Å; D123-K354 PolarHBondContact OD1-NZ 2.75Å
355	L	30.8	Very low	33.1	Very low	151 Å²	151	112.4 Å²	112.4	79%	0.791	60%	0.598	S	S	*	*			trans	-95	117.5	-179.3	-87.1	163.9	0	0	0	112.5	G353 L357	G353-L355 PolarHBondContact O-N 3.36Å; L355-L357 HydrophobicContact CB-CD1 3.92Å; L355-L357 PolarHBondContact O-N 2.9Å
356	S	31.4	Very low	32.8	Very low	83 Å²	83	115 Å²	115	58%	0.58	60%	0.598	S	S	*	*			trans	-80.1	99	161	40.9	0	0	0	0	109.4	I358	S356-I358 PolarHBondContact O-N 3.45Å
357	L	35.5	Very low	32.6	Very low	93 Å²	93	116.1 Å²	116.1	49%	0.487	60%	0.596	S	S	.	*			trans	-73.3	96.3	-179	-86.1	89.8	0	0	0	111.9	L355 M359	L355-L357 HydrophobicContact CB-CD1 3.92Å; L355-L357 PolarHBondContact O-N 2.9Å; L357-M359 HydrophobicContact CB-CG 3.87Å; L357-M359 HydrophobicContact CB-SD 4.39Å; L357-M359 HydrophobicContact CD2-CG 4.07Å; L357-M359 HydrophobicContact CD2-SD 3.88Å; L357-M359 PolarHBondContact O-N 2.95Å
358	I	37.3	Very low	32.5	Very low	96 Å²	96	116.3 Å²	116.3	49%	0.492	59%	0.593	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-74.6	108.7	153	-45	-169.6	0	0	0	107	Y286 S356 P360	Y286-I358 HydrophobicContact CE1-CD1 4.3Å; Y286-I358 HydrophobicContact CE1-CG1 4.1Å; Y286-I358 WeakPolarHBondContact OH-CD1 3.41Å; Y286-I358 WeakPolarHBondContact OH-CG1 3.49Å; S356-I358 PolarHBondContact O-N 3.45Å; I358-P360 WeakPolarHBondContact O-CD 3.37Å
359	M	36.8	Very low	32.3	Very low	19 Å²	19	109.7 Å²	109.7	9%	0.094	58%	0.584	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.6	101.6	-177.6	-61	-162.1	-68	0	0	109.9	R282 F283 F285 L357 I364	R282-M359 WeakPolarHBondContact CA-O 3.43Å; F283-M359 HydrophobicContact CD2-CE 4.35Å; F283-M359 HydrophobicContact CE2-CE 3.67Å; F283-M359 HydrophobicContact CZ-CE 4.38Å; F283-M359 PolarHBondContact N-O 2.9Å; F283-M359 PolarHBondContact O-N 3.23Å; F285-M359 HydrophobicContact CE2-CE 4.48Å; L357-M359 HydrophobicContact CB-CG 3.87Å; L357-M359 HydrophobicContact CB-SD 4.39Å; L357-M359 HydrophobicContact CD2-CG 4.07Å; L357-M359 HydrophobicContact CD2-SD 3.88Å; L357-M359 PolarHBondContact O-N 2.95Å; M359-I364 HydrophobicContact CB-CD1 4.02Å; M359-I364 HydrophobicContact CB-CG1 3.8Å; M359-I364 HydrophobicContact CE-CD1 4.38Å; M359-I364 HydrophobicContact CE-CG1 4.47Å; M359-I364 HydrophobicContact CG-CG1 4.42Å; M359-I364 HydrophobicContact SD-CG1 4.02Å
360	P	37.9	Very low	32.3	Very low	27 Å²	27	109 Å²	109	18%	0.175	58%	0.579	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-65.2	144.5	156.8	31.1	-33.4	0	0	0	108.3	R282 I358 N362 K363	R282-P360 HydrophobicContact CG-CB 3.98Å; I358-P360 WeakPolarHBondContact O-CD 3.37Å; P360-N362 PolarHBondContact O-N 2.83Å; P360-N362 VanDerWaalsContact O-N 3.1Å; P360-K363 HydrophobicContact CG-CB 3.91Å; P360-K363 HydrophobicContact CG-CD 3.88Å; P360-K363 HydrophobicContact CG-CG 3.84Å; P360-K363 PolarHBondContact O-N 3.34Å
361	F	37.9	Very low	31.9	Very low	34 Å²	34	108.8 Å²	108.8	15%	0.149	58%	0.577	C	S	.	*	H	α-helix	trans	-48.5	-45.5	-176.4	-93.8	-114.7	0	0	0	112.1	L277 L280 R281 F283 V324 K363 I364 F365	L277-F361 WeakPolarHBondContact O-CZ 3.4Å; L280-F361 HydrophobicContact CB-CE2 3.53Å; L280-F361 HydrophobicContact CB-CZ 3.77Å; L280-F361 WeakPolarHBondContact O-CD2 3.36Å; L280-F361 WeakPolarHBondContact O-CE2 3.34Å; R281-F361 WeakPolarHBondContact O-CD2 3.48Å; R281-F361 PolarHBondContact O-N 2.81Å; R281-F361 VanDerWaalsContact O-N 3.16Å; F283-F361 HydrophobicContact CD1-CD2 4.22Å; F283-F361 AromaticContact CD1-CE2 3.59Å; F283-F361 HydrophobicContact CD1-CE2 3.59Å; F283-F361 HydrophobicContact CD1-CZ 4.24Å; F283-F361 HydrophobicContact CE1-CD2 4.13Å; F283-F361 AromaticContact CE1-CE2 3.58Å; F283-F361 HydrophobicContact CE1-CE2 3.58Å; F283-F361 AromaticContact CE1-CZ 3.9Å; F283-F361 HydrophobicContact CE1-CZ 3.9Å; V324-F361 HydrophobicContact CG1-CE1 4.34Å; F361-K363 PolarHBondContact O-N 3.12Å; F361-I364 PolarHBondContact O-N 3.35Å; F361-I364 VanDerWaalsContact O-N 3.1Å; F361-F365 HydrophobicContact CB-CE2 4.41Å; F361-F365 HydrophobicContact CD1-CZ 4.29Å; F361-F365 VanDerWaalsContact O-CD2 3.23Å; F361-F365 WeakPolarHBondContact O-CD2 3.22Å; F361-F365 VanDerWaalsContact O-CE2 3.26Å; F361-F365 WeakPolarHBondContact O-CE2 3.44Å
362	N	36.7	Very low	31.7	Very low	123 Å²	123	106.7 Å²	106.7	66%	0.658	57%	0.573	S	S	*	*	H	α-helix	trans	-58	-21.6	180	-59	14.2	0	0	0	114.8	P360	P360-N362 PolarHBondContact O-N 2.83Å; P360-N362 VanDerWaalsContact O-N 3.1Å
363	K	34.9	Very low	31.5	Very low	164 Å²	164	105.6 Å²	105.6	71%	0.713	57%	0.567	S	S	*	*	H	α-helix	trans	-96.5	-8.5	179.4	-72.8	-171.7	176.8	-176.4	0	114.9	P360 F361 F365	P360-K363 HydrophobicContact CG-CB 3.91Å; P360-K363 HydrophobicContact CG-CD 3.88Å; P360-K363 HydrophobicContact CG-CG 3.84Å; P360-K363 PolarHBondContact O-N 3.34Å; F361-K363 PolarHBondContact O-N 3.12Å; K363-F365 PolarHBondContact O-N 2.94Å
364	I	38	Very low	31.4	Very low	32 Å²	32	107.3 Å²	107.3	16%	0.164	57%	0.568	C	S	.	*	H	α-helix	trans	-70.7	-19	170.1	-55.5	177.4	0	0	0	109.9	F283 M359 F361 H366	F283-I364 HydrophobicContact CE1-CD1 3.6Å; F283-I364 HydrophobicContact CE2-CD1 4.09Å; F283-I364 HydrophobicContact CZ-CD1 3.27Å; M359-I364 HydrophobicContact CB-CD1 4.02Å; M359-I364 HydrophobicContact CB-CG1 3.8Å; M359-I364 HydrophobicContact CE-CD1 4.38Å; M359-I364 HydrophobicContact CE-CG1 4.47Å; M359-I364 HydrophobicContact CG-CG1 4.42Å; M359-I364 HydrophobicContact SD-CG1 4.02Å; F361-I364 PolarHBondContact O-N 3.35Å; F361-I364 VanDerWaalsContact O-N 3.1Å; I364-H366 PolarHBondContact O-N 3.09Å
365	F	31.3	Very low	31.3	Very low	47 Å²	47	104.5 Å²	104.5	21%	0.206	57%	0.566	C	S	.	*			trans	-100.2	37.9	-163.5	-55.8	-34.2	0	0	0	115.7	F361 K363	F361-F365 HydrophobicContact CB-CE2 4.41Å; F361-F365 HydrophobicContact CD1-CZ 4.29Å; F361-F365 VanDerWaalsContact O-CD2 3.23Å; F361-F365 WeakPolarHBondContact O-CD2 3.22Å; F361-F365 VanDerWaalsContact O-CE2 3.26Å; F361-F365 WeakPolarHBondContact O-CE2 3.44Å; K363-F365 PolarHBondContact O-N 2.94Å
366	H	28.8	Very low	31.2	Very low	153 Å²	153	102.7 Å²	102.7	71%	0.708	56%	0.561	S	S	*	*			trans	-106.5	78.5	161.6	-87.5	-63.4	0	0	0	111.6	I364 Q368	I364-H366 PolarHBondContact O-N 3.09Å; H366-Q368 PolarHBondContact O-N 3.13Å
367	K	29.2	Very low	30.8	Very low	190 Å²	190	104.5 Å²	104.5	83%	0.826	57%	0.571	S	S	*	*			trans	-64.5	119.1	154.7	-167.3	174.2	-171.2	175.3	0	106.2	S369	K367-S369 VanDerWaalsContact C-N 3.29Å; K367-S369 PolarHBondContact O-N 3.23Å
368	Q	27.8	Very low	30.4	Very low	173 Å²	173	107.1 Å²	107.1	81%	0.808	58%	0.583	S	S	*	*			trans	-67.7	91.9	172.2	-83.5	-176	-29.4	0	0	108.7	H366 S370	H366-Q368 PolarHBondContact O-N 3.13Å; Q368-S370 PolarHBondContact O-N 2.88Å
369	S	26.8	Very low	29.9	Very low	107 Å²	107	110.5 Å²	110.5	75%	0.748	60%	0.601	S	S	*	*			trans	-75.8	44.9	168.2	62.8	0	0	0	0	110.9	K367 I371	K367-S369 VanDerWaalsContact C-N 3.29Å; K367-S369 PolarHBondContact O-N 3.23Å; S369-I371 PolarHBondContact O-N 2.83Å; S369-I371 VanDerWaalsContact O-N 3.09Å
370	S	28.5	Very low	29.5	Very low	90 Å²	90	117.6 Å²	117.6	63%	0.629	63%	0.633	S	S	*	*			trans	-81.9	56.7	165.3	54.6	0	0	0	0	109.2	Q368 S372	Q368-S370 PolarHBondContact O-N 2.88Å; S370-S372 VanDerWaalsContact C-N 3.28Å; S370-S372 PolarHBondContact O-N 3.39Å
371	I	25.1	Very low	29.1	Very low	144 Å²	144	123 Å²	123	74%	0.738	66%	0.661	S	S	*	*			trans	-69	99.4	155.5	-65.8	176.7	0	0	0	104.5	S369 L373	S369-I371 PolarHBondContact O-N 2.83Å; S369-I371 VanDerWaalsContact O-N 3.09Å; I371-L373 VanDerWaalsContact C-N 3.29Å; I371-L373 HydrophobicContact CG2-CD1 4.48Å; I371-L373 PolarHBondContact O-N 3.08Å
372	S	25.7	Very low	28.6	Very low	102 Å²	102	126.3 Å²	126.3	71%	0.713	69%	0.688	S	S	*	*			trans	-65.8	93.8	168.4	49.9	0	0	0	0	107.7	S370 S374	S370-S372 VanDerWaalsContact C-N 3.28Å; S370-S372 PolarHBondContact O-N 3.39Å; S372-S374 PolarHBondContact O-N 3.16Å
373	L	25.1	Very low	28.4	Very low	147 Å²	147	127.5 Å²	127.5	77%	0.77	69%	0.693	S	S	*	*			trans	-74.6	65.2	179.9	-162.8	76.5	0	0	0	110.3	I371 T375	I371-L373 VanDerWaalsContact C-N 3.29Å; I371-L373 HydrophobicContact CG2-CD1 4.48Å; I371-L373 PolarHBondContact O-N 3.08Å; L373-T375 PolarHBondContact O-N 3.35Å; L373-T375 VanDerWaalsContact O-N 3.14Å
374	S	26.1	Very low	28	Very low	102 Å²	102	128.1 Å²	128.1	71%	0.713	70%	0.704	S	S	*	*			trans	-70.5	103.3	172.6	53.4	0	0	0	0	109	S372 T376	S372-S374 PolarHBondContact O-N 3.16Å; S374-T376 PolarHBondContact O-N 3.15Å
375	T	25.5	Very low	27.7	Very low	118 Å²	118	133 Å²	133	72%	0.724	73%	0.726	S	S	*	*			trans	-70.8	107	-176	48.7	0	0	0	0	112.8	L373	L373-T375 PolarHBondContact O-N 3.35Å; L373-T375 VanDerWaalsContact O-N 3.14Å
376	T	28.4	Very low	27.6	Very low	113 Å²	113	138.4 Å²	138.4	69%	0.693	75%	0.75	S	S	*	*			trans	-158.5	97.2	154	17.4	0	0	0	0	111.3	S374 M378	S374-T376 PolarHBondContact O-N 3.15Å; T376-M378 HydrophobicContact CG2-CG 4.14Å; T376-M378 PolarHBondContact O-N 3.15Å
377	P	24	Very low	27.6	Very low	121 Å²	121	137.8 Å²	137.8	79%	0.786	75%	0.75	S	S	*	*			trans	-78.6	91.1	161.2	32	-29.7	0	0	0	108.5
378	M	27.3	Very low	27.7	Very low	148 Å²	148	133.7 Å²	133.7	73%	0.729	74%	0.737	S	S	*	*			trans	-105.8	69.8	172.1	-69	-84.7	77.8	0	0	110.1	T376 H380	T376-M378 HydrophobicContact CG2-CG 4.14Å; T376-M378 PolarHBondContact O-N 3.15Å; M378-H380 PolarHBondContact O-N 3.05Å
379	L	26.3	Very low	27.7	Very low	167 Å²	167	134.6 Å²	134.6	87%	0.874	73%	0.733	S	S	*	*			trans	-65.7	118.6	144	-73.6	170.1	0	0	0	106.1
380	H	28.1	Very low	28	Very low	167 Å²	167	136.3 Å²	136.3	77%	0.773	73%	0.734	S	S	*	*			trans	-138.3	131.8	158.5	-157.7	-57.9	0	0	0	107.5	M378	M378-H380 PolarHBondContact O-N 3.05Å
381	D	29.3	Very low	28.1	Very low	140 Å²	140	138.5 Å²	138.5	75%	0.749	74%	0.738	S	S	*	*			trans	-71	152.4	-159.7	-54.3	-82.8	0	0	0	113.8
382	S	28.6	Very low	28.3	Very low	104 Å²	104	140.1 Å²	140.1	73%	0.727	74%	0.74	S	S	*	*			trans	-70.9	-178.1	157.7	55.7	0	0	0	0	110.2
383	I	32	Very low	28.5	Very low	148 Å²	148	142.8 Å²	142.8	76%	0.759	75%	0.746	S	S	*	*			trans	72.2	71.3	-178.9	-43.4	175.7	0	0	0	112.9	E385	I383-E385 HydrophobicContact CG2-CB 4.19Å; I383-E385 PolarHBondContact O-N 3.03Å
384	N	26.9	Very low	28.8	Very low	178 Å²	178	139.3 Å²	139.3	95%	0.952	75%	0.746	S	S	*	*			trans	-66.2	81.1	148.3	-120.4	-28.2	0	0	0	108.9
385	E	31.7	Very low	28.9	Very low	134 Å²	134	145.9 Å²	145.9	63%	0.626	76%	0.755	S	S	*	*			trans	-142.3	102.9	160.7	-114.9	-165.3	151.3	0	0	115	I383	I383-E385 HydrophobicContact CG2-CB 4.19Å; I383-E385 PolarHBondContact O-N 3.03Å
386	K	28.6	Very low	29.1	Very low	161 Å²	161	144.3 Å²	144.3	70%	0.7	75%	0.749	S	S	*	*			trans	61.2	132.9	131.3	-83.2	178.6	-165.3	144.1	0	121.8
387	I	29.7	Very low	29.1	Very low	140 Å²	140	145 Å²	145	72%	0.718	75%	0.748	S	S	*	*			trans	91	100.8	140.4	-66	162.8	0	0	0	117.6
388	D	29.5	Very low	29.5	Very low	104 Å²	104	146.6 Å²	146.6	56%	0.556	75%	0.745	S	S	*	*			trans	56.6	123.1	135.1	-73.6	-39.6	0	0	0	123.3
389	R	28	Very low	29.8	Very low	192 Å²	192	147.1 Å²	147.1	73%	0.725	74%	0.743	S	S	*	*				53.4	114.1	127.8	-54	171	-141.6	178.6	18.3	118.4
390	N	34.7	Very low	29.9	Very low	142 Å²	142	146.1 Å²	146.1	76%	0.759	74%	0.739	S	S	*	*				-164.9	140.9	83.6	-82.3	-51.9	0	0	0	108.7
391	L	29.5	Very low	30	Very low	136 Å²	136	145.2 Å²	145.2	71%	0.712	74%	0.738	S	S	*	*			cis	89.6	123.6	42.5	-149.1	79.9	0	0	0	113
392	F	29.8	Very low	30	Very low	178 Å²	178	144 Å²	144	78%	0.781	74%	0.736	S	S	*	*			trans	70.4	134.5	-175.9	-65.9	-88.9	0	0	0	116.7
393	N	28.7	Very low	30.1	Very low	158 Å²	158	146 Å²	146	85%	0.845	74%	0.738	S	S	*	*			cis	75.8	107	33.6	-78.1	-26.1	0	0	0	116.3
394	G	31.4	Very low	30.1	Very low	74 Å²	74	145.1 Å²	145.1	76%	0.763	74%	0.735	S	S	*	*			trans	150.3	104.5	174.6	0	0	0	0	0	108.7
395	R	28.5	Very low	30.4	Very low	241 Å²	241	144.6 Å²	144.6	91%	0.909	73%	0.727	S	S	*	*			cis	83.3	125	38.2	-158.6	-170.6	-164.5	-174.3	6.4	113.1
396	S	29.3	Very low	30.3	Very low	85 Å²	85	144.5 Å²	144.5	59%	0.594	73%	0.731	S	S	*	*			trans	80.2	108.1	162.7	-77.6	0	0	0	0	120.6
397	D	29.1	Very low	30.4	Very low	127 Å²	127	142.7 Å²	142.7	68%	0.679	73%	0.733	S	S	*	*				69.9	137	115	-53.7	-52.2	0	0	0	122.8
398	H	32	Very low	30.4	Very low	154 Å²	154	140.8 Å²	140.8	71%	0.713	72%	0.72	S	S	*	*			trans	86.6	113.2	149.8	-66	-26.6	0	0	0	122.6
399	K	33.8	Very low	30.5	Very low	160 Å²	160	142.6 Å²	142.6	70%	0.696	73%	0.725	S	S	*	*				75.9	111.1	124.8	-67.6	175	179.5	172	0	121.2
400	N	28.7	Very low	30.6	Very low	145 Å²	145	139.2 Å²	139.2	78%	0.775	72%	0.717	S	S	*	*				75.2	163.3	129.2	-58.3	6.2	0	0	0	119.4
401	I	31.2	Very low	30.3	Very low	148 Å²	148	142.7 Å²	142.7	76%	0.759	72%	0.721	S	S	*	*			trans	69.9	83.6	169.9	-47	-177.4	0	0	0	112.3
402	T	29	Very low	30.3	Very low	115 Å²	115	143.2 Å²	143.2	71%	0.706	72%	0.724	S	S	*	*				44.4	97.4	89.2	65.4	0	0	0	0	114.2
403	D	31.1	Very low	30.1	Very low	145 Å²	145	144.5 Å²	144.5	78%	0.775	72%	0.724	S	S	*	*				-167.7	158.1	110	-92	-17.6	0	0	0	112.7
404	N	31	Very low	30	Very low	131 Å²	131	143.2 Å²	143.2	70%	0.701	73%	0.725	S	S	*	*			trans	-5.7	119	167.8	-46.8	-49.1	0	0	0	119
405	H	32.6	Very low	29.7	Very low	166 Å²	166	148.7 Å²	148.7	77%	0.769	72%	0.723	S	S	*	*				172.3	132.2	105.2	-95.9	-78.6	0	0	0	113.2
406	D	30.4	Very low	29.6	Very low	133 Å²	133	142.8 Å²	142.8	71%	0.711	72%	0.716	S	S	*	*			trans	41	147.8	148.9	-55.7	-54.1	0	0	0	124.8
407	T	31.4	Very low	29.5	Very low	122 Å²	122	144.2 Å²	144.2	75%	0.748	72%	0.724	S	S	*	*			trans	95.6	108	153.8	-35	0	0	0	0	119.2
408	F	28.4	Very low	29.3	Very low	100 Å²	100	145 Å²	145	44%	0.439	73%	0.732	S	S	.	*			trans	32	128.7	149.5	-67	-96.3	0	0	0	121.7	D609 I610	F408-D609 HydrophobicContact CD1-CB 4.05Å; F408-D609 HydrophobicContact CE1-CB 3.79Å; F408-D609 WeakPolarHBondContact CE1-O 3.35Å; F408-D609 VanDerWaalsContact CZ-O 3.3Å; F408-D609 WeakPolarHBondContact CZ-O 3.41Å; F408-I610 HydrophobicContact CD1-CD1 4.12Å; F408-I610 HydrophobicContact CE1-CB 4.01Å; F408-I610 HydrophobicContact CE1-CD1 4.25Å; F408-I610 HydrophobicContact CE1-CG1 4.45Å; F408-I610 VanDerWaalsContact CE1-O 3.24Å; F408-I610 WeakPolarHBondContact CE1-O 3.35Å; F408-I610 WeakPolarHBondContact CZ-O 3.25Å
409	H	32.8	Very low	29.1	Very low	142 Å²	142	145.5 Å²	145.5	66%	0.657	74%	0.74	S	S	*	*				-169	176.8	73.4	-99	-71.5	0	0	0	114	D609	H409-D609 IonicContact CE1-OD2 3.27Å; H409-D609 PolarHBondContact CE1-OD2 3.04Å; H409-D609 VanDerWaalsContact CE1-OD2 3.27Å; H409-D609 IonicContact ND1-OD2 3.29Å; H409-D609 PolarHBondContact ND1-OD2 3.31Å
410	H	29.1	Very low	28.7	Very low	121 Å²	121	142.8 Å²	142.8	56%	0.56	74%	0.741	S	S	*	*			trans	-67.6	153.3	176.2	-77	-31.3	0	0	0	115.9	I610	H410-I610 WeakPolarHBondContact CE1-CD1 3.25Å; H410-I610 WeakPolarHBondContact NE2-CD1 3.36Å
411	Y	29.4	Very low	28.6	Very low	215 Å²	215	145.1 Å²	145.1	84%	0.843	75%	0.747	S	S	*	*				-170.8	122.6	116.5	-107.3	-68.7	0	0	0	115
412	N	28.1	Very low	28.3	Very low	147 Å²	147	147.5 Å²	147.5	79%	0.786	75%	0.746	S	S	*	*			trans	21.8	111	154.2	-64.2	-18.3	0	0	0	122.2
413	R	26.9	Very low	28.3	Very low	205 Å²	205	149.6 Å²	149.6	77%	0.774	75%	0.753	S	S	*	*			trans	-147.4	134.9	137.7	-153.1	175	-161.7	-154.3	5.4	109.8	Y415	R413-Y415 PolarHBondContact O-N 3.04Å
414	P	25.2	Very low	28	Very low	132 Å²	132	148 Å²	148	86%	0.857	74%	0.744	S	S	*	*			trans	-74.3	98.9	-174.7	28.8	-35	0	0	0	111.9
415	Y	25.3	Very low	27.8	Very low	189 Å²	189	147.8 Å²	147.8	74%	0.741	74%	0.743	S	S	*	*			trans	-91.3	137.8	166	-83.5	-83.8	0	0	0	110.5	R413 P417	R413-Y415 PolarHBondContact O-N 3.04Å; Y415-P417 WeakPolarHBondContact O-CD 3.21Å
416	P	26	Very low	27.4	Very low	116 Å²	116	143.5 Å²	143.5	75%	0.753	74%	0.736	S	S	*	*			trans	-83.8	116	176.4	31.5	-31.4	0	0	0	111.1	V418	P416-V418 PolarHBondContact O-N 3.1Å
417	P	28.4	Very low	27.1	Very low	116 Å²	116	145 Å²	145	75%	0.753	74%	0.737	S	S	*	*			trans	-92.9	102.6	175.4	15.5	3.6	0	0	0	109.7	Y415 L419	Y415-P417 WeakPolarHBondContact O-CD 3.21Å; P417-L419 PolarHBondContact O-N 2.79Å
418	V	25.3	Very low	26.8	Very low	142 Å²	142	143.4 Å²	143.4	86%	0.861	73%	0.731	S	S	*	*			trans	-78.5	97.9	164.3	177.5	0	0	0	0	107.8	P416	P416-V418 PolarHBondContact O-N 3.1Å
419	L	27.2	Very low	26.6	Very low	166 Å²	166	147.4 Å²	147.4	87%	0.869	75%	0.748	S	S	*	*			trans	-128.8	140.1	164.2	-75.9	178.2	0	0	0	110.2	P417	P417-L419 PolarHBondContact O-N 2.79Å
420	S	24.6	Very low	26.4	Very low	102 Å²	102	147 Å²	147	71%	0.713	75%	0.751	S	S	*	*			trans	-97.4	128.4	-168.6	154.8	0	0	0	0	110.6
421	E	27.5	Very low	26.3	Very low	195 Å²	195	148.2 Å²	148.2	91%	0.911	76%	0.762	S	S	*	*			trans	-135	126.9	152.1	-131.9	163.2	-127.4	0	0	110.8
422	R	25	Very low	26.3	Very low	197 Å²	197	144 Å²	144	74%	0.743	76%	0.759	S	S	*	*			trans	-90.4	114	-179.5	-68.1	168.6	171.7	149.7	-8.2	108.5	N424	R422-N424 HydrophobicContact CB-CB 4.37Å; R422-N424 PolarHBondContact O-N 2.76Å
423	N	28.1	Very low	26.4	Very low	160 Å²	160	146.3 Å²	146.3	86%	0.856	77%	0.765	S	S	*	*			trans	-94.1	59.6	151	-82.3	-22.8	0	0	0	110	L425	N423-L425 PolarHBondContact O-N 2.84Å
424	N	24.9	Very low	26.4	Very low	110 Å²	110	143.9 Å²	143.9	59%	0.588	77%	0.765	S	S	*	*			trans	-69.6	108.3	156	-80.4	-2.5	0	0	0	107	R422 A426	R422-N424 HydrophobicContact CB-CB 4.37Å; R422-N424 PolarHBondContact O-N 2.76Å; N424-A426 HydrophobicContact CB-CB 3.75Å
425	L	26.9	Very low	26.6	Very low	127 Å²	127	144.1 Å²	144.1	67%	0.665	76%	0.76	S	S	*	*			trans	-121.1	91	158.1	-68.6	174.3	0	0	0	106.6	N423 F427	N423-L425 PolarHBondContact O-N 2.84Å; L425-F427 HydrophobicContact CB-CD2 4.28Å; L425-F427 HydrophobicContact CB-CE2 4.15Å; L425-F427 HydrophobicContact CD1-CE2 4.29Å; L425-F427 HydrophobicContact CD1-CZ 4.38Å; L425-F427 HydrophobicContact CD2-CE1 4.43Å; L425-F427 HydrophobicContact CD2-CE2 4.27Å; L425-F427 HydrophobicContact CD2-CZ 4.2Å; L425-F427 HydrophobicContact CG-CE2 4.48Å
426	A	23.9	Very low	26.7	Very low	77 Å²	77	140.9 Å²	140.9	64%	0.636	75%	0.754	S	S	*	*			cis	48.5	47.1	11.3	0	0	0	0	0	114.3	N424 S428	N424-A426 HydrophobicContact CB-CB 3.75Å; A426-S428 VanDerWaalsContact C-N 3.32Å; A426-S428 PolarHBondContact O-N 2.78Å
427	F	24.6	Very low	26.9	Very low	163 Å²	163	143.5 Å²	143.5	72%	0.715	76%	0.761	S	S	*	*			trans	-59.4	105.8	148.8	-74.6	-81.4	0	0	0	107.2	L425	L425-F427 HydrophobicContact CB-CD2 4.28Å; L425-F427 HydrophobicContact CB-CE2 4.15Å; L425-F427 HydrophobicContact CD1-CE2 4.29Å; L425-F427 HydrophobicContact CD1-CZ 4.38Å; L425-F427 HydrophobicContact CD2-CE1 4.43Å; L425-F427 HydrophobicContact CD2-CE2 4.27Å; L425-F427 HydrophobicContact CD2-CZ 4.2Å; L425-F427 HydrophobicContact CG-CE2 4.48Å
428	S	24.7	Very low	26.9	Very low	90 Å²	90	145.8 Å²	145.8	63%	0.629	76%	0.762	S	S	*	*			trans	-57.6	133.2	158	-173.2	0	0	0	0	107	A426 D430	A426-S428 VanDerWaalsContact C-N 3.32Å; A426-S428 PolarHBondContact O-N 2.78Å; S428-D430 PolarHBondContact O-N 2.67Å; S428-D430 PolarHBondContact OG-OD1 3.49Å; S428-D430 VanDerWaalsContact OG-OD1 3.05Å
429	F	25.3	Very low	27.1	Very low	183 Å²	183	144.2 Å²	144.2	80%	0.803	76%	0.757	S	S	*	*			trans	-79	102.9	161.3	-73.3	-96.4	0	0	0	105.7	D431	F429-D431 PolarHBondContact O-N 2.94Å; F429-D431 VanDerWaalsContact O-N 3.16Å
430	D	28.8	Very low	27.3	Very low	135 Å²	135	144.4 Å²	144.4	72%	0.722	75%	0.753	S	S	*	*			trans	-78.6	96.7	168	-72.1	-6.3	0	0	0	107.1	S428 T432	S428-D430 PolarHBondContact O-N 2.67Å; S428-D430 PolarHBondContact OG-OD1 3.49Å; S428-D430 VanDerWaalsContact OG-OD1 3.05Å; D430-T432 PolarHBondContact O-N 3.14Å
431	D	26.2	Very low	27.4	Very low	146 Å²	146	144.7 Å²	144.7	78%	0.781	75%	0.751	S	S	*	*			trans	-66.1	95.6	179.7	-75.4	-46.1	0	0	0	111	F429	F429-D431 PolarHBondContact O-N 2.94Å; F429-D431 VanDerWaalsContact O-N 3.16Å
432	T	29.7	Very low	27.6	Very low	126 Å²	126	142.9 Å²	142.9	77%	0.773	75%	0.746	S	S	*	*			trans	-135.9	134.2	162.9	39.8	0	0	0	0	111.7	D430	D430-T432 PolarHBondContact O-N 3.14Å
433	E	29.9	Very low	27.7	Very low	195 Å²	195	141.7 Å²	141.7	91%	0.911	75%	0.746	S	S	*	*			trans	63.6	62.6	169.5	-54.6	-162.5	147.4	0	0	116.6	D435	E433-D435 PolarHBondContact O-N 3.33Å
434	I	26	Very low	27.9	Very low	154 Å²	154	142 Å²	142	79%	0.79	75%	0.747	S	S	*	*			trans	-63.4	114.3	139.7	-59.5	169.2	0	0	0	108
435	D	29.3	Very low	28.1	Very low	138 Å²	138	141.4 Å²	141.4	74%	0.738	75%	0.747	S	S	*	*			trans	172.5	156.1	138.5	-96.8	-6.7	0	0	0	110	E433	E433-D435 PolarHBondContact O-N 3.33Å
436	L	28.1	Very low	28.4	Very low	121 Å²	121	142.4 Å²	142.4	63%	0.634	75%	0.754	S	S	*	*			cis	-172.3	129.2	-26.6	179	125.6	0	0	0	106.7
437	L	29.7	Very low	28.8	Very low	170 Å²	170	144.8 Å²	144.8	89%	0.89	76%	0.755	S	S	*	*			trans	-164	106.7	149.5	-112.8	166.3	0	0	0	111.8
438	Q	28.9	Very low	29.3	Very low	164 Å²	164	143.9 Å²	143.9	77%	0.766	76%	0.758	S	S	*	*			trans	-83.7	146.9	175.5	-61.2	172.5	-26.4	0	0	111.2
439	S	29.6	Very low	29.7	Very low	109 Å²	109	148.2 Å²	148.2	76%	0.762	77%	0.766	S	S	*	*			trans	166.6	145.1	131	56.1	0	0	0	0	109.1
440	Q	31.1	Very low	30.1	Very low	170 Å²	170	145.4 Å²	145.4	79%	0.794	76%	0.758	S	S	*	*			cis	-132.1	141.9	12.7	-65.3	174	10.6	0	0	112.1
441	T	27.5	Very low	30.3	Very low	108 Å²	108	146.8 Å²	146.8	66%	0.663	76%	0.76	S	S	*	*				35.7	124.3	122.4	-31.8	0	0	0	0	117.9
442	I	30.7	Very low	30.4	Very low	157 Å²	157	148.2 Å²	148.2	81%	0.805	76%	0.762	S	S	*	*				-155.2	116.1	68.7	-73.9	154.1	0	0	0	108.2
443	K	28.2	Very low	30.5	Very low	172 Å²	172	151.3 Å²	151.3	75%	0.748	77%	0.765	S	S	*	*				62.3	107.7	80.2	-88.4	-171	175.9	-179.6	0	117.3
444	L	31.2	Very low	30.6	Very low	166 Å²	166	149.8 Å²	149.8	87%	0.869	76%	0.757	S	S	*	*			trans	176.7	69.8	145.5	-99.8	164.9	0	0	0	110.3
445	T	30.4	Very low	30.8	Very low	98 Å²	98	150.3 Å²	150.3	60%	0.601	76%	0.756	S	S	*	*				57.1	86.5	85.3	68.5	0	0	0	0	118.2
446	N	33	Very low	30.9	Very low	149 Å²	149	151 Å²	151	80%	0.797	76%	0.755	S	S	*	*				-178.6	125.5	123	-92.6	-25.3	0	0	0	109.2
447	N	31.9	Very low	30.9	Very low	126 Å²	126	152.8 Å²	152.8	67%	0.674	76%	0.76	S	S	*	*			cis	102	90.9	40.6	-82.8	-35.9	0	0	0	112.7
448	N	35	Very low	30.9	Very low	145 Å²	145	150.3 Å²	150.3	78%	0.775	75%	0.748	S	S	*	*			trans	173.9	124.5	130.4	-84.5	-29.8	0	0	0	108.5
449	K	34	Very low	30.8	Very low	181 Å²	181	153.4 Å²	153.4	79%	0.787	75%	0.752	S	S	*	*				73.3	131	64.4	-75.8	-171.9	171.9	-176.5	0	112.4
450	I	32.1	Very low	30.7	Very low	123 Å²	123	154.4 Å²	154.4	63%	0.631	75%	0.754	S	S	*	*			cis	-168	166.4	-1.8	-134.8	167.4	0	0	0	111.2
451	Q	33.8	Very low	30.4	Very low	165 Å²	165	152 Å²	152	77%	0.771	76%	0.755	S	S	*	*			trans	63.6	169.3	165.3	-77.7	157.8	10.5	0	0	119.3
452	Q	29.3	Very low	30.4	Very low	176 Å²	176	151.1 Å²	151.1	82%	0.822	75%	0.754	S	S	*	*				-171.3	166.4	-58	-119.5	179.8	-9.6	0	0	110.9
453	K	31.3	Very low	30.2	Very low	191 Å²	191	150.5 Å²	150.5	83%	0.83	75%	0.752	S	S	*	*			trans	69.5	136.4	-175.7	-65.8	-173.7	170.2	-171.2	0	115.8
454	Q	30.8	Very low	30.1	Very low	162 Å²	162	147.8 Å²	147.8	76%	0.757	75%	0.753	S	S	*	*			cis	104	91.3	14	-175.3	172	1.6	0	0	114.5
455	E	31.3	Very low	30	Very low	165 Å²	165	148.5 Å²	148.5	77%	0.771	76%	0.757	S	S	*	*				-176.4	144.9	113.7	-106.1	163.6	-160.1	0	0	115.8
456	H	30.6	Very low	29.8	Very low	153 Å²	153	151.1 Å²	151.1	71%	0.708	76%	0.762	S	S	*	*			trans	39.5	124.1	156.3	-77.9	-69.4	0	0	0	126
457	H	28.2	Very low	29.5	Very low	158 Å²	158	154.8 Å²	154.8	73%	0.731	77%	0.765	S	S	*	*			trans	89.3	137.8	136.5	-83.2	-67.5	0	0	0	124.4
458	D	30	Very low	29.4	Very low	119 Å²	119	156.2 Å²	156.2	64%	0.636	77%	0.772	S	S	*	*			trans	71.3	91.8	150.7	-73.5	24.6	0	0	0	123.3
459	R	26	Very low	29	Very low	228 Å²	228	157.1 Å²	157.1	86%	0.86	77%	0.771	S	S	*	*				70	150.4	129.6	-68.8	176.5	160.2	168	-4.9	120.9
460	V	27.9	Very low	28.7	Very low	131 Å²	131	156 Å²	156	79%	0.794	77%	0.773	S	S	*	*			trans	77.9	79.7	166.9	-159.7	0	0	0	0	118.1
461	S	25.2	Very low	28.4	Very low	118 Å²	118	157.7 Å²	157.7	83%	0.825	78%	0.779	S	S	*	*				13	106.5	128.9	168.3	0	0	0	0	118.3
462	S	26.9	Very low	28.2	Very low	90 Å²	90	156.8 Å²	156.8	63%	0.629	78%	0.779	S	S	*	*			trans	-159.6	152.9	150.9	61.2	0	0	0	0	112.4
463	N	28.3	Very low	28.2	Very low	145 Å²	145	153.3 Å²	153.3	78%	0.775	77%	0.774	S	S	*	*			trans	64.5	169.3	161.6	-51.9	-28.8	0	0	0	117.3
464	C	25.5	Very low	28.2	Very low	115 Å²	115	148.5 Å²	148.5	78%	0.777	77%	0.765	S	S	*	*			cis	-162.8	144.9	-48.7	-100.4	0	0	0	0	107.5
465	L	27.8	Very low	28.2	Very low	181 Å²	181	147.5 Å²	147.5	95%	0.948	77%	0.765	S	S	*	*			trans	-141.2	139	164	-97.9	172.4	0	0	0	110.8
466	H	26.7	Very low	28.1	Very low	153 Å²	153	146.2 Å²	146.2	71%	0.708	76%	0.763	S	S	*	*			trans	-153	118	-163.7	171.4	-74.4	0	0	0	111.5
467	W	27.7	Very low	28.2	Very low	226 Å²	226	148.4 Å²	148.4	86%	0.856	77%	0.771	S	S	*	*			trans	-165.4	150.7	165.1	-86.7	101.7	0	0	0	105.8
468	L	28.7	Very low	28.3	Very low	155 Å²	155	143.9 Å²	143.9	81%	0.812	77%	0.766	S	S	*	*			cis	-121.3	164.4	8.5	-86.8	118	0	0	0	112.5
469	Q	26.7	Very low	28.4	Very low	164 Å²	164	145.1 Å²	145.1	77%	0.766	77%	0.773	S	S	*	*			trans	-122	136.6	174.1	178.5	173.8	-7	0	0	110.3
470	L	28.1	Very low	28.7	Very low	159 Å²	159	140.2 Å²	140.2	83%	0.832	76%	0.764	S	S	*	*			trans	-127.4	120.7	168.7	-92.5	168.9	0	0	0	111.2
471	Q	26.6	Very low	29	Very low	158 Å²	158	140.2 Å²	140.2	74%	0.738	76%	0.755	S	S	*	*			trans	-17.7	139.2	167.9	-61	165	-12.7	0	0	117.8
472	N	28.2	Very low	29.4	Very low	145 Å²	145	140.2 Å²	140.2	78%	0.775	75%	0.746	S	S	*	*				-168.3	148.6	100.5	-97.2	-35.3	0	0	0	113.6
473	S	30.1	Very low	29.7	Very low	104 Å²	104	141.5 Å²	141.5	73%	0.727	75%	0.746	S	S	*	*			trans	32	141.2	150.1	60.2	0	0	0	0	121.7
474	S	31.1	Very low	30	Very low	90 Å²	90	141.9 Å²	141.9	63%	0.629	74%	0.743	S	S	*	*			cis	177.3	161.8	-4.5	47.2	0	0	0	0	109.3
475	N	30.8	Very low	30.4	Very low	141 Å²	141	144.2 Å²	144.2	75%	0.754	74%	0.742	S	S	*	*			trans	69.2	156	163.7	-56.4	-15.8	0	0	0	116.2
476	N	29	Very low	30.7	Very low	137 Å²	137	139.3 Å²	139.3	73%	0.733	73%	0.728	S	S	*	*			cis	-161.1	-176.6	-41.5	-119.9	-12.7	0	0	0	108.3
477	F	31.8	Very low	31.2	Very low	200 Å²	200	139 Å²	139	88%	0.877	73%	0.731	S	S	*	*			trans	70.4	122.9	-178	-57.7	-85.2	0	0	0	114.6
478	G	30.3	Very low	31.5	Very low	62 Å²	62	134.1 Å²	134.1	64%	0.639	72%	0.722	S	S	*	*			cis	121.8	150.6	-7.6	0	0	0	0	0	113.3
479	N	32.8	Very low	31.7	Very low	146 Å²	146	133.1 Å²	133.1	78%	0.781	72%	0.717	S	S	*	*			trans	65.3	146	-171.8	-52.1	-4.1	0	0	0	112.7
480	N	32.2	Very low	31.9	Very low	124 Å²	124	132.8 Å²	132.8	66%	0.663	72%	0.715	S	S	*	*			cis	-154.5	167.1	-12.5	-109.9	11.2	0	0	0	104.9
481	E	33.8	Very low	32.1	Very low	132 Å²	132	130.8 Å²	130.8	62%	0.617	71%	0.71	S	S	*	*			cis	-169.2	163.2	18.6	-135.6	162.8	-101.8	0	0	108.9
482	N	33.6	Very low	32.3	Very low	117 Å²	117	129.9 Å²	129.9	63%	0.626	71%	0.71	S	S	*	*			trans	63.3	141.3	152.3	-59	-34.9	0	0	0	118.9
483	N	33.6	Very low	32.5	Very low	117 Å²	117	126.5 Å²	126.5	63%	0.626	70%	0.698	S	S	*	*			cis	-161	156.5	-5.1	-128.4	-36.1	0	0	0	111.1
484	Q	34.6	Very low	32.6	Very low	153 Å²	153	128 Å²	128	72%	0.715	70%	0.698	S	S	*	*			trans	65.6	152.5	155	-65.3	163.8	22.7	0	0	118
485	H	34.7	Very low	32.8	Very low	165 Å²	165	131 Å²	131	76%	0.764	70%	0.702	S	S	*	*			cis	-142.5	144.8	-5.5	-134	-66	0	0	0	109.9
486	A	32.8	Very low	32.7	Very low	78 Å²	78	128.4 Å²	128.4	65%	0.645	69%	0.693	S	S	*	*			trans	-89.7	145.1	174.1	0	0	0	0	0	112.4
487	N	37.2	Very low	32.9	Very low	146 Å²	146	126.7 Å²	126.7	78%	0.781	69%	0.688	S	S	*	*			trans	-158	107.6	151.4	-91.4	-40.6	0	0	0	105.1
488	N	35.3	Very low	32.9	Very low	123 Å²	123	125.7 Å²	125.7	66%	0.658	68%	0.684	S	S	*	*				76.3	115.1	86.2	-78.9	26.1	0	0	0	112.8
489	D	33.2	Very low	32.8	Very low	134 Å²	134	128.4 Å²	128.4	72%	0.717	68%	0.683	S	S	*	*				63.1	145.8	127.1	-63.8	-11	0	0	0	121.8
490	H	31	Very low	32.6	Very low	157 Å²	157	128.6 Å²	128.6	73%	0.727	68%	0.679	S	S	*	*			cis	-173.3	165.1	-27	-141.1	-5.3	0	0	0	107
491	T	31.6	Very low	32.5	Very low	117 Å²	117	128.3 Å²	128.3	72%	0.718	68%	0.677	S	S	*	*			trans	61.1	179.3	173.4	82.9	0	0	0	0	113.9
492	N	31.1	Very low	32.1	Very low	140 Å²	140	125.5 Å²	125.5	75%	0.749	67%	0.672	S	S	*	*			cis	-150.7	165.9	-4.4	-126	-29.4	0	0	0	105.6
493	S	30.9	Very low	31.7	Very low	74 Å²	74	127.7 Å²	127.7	52%	0.517	68%	0.676	S	S	.	*			cis	-167.4	-174.1	8.9	45.1	0	0	0	0	107.8
494	N	34.1	Very low	31.4	Very low	135 Å²	135	128.8 Å²	128.8	72%	0.722	68%	0.676	S	S	*	*			trans	76.4	133.2	160	-51.5	-29.8	0	0	0	116.5
495	H	34	Very low	31.1	Very low	154 Å²	154	130.2 Å²	130.2	71%	0.713	68%	0.676	S	S	*	*			cis	-154.3	148.5	-3.5	-142	-130.7	0	0	0	110.5
496	C	28.9	Very low	30.6	Very low	85 Å²	85	127.1 Å²	127.1	57%	0.574	67%	0.672	S	S	*	*			trans	39.9	141.9	137.6	-70.6	0	0	0	0	121.5
497	T	33.1	Very low	30.3	Very low	102 Å²	102	128.5 Å²	128.5	63%	0.626	68%	0.677	S	S	*	*			cis	-169.5	149.6	16	8.1	0	0	0	0	111.9
498	K	31.4	Very low	29.8	Very low	179 Å²	179	126.8 Å²	126.8	78%	0.778	67%	0.673	S	S	*	*			trans	68.1	152.4	149.3	-62.6	169.1	175.2	-178	0	118
499	L	29.3	Very low	29.3	Very low	119 Å²	119	128.7 Å²	128.7	62%	0.623	68%	0.678	S	S	*	*			cis	-167.8	142.3	-20.4	-104.9	168.5	0	0	0	106.9
500	Q	28.6	Very low	29	Very low	149 Å²	149	129.7 Å²	129.7	70%	0.696	68%	0.683	S	S	*	*			trans	60.2	169.5	144.1	-70.6	172.6	-30.7	0	0	117.1
501	N	29.2	Very low	28.7	Very low	118 Å²	118	126 Å²	126	63%	0.631	68%	0.675	S	S	*	*			cis	-151.9	128.6	-20.5	-113.8	-4.8	0	0	0	105.5
502	S	26.3	Very low	28.3	Very low	73 Å²	73	126.6 Å²	126.6	51%	0.51	67%	0.673	S	S	.	*				61.6	147.6	95.9	80.5	0	0	0	0	116.6
503	F	25.2	Very low	28.1	Very low	163 Å²	163	126.9 Å²	126.9	72%	0.715	67%	0.673	S	S	*	*			trans	78.6	120.9	-178.9	-58.1	-78.9	0	0	0	113.7
504	K	27.8	Very low	27.9	Very low	140 Å²	140	127.6 Å²	127.6	61%	0.609	68%	0.683	S	S	*	*			cis	99.6	150.3	41.7	-87.8	-157	-159.1	167	0	109.9
505	Y	26.8	Very low	27.6	Very low	184 Å²	184	125.7 Å²	125.7	72%	0.722	68%	0.681	S	S	*	*			trans	70.1	145.4	167.2	-52.6	-59.5	0	0	0	114.4
506	S	25.6	Very low	27.2	Very low	99 Å²	99	124.1 Å²	124.1	69%	0.692	68%	0.682	S	S	*	*			cis	-156.6	159.1	-13.1	-112.5	0	0	0	0	110.4
507	C	26.4	Very low	27.5	Very low	108 Å²	108	127.8 Å²	127.8	73%	0.73	70%	0.696	S	S	*	*			trans	-67.2	140.2	157.8	-166	0	0	0	0	108.8	Q509	C507-Q509 PolarHBondContact SG-N 3.45Å
508	P	27.1	Very low	27.2	Very low	109 Å²	109	127.3 Å²	127.3	71%	0.708	70%	0.695	S	S	*	*				-124.9	141.6	113.7	38.2	-33.2	0	0	0	109.6
509	Q	24.1	Very low	26.8	Very low	163 Å²	163	125.2 Å²	125.2	76%	0.762	69%	0.69	S	S	*	*				54.6	84.3	56.1	-68.4	-166.3	-26.3	0	0	112.7	C507	C507-Q509 PolarHBondContact SG-N 3.45Å
510	L	25.9	Very low	26.6	Very low	156 Å²	156	126.1 Å²	126.1	82%	0.817	70%	0.696	S	S	*	*				-156.1	118	109.6	-77.5	125	0	0	0	103.8
511	S	24.9	Very low	26.5	Very low	80 Å²	80	123.3 Å²	123.3	56%	0.559	69%	0.692	S	S	*	*				62.4	152.7	61	81.4	0	0	0	0	112.6
512	D	24.8	Very low	26.4	Very low	128 Å²	128	123.3 Å²	123.3	68%	0.684	69%	0.692	S	S	*	*			trans	59.2	107.5	160.9	-44.1	-44.6	0	0	0	115.4
513	I	26.7	Very low	26.5	Very low	147 Å²	147	125.5 Å²	125.5	75%	0.754	70%	0.698	S	S	*	*			cis	-147.8	135.1	27.2	-91.2	126.7	0	0	0	106.1
514	A	26.6	Very low	26.6	Very low	88 Å²	88	125 Å²	125	73%	0.727	70%	0.703	S	S	*	*				57.3	156.9	76.2	0	0	0	0	0	112.2
515	S	26.5	Very low	26.7	Very low	95 Å²	95	122 Å²	122	66%	0.664	70%	0.704	S	S	*	*			cis	-163.5	148.6	2	47	0	0	0	0	109.5
516	V	26.7	Very low	26.8	Very low	122 Å²	122	117.5 Å²	117.5	74%	0.739	71%	0.705	S	S	*	*				49.5	107.3	125.8	-177	0	0	0	0	116.6
517	N	33.9	Very low	27.1	Very low	161 Å²	161	117 Å²	117	86%	0.861	71%	0.706	S	S	*	*			trans	-35.3	128.2	142.3	-77.3	-19.6	0	0	0	108.2
518	P	27.5	Very low	27.3	Very low	93 Å²	93	117 Å²	117	60%	0.604	70%	0.703	S	S	*	*				-161.8	-172.8	92.9	37.6	-14.9	0	0	0	116.1
519	I	24	Very low	27.3	Very low	135 Å²	135	122.1 Å²	122.1	69%	0.692	71%	0.708	S	S	*	*			trans	66.9	119.5	134.4	-83.9	160	0	0	0	118
520	N	25.3	Very low	27.4	Very low	138 Å²	138	118.9 Å²	118.9	74%	0.738	70%	0.704	S	S	*	*			trans	70	151.7	146.1	-68.9	13.9	0	0	0	117.7
521	C	25.1	Very low	27.5	Very low	90 Å²	90	115.1 Å²	115.1	61%	0.608	69%	0.691	S	S	*	*			cis	-155.7	161.2	-8.7	-119	0	0	0	0	110.6
522	N	26.5	Very low	27.6	Very low	118 Å²	118	118.4 Å²	118.4	63%	0.631	70%	0.701	S	S	*	*			trans	61.4	121.1	140.8	-74.3	42.7	0	0	0	120.9
523	D	28.4	Very low	27.7	Very low	119 Å²	119	118 Å²	118	64%	0.636	70%	0.698	S	S	*	*				75.9	128.1	120.4	-52.1	-9.5	0	0	0	120.1
524	D	29.2	Very low	27.6	Very low	153 Å²	153	119.4 Å²	119.4	82%	0.818	69%	0.694	S	S	*	*			trans	70.3	147.1	132.8	-71.9	-3.5	0	0	0	120.3
525	A	29	Very low	27.6	Very low	76 Å²	76	122.1 Å²	122.1	63%	0.628	69%	0.692	S	S	*	*			cis	-165.2	-178.8	-17.7	0	0	0	0	0	108.7
526	A	29.6	Very low	27.6	Very low	90 Å²	90	122.2 Å²	122.2	74%	0.744	69%	0.691	S	S	*	*			trans	57.7	98.8	151	0	0	0	0	0	116.5
527	A	30	Very low	27.7	Very low	88 Å²	88	123.2 Å²	123.2	73%	0.727	69%	0.688	S	S	*	*				89.3	170.8	94.9	0	0	0	0	0	111.4
528	T	31.5	Very low	27.4	Very low	109 Å²	109	122.8 Å²	122.8	67%	0.669	68%	0.68	S	S	*	*			cis	-149.4	152.5	15.5	-33.2	0	0	0	0	110.8
529	R	26.6	Very low	27.5	Very low	215 Å²	215	125.2 Å²	125.2	81%	0.811	69%	0.693	S	S	*	*			trans	47.8	118.6	147.7	-85.6	168.6	177.8	150.4	-1.9	118.3
530	S	27.5	Very low	27.8	Very low	95 Å²	95	122.4 Å²	122.4	66%	0.664	70%	0.698	S	S	*	*				72.2	156.4	80.1	101.7	0	0	0	0	112.3
531	S	27.2	Very low	27.8	Very low	78 Å²	78	126.3 Å²	126.3	55%	0.545	71%	0.708	S	S	.	*			cis	177.3	174.2	4.4	34.5	0	0	0	0	107.4
532	I	27.7	Very low	28	Very low	149 Å²	149	125.6 Å²	125.6	76%	0.764	72%	0.715	S	S	*	*			trans	70.6	132.3	140	-84.5	161.2	0	0	0	115.4
533	N	25.2	Very low	27.9	Very low	119 Å²	119	131 Å²	131	64%	0.636	73%	0.728	S	S	*	*			cis	-173.7	-169.5	-8.5	-156.2	-17	0	0	0	107.1
534	R	26.4	Very low	27.7	Very low	176 Å²	176	130.4 Å²	130.4	66%	0.664	73%	0.733	S	S	*	*			trans	68	127.6	139.6	-78.6	166.3	178.2	-97.6	5.8	119.7
535	E	26.6	Very low	27.5	Very low	145 Å²	145	131.1 Å²	131.1	68%	0.678	73%	0.731	S	S	*	*				70	131.4	121.9	-64.9	172.6	130.6	0	0	119.2
536	C	25.3	Very low	27.3	Very low	97 Å²	97	138.2 Å²	138.2	66%	0.655	74%	0.742	S	S	*	*			cis	-171.1	-173.1	-13	-148.2	0	0	0	0	111.1
537	H	28.8	Very low	27.1	Very low	144 Å²	144	139.6 Å²	139.6	67%	0.667	75%	0.746	S	S	*	*			trans	70	132.5	143.8	-83.9	-67.6	0	0	0	121.4
538	H	28.7	Very low	27	Very low	152 Å²	152	139.5 Å²	139.5	70%	0.704	75%	0.754	S	S	*	*			trans	70.9	109.3	149.1	-65.2	-46.5	0	0	0	118.6
539	V	28.7	Very low	26.8	Very low	143 Å²	143	138.1 Å²	138.1	87%	0.867	76%	0.76	S	S	*	*				84.6	119.2	74	162.2	0	0	0	0	111.9
540	G	30.2	Very low	26.9	Very low	77 Å²	77	132.5 Å²	132.5	79%	0.794	75%	0.754	S	S	*	*			trans	170.4	101.3	172.2	0	0	0	0	0	112.7
541	K	26.3	Very low	27	Very low	220 Å²	220	137.8 Å²	137.8	96%	0.957	76%	0.761	S	S	*	*			trans	-82.4	141.4	159.6	-60.9	173.3	-178.4	174.2	0	107.3
542	G	27.9	Very low	27.1	Very low	74 Å²	74	142 Å²	142	76%	0.763	77%	0.77	S	S	*	*			trans	173.1	109.1	170.3	0	0	0	0	0	115.6
543	Y	24.7	Very low	27.2	Very low	231 Å²	231	139.6 Å²	139.6	91%	0.906	77%	0.767	S	S	*	*			trans	-55.8	161.2	171.1	-78	-98.7	0	0	0	115.7
544	C	24	Very low	27.4	Very low	107 Å²	107	140.2 Å²	140.2	72%	0.723	77%	0.774	S	S	*	*			trans	95.4	139.1	147.5	-74.7	0	0	0	0	121.7
545	Q	25.9	Very low	27.5	Very low	169 Å²	169	140.7 Å²	140.7	79%	0.79	78%	0.784	S	S	*	*			trans	71.5	111.7	152.3	-72.2	169.4	-64.4	0	0	121.5
546	R	23.9	Very low	27.5	Very low	225 Å²	225	143.5 Å²	143.5	85%	0.849	79%	0.788	S	S	*	*				43.5	120.1	128.8	-64	-179.5	168	-168.3	-3.5	118.7
547	S	25.5	Very low	27.5	Very low	119 Å²	119	142.9 Å²	142.9	83%	0.832	79%	0.785	S	S	*	*				175.2	148.9	91	-73.2	0	0	0	0	113.4
548	G	27.7	Very low	27.4	Very low	86 Å²	86	141.9 Å²	141.9	89%	0.887	79%	0.785	S	S	*	*			trans	74.2	136.7	173.1	0	0	0	0	0	114.7
549	G	28.5	Very low	27.3	Very low	79 Å²	79	140.6 Å²	140.6	81%	0.814	78%	0.783	S	S	*	*			cis	-167.5	-171.4	-6.9	0	0	0	0	0	108
550	S	28.5	Very low	27.3	Very low	97 Å²	97	141.4 Å²	141.4	68%	0.678	78%	0.777	S	S	*	*			cis	-168.5	112.7	-7.6	173.5	0	0	0	0	109.5
551	Y	29.4	Very low	27.2	Very low	207 Å²	207	145 Å²	145	81%	0.812	77%	0.773	S	S	*	*			trans	67.5	144.4	163.4	-66.5	-132.8	0	0	0	116.5
552	F	29.2	Very low	27.2	Very low	165 Å²	165	139.2 Å²	139.2	72%	0.724	76%	0.76	S	S	*	*			cis	-150.9	125.6	-10.4	-131.2	-125.3	0	0	0	105.9
553	S	28.8	Very low	27.1	Very low	100 Å²	100	140.9 Å²	140.9	70%	0.699	76%	0.759	S	S	*	*				57.6	134.9	94.5	-66.5	0	0	0	0	115.2
554	V	30.9	Very low	27.2	Very low	132 Å²	132	135.1 Å²	135.1	80%	0.8	75%	0.751	S	S	*	*			cis	-136.1	137.9	24.3	174.4	0	0	0	0	113.3
555	H	27.2	Very low	27.5	Very low	186 Å²	186	137.8 Å²	137.8	86%	0.861	76%	0.757	S	S	*	*			trans	-109.2	132.4	157.8	-134.8	-85.6	0	0	0	106.9
556	R	26.8	Very low	27.6	Very low	203 Å²	203	136.5 Å²	136.5	77%	0.766	76%	0.756	S	S	*	*			trans	-161.1	110.9	157.3	-117.6	-174.7	-175.6	-150	-3.2	114.4
557	S	26.9	Very low	28.1	Very low	85 Å²	85	135.3 Å²	135.3	59%	0.594	76%	0.756	S	S	*	*			trans	-85.6	-178	143.1	60.5	0	0	0	0	109.5
558	N	25.4	Very low	28.4	Very low	123 Å²	123	136.4 Å²	136.4	66%	0.658	75%	0.753	S	S	*	*			trans	83.8	116.6	166.2	-52	7.4	0	0	0	117.6
559	N	26.8	Very low	28.8	Very low	125 Å²	125	138.4 Å²	138.4	67%	0.668	75%	0.748	S	S	*	*				40	113	125.1	-54.8	11	0	0	0	119.5
560	H	29.3	Very low	29	Very low	159 Å²	159	143.2 Å²	143.2	74%	0.736	75%	0.747	S	S	*	*			trans	-128.7	122.6	130.7	-86.5	-90.7	0	0	0	104.3
561	H	27.7	Very low	29.3	Very low	154 Å²	154	145.9 Å²	145.9	71%	0.713	75%	0.754	S	S	*	*				46.6	123.8	56.7	-71.9	-79.2	0	0	0	112.2
562	S	25.8	Very low	29.3	Very low	97 Å²	97	143.2 Å²	143.2	68%	0.678	75%	0.753	S	S	*	*			cis	-177.9	157.5	1.3	42.2	0	0	0	0	108.5
563	C	27	Very low	29.4	Very low	110 Å²	110	142.1 Å²	142.1	74%	0.743	76%	0.76	S	S	*	*				166.5	126.7	129.8	-94.9	0	0	0	0	112.3
564	C	26.1	Very low	29.3	Very low	109 Å²	109	143.2 Å²	143.2	74%	0.736	76%	0.762	S	S	*	*			trans	63	140.5	146.6	-53.4	0	0	0	0	118.5
565	L	30.4	Very low	29.4	Very low	163 Å²	163	142.6 Å²	142.6	85%	0.853	76%	0.759	S	S	*	*			cis	-126.4	151.8	7.8	-74.4	167.6	0	0	0	112.1
566	D	28	Very low	29.4	Very low	143 Å²	143	140.9 Å²	140.9	77%	0.765	76%	0.756	S	S	*	*			trans	-73.9	155.5	169.9	-49.5	-88.4	0	0	0	112.5
567	K	34.7	Very low	29.8	Very low	199 Å²	199	138.8 Å²	138.8	87%	0.865	76%	0.758	S	S	*	*			trans	-159.5	123	136.8	-110.8	167.4	-173.7	175.7	0	110.7
568	D	30.9	Very low	29.9	Very low	142 Å²	142	141.8 Å²	141.8	76%	0.759	77%	0.767	S	S	*	*			trans	-58.2	162.9	166.3	-50.1	-101.7	0	0	0	110.6
569	T	36	Very low	30	Very low	128 Å²	128	143.2 Å²	143.2	79%	0.785	77%	0.77	S	S	*	*			cis	-157.4	148.4	40.9	47.5	0	0	0	0	114.6
570	K	32.6	Very low	30.1	Very low	180 Å²	180	143.4 Å²	143.4	78%	0.783	78%	0.78	S	S	*	*			trans	-3.7	136.3	144.3	-54.6	167.2	-177	171.6	0	117.9
571	N	35.6	Very low	30	Very low	154 Å²	154	141.9 Å²	141.9	82%	0.824	78%	0.776	S	S	*	*				-167.1	153.8	101.7	-94.2	-12	0	0	0	111.9
572	D	29.3	Very low	30.1	Very low	150 Å²	150	140.4 Å²	140.4	80%	0.802	78%	0.778	S	S	*	*			trans	-78.7	148.4	-176.8	-50	-92	0	0	0	113.4
573	T	32.2	Very low	30.1	Very low	143 Å²	143	142.5 Å²	142.5	88%	0.877	78%	0.781	S	S	*	*			trans	-159.1	136.1	136.5	-5.8	0	0	0	0	111.1
574	V	26.6	Very low	30.4	Very low	122 Å²	122	143.2 Å²	143.2	74%	0.739	78%	0.782	S	S	*	*			trans	-93	135.4	177.1	174.4	0	0	0	0	109.6
575	V	33	Very low	30.6	Very low	119 Å²	119	144.5 Å²	144.5	72%	0.721	78%	0.782	S	S	*	*			trans	-141.4	102.9	159.6	-170.9	0	0	0	0	109.3	I577	V575-I577 HydrophobicContact CG1-CD1 4.18Å; V575-I577 HydrophobicContact CG1-CG1 3.77Å
576	D	27.3	Very low	30.7	Very low	151 Å²	151	144.6 Å²	144.6	81%	0.807	78%	0.777	S	S	*	*			trans	-73.4	141.7	156	-78.3	-54	0	0	0	108.9
577	I	34.8	Very low	30.8	Very low	158 Å²	158	144.8 Å²	144.8	81%	0.81	78%	0.779	S	S	*	*			trans	-132.5	92.7	162.4	-53.2	-175	0	0	0	108.4	V575	V575-I577 HydrophobicContact CG1-CD1 4.18Å; V575-I577 HydrophobicContact CG1-CG1 3.77Å
578	D	27.6	Very low	30.9	Very low	148 Å²	148	143.3 Å²	143.3	79%	0.791	78%	0.78	S	S	*	*			trans	-85.7	165	161	-130	-29.4	0	0	0	110.1
579	E	27.8	Very low	30.9	Very low	153 Å²	153	144.9 Å²	144.9	72%	0.715	78%	0.783	S	S	*	*			trans	35.6	115	169.5	-61.7	-158.6	125.8	0	0	121.1
580	C	29.2	Very low	30.9	Very low	130 Å²	130	146 Å²	146	88%	0.878	78%	0.783	S	S	*	*			trans	-137.2	96.3	141.4	-100.5	0	0	0	0	110.8
581	I	26.5	Very low	30.8	Very low	127 Å²	127	142 Å²	142	65%	0.651	78%	0.777	S	S	*	*			trans	-82.8	128.2	167	-62.4	170.3	0	0	0	108.2
582	V	30.3	Very low	30.7	Very low	123 Å²	123	141.1 Å²	141.1	75%	0.745	77%	0.772	S	S	*	*			trans	-119.4	97.3	169	-178.2	0	0	0	0	109	V584	V582-V584 HydrophobicContact CG1-CG2 4.08Å
583	N	27	Very low	30.9	Very low	140 Å²	140	141.4 Å²	141.4	75%	0.749	77%	0.773	S	S	*	*			trans	-87.3	132	160.7	-70.3	-24	0	0	0	108.1
584	V	33.7	Very low	31	Very low	126 Å²	126	140.5 Å²	140.5	76%	0.764	77%	0.77	S	S	*	*			trans	-136.2	119.3	159.4	-176.4	0	0	0	0	107.3	V582	V582-V584 HydrophobicContact CG1-CG2 4.08Å
585	N	28.8	Very low	31.3	Very low	136 Å²	136	143.8 Å²	143.8	73%	0.727	78%	0.777	S	S	*	*			trans	-122.6	168.8	169.4	-72.4	-4.9	0	0	0	108.1
586	E	32.2	Very low	31.2	Very low	164 Å²	164	142.3 Å²	142.3	77%	0.766	78%	0.777	S	S	*	*			trans	74.8	101.7	161.5	-41.6	-163.7	169.9	0	0	115.5
587	D	30.9	Very low	31.5	Very low	148 Å²	148	141 Å²	141	79%	0.791	78%	0.777	S	S	*	*				48.7	115.2	118.4	-46.4	-18	0	0	0	119.3
588	D	35.7	Very low	31.3	Very low	168 Å²	168	141.3 Å²	141.3	90%	0.898	78%	0.78	S	S	*	*				-169.7	165.2	108.4	-107.1	-27.1	0	0	0	112.7
589	E	32.2	Very low	31.7	Very low	174 Å²	174	139.7 Å²	139.7	81%	0.813	78%	0.777	S	S	*	*			trans	-81.3	163.6	-179	-56.9	-177.3	132.5	0	0	113.5
590	I	34.8	Very low	32	Very low	153 Å²	153	138.1 Å²	138.1	79%	0.785	78%	0.78	S	S	*	*			trans	159.1	104.2	131.1	-79.9	158.7	0	0	0	113
591	S	31.5	Very low	32	Very low	94 Å²	94	140 Å²	140	66%	0.657	78%	0.78	S	S	*	*			trans	60.8	116.4	131	-54.8	0	0	0	0	124.5
592	N	33.6	Very low	32.1	Very low	136 Å²	136	144.3 Å²	144.3	73%	0.727	79%	0.79	S	S	*	*				91.3	112.3	122	-68.2	-14.3	0	0	0	123.5
593	L	32.3	Very low	32	Very low	156 Å²	156	144.9 Å²	144.9	82%	0.817	79%	0.789	S	S	*	*			trans	76.2	152.6	133.4	-63.6	167.9	0	0	0	120.2
594	P	35.3	Very low	32.1	Very low	125 Å²	125	145.7 Å²	145.7	81%	0.812	79%	0.793	S	S	*	*			cis	-126.3	179.5	-20.7	34.4	-15.6	0	0	0	114.4
595	E	31.9	Very low	31.8	Very low	191 Å²	191	144.2 Å²	144.2	89%	0.893	79%	0.788	S	S	*	*			trans	-98.3	161.7	-168	-176.4	174.5	-157.2	0	0	114.2
596	A	31.7	Very low	31.8	Very low	88 Å²	88	143.2 Å²	143.2	73%	0.727	79%	0.792	S	S	*	*			trans	-136.6	143	166.8	0	0	0	0	0	110.7
597	P	33.8	Very low	31.6	Very low	123 Å²	123	145.3 Å²	145.3	80%	0.799	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-92.7	157.8	-153	35.3	-38.2	0	0	0	116.7
598	L	31.5	Very low	31.4	Very low	165 Å²	165	141.6 Å²	141.6	86%	0.864	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-89.1	151.6	171.6	-68.2	168.9	0	0	0	112.8
599	P	34.9	Very low	31	Very low	114 Å²	114	137.3 Å²	137.3	74%	0.74	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-72.8	156.2	163.2	32.3	-34.2	0	0	0	111.7
600	P	33.6	Very low	30.7	Very low	119 Å²	119	132.1 Å²	132.1	77%	0.773	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-82.7	149.8	-162.4	31.8	-36.9	0	0	0	115.6
601	L	28.9	Very low	30.2	Very low	170 Å²	170	131 Å²	131	89%	0.89	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-72.7	129.3	165.7	-74.3	162	0	0	0	110.9
602	Y	29.2	Very low	30.2	Very low	217 Å²	217	135.6 Å²	135.6	85%	0.851	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-82.6	121.3	160.8	-100.9	-88.8	0	0	0	109.6
603	N	28.8	Very low	29.9	Very low	136 Å²	136	132.4 Å²	132.4	73%	0.727	74%	0.738	S	S	*	*			trans	-133	84.6	-176.5	-169.4	22.1	0	0	0	109.8
604	N	29.3	Very low	29.7	Very low	156 Å²	156	133.8 Å²	133.8	83%	0.834	74%	0.74	S	S	*	*			trans	-85	120.4	176.2	-88.2	10.2	0	0	0	110.5
605	S	26.9	Very low	29.2	Very low	95 Å²	95	133.1 Å²	133.1	66%	0.664	74%	0.739	S	S	*	*			trans	-135.2	167.7	171.8	62.3	0	0	0	0	109.4
606	S	29.5	Very low	29.1	Very low	115 Å²	115	130.2 Å²	130.2	80%	0.804	73%	0.733	S	S	*	*			trans	71.3	154.5	-168.7	88.3	0	0	0	0	113.6
607	Y	26.4	Very low	28.7	Very low	208 Å²	208	131.2 Å²	131.2	82%	0.816	73%	0.734	S	S	*	*			cis	-155.2	163.8	0.9	-153.3	-136.4	0	0	0	112.3
608	C	28.1	Very low	28.5	Very low	70 Å²	70	131.8 Å²	131.8	47%	0.473	74%	0.74	S	S	.	*			trans	52	113.8	158.3	-84.5	0	0	0	0	123.4
609	D	26.1	Very low	28.3	Very low	78 Å²	78	131.7 Å²	131.7	42%	0.417	73%	0.734	S	S	.	*				71.7	118.3	109.2	-72.6	14.3	0	0	0	125.1	F408 H409	F408-D609 HydrophobicContact CD1-CB 4.05Å; F408-D609 HydrophobicContact CE1-CB 3.79Å; F408-D609 WeakPolarHBondContact CE1-O 3.35Å; F408-D609 VanDerWaalsContact CZ-O 3.3Å; F408-D609 WeakPolarHBondContact CZ-O 3.41Å; H409-D609 IonicContact CE1-OD2 3.27Å; H409-D609 PolarHBondContact CE1-OD2 3.04Å; H409-D609 VanDerWaalsContact CE1-OD2 3.27Å; H409-D609 IonicContact ND1-OD2 3.29Å; H409-D609 PolarHBondContact ND1-OD2 3.31Å
610	I	26	Very low	27.9	Very low	66 Å²	66	136.6 Å²	136.6	34%	0.338	74%	0.738	S	S	.	*				51.5	144.3	129.6	-19.3	143.5	0	0	0	123.7	F408 H410	F408-I610 HydrophobicContact CD1-CD1 4.12Å; F408-I610 HydrophobicContact CE1-CB 4.01Å; F408-I610 HydrophobicContact CE1-CD1 4.25Å; F408-I610 HydrophobicContact CE1-CG1 4.45Å; F408-I610 VanDerWaalsContact CE1-O 3.24Å; F408-I610 WeakPolarHBondContact CE1-O 3.35Å; F408-I610 WeakPolarHBondContact CZ-O 3.25Å; H410-I610 WeakPolarHBondContact CE1-CD1 3.25Å; H410-I610 WeakPolarHBondContact NE2-CD1 3.36Å
611	I	25.9	Very low	27.5	Very low	129 Å²	129	136.1 Å²	136.1	66%	0.662	73%	0.728	S	S	*	*			trans	86.1	133.7	157.2	-28.5	178.2	0	0	0	117.5
612	Q	29.8	Very low	27.6	Very low	191 Å²	191	138.7 Å²	138.7	89%	0.893	73%	0.728	S	S	*	*			trans	70.9	146	175.4	-45.7	-168.4	7.8	0	0	115.2
613	G	27.8	Very low	27.6	Very low	68 Å²	68	134.6 Å²	134.6	70%	0.701	72%	0.72	S	S	*	*			cis	161.3	114.2	-9.1	0	0	0	0	0	112.6
614	Q	28.1	Very low	27.7	Very low	186 Å²	186	135.4 Å²	135.4	87%	0.869	73%	0.725	S	S	*	*			trans	53.2	108.3	163.3	-66.4	179.2	-29.3	0	0	119.7
615	S	25.6	Very low	27.8	Very low	111 Å²	111	136 Å²	136	78%	0.776	73%	0.727	S	S	*	*				83.6	160.6	124.8	79.2	0	0	0	0	122
616	V	29.2	Very low	28	Very low	129 Å²	129	140 Å²	140	78%	0.782	74%	0.739	S	S	*	*			trans	65.3	95.3	165.9	-166.4	0	0	0	0	118.5
617	C	24	Very low	28.1	Very low	110 Å²	110	138.4 Å²	138.4	74%	0.743	73%	0.733	S	S	*	*				24	122.6	127.9	-166.4	0	0	0	0	119.5
618	C	29	Very low	28.2	Very low	135 Å²	135	134.3 Å²	134.3	91%	0.912	73%	0.729	S	S	*	*			trans	-147.7	141.3	143.7	-141.4	0	0	0	0	110.7
619	Q	26.6	Very low	28.4	Very low	162 Å²	162	137.2 Å²	137.2	76%	0.757	74%	0.74	S	S	*	*			trans	-118.9	141.6	-174.7	179.7	166.1	-9.2	0	0	109.8
620	R	27.6	Very low	28.7	Very low	218 Å²	218	140.6 Å²	140.6	82%	0.823	76%	0.758	S	S	*	*			trans	162.5	136.1	131.8	-89.7	163.4	-167.7	-146.3	1.2	115.2
621	I	25.8	Very low	29	Very low	109 Å²	109	141 Å²	141	56%	0.559	78%	0.779	S	S	*	*			trans	63.6	118.8	132.6	-60.6	166.6	0	0	0	118.4
622	Y	29.9	Very low	29.4	Very low	224 Å²	224	140.7 Å²	140.7	88%	0.878	78%	0.782	S	S	*	*				-153.7	120.2	107.5	-100.6	-69	0	0	0	111.2
623	D	28.4	Very low	29.5	Very low	130 Å²	130	137.8 Å²	137.8	70%	0.695	77%	0.773	S	S	*	*			trans	-81.1	163.5	172.7	-62	-77.7	0	0	0	112
624	N	31.9	Very low	29.7	Very low	153 Å²	153	141.1 Å²	141.1	82%	0.818	78%	0.775	S	S	*	*				172.2	129.3	125	-93.3	-58.7	0	0	0	112.3
625	L	31	Very low	29.7	Very low	170 Å²	170	137.6 Å²	137.6	89%	0.89	77%	0.769	S	S	*	*			trans	144.2	73.6	145.5	-79.5	167.9	0	0	0	114.5
626	I	30.6	Very low	30.1	Very low	179 Å²	179	137 Å²	137	92%	0.918	77%	0.771	S	S	*	*			trans	-132.1	134.5	140.4	-65.1	-174.8	0	0	0	106.9
627	A	32.7	Very low	30.2	Very low	81 Å²	81	134.9 Å²	134.9	67%	0.669	76%	0.762	S	S	*	*			trans	-110.8	127.8	-174.3	0	0	0	0	0	112.7
628	V	27.9	Very low	30.5	Very low	121 Å²	121	137.1 Å²	137.1	73%	0.733	76%	0.761	S	S	*	*			trans	52.5	105.4	135.7	-176	0	0	0	0	118.2
629	N	32.1	Very low	30.7	Very low	132 Å²	132	137.1 Å²	137.1	71%	0.706	75%	0.753	S	S	*	*				-170.4	127.9	99.7	-113.3	-34.6	0	0	0	115.3
630	N	31.9	Very low	31.1	Very low	149 Å²	149	135.1 Å²	135.1	80%	0.797	75%	0.747	S	S	*	*			trans	32.5	126.8	144.3	-55	-14.9	0	0	0	121.8
631	G	33.1	Very low	31.4	Very low	75 Å²	75	130.5 Å²	130.5	77%	0.773	74%	0.739	S	S	*	*			trans	-149.4	-13.9	176.8	0	0	0	0	0	118.9
632	V	34.2	Very low	31.9	Very low	121 Å²	121	132.2 Å²	132.2	73%	0.733	75%	0.749	S	S	*	*			trans	70.2	108.1	162	-174.3	0	0	0	0	119
633	N	32.6	Very low	31.9	Very low	131 Å²	131	128.7 Å²	128.7	70%	0.701	75%	0.745	S	S	*	*			trans	73.5	121.2	143.7	-64.1	3.6	0	0	0	123.4
634	N	32.3	Very low	31.8	Very low	138 Å²	138	127.3 Å²	127.3	74%	0.738	75%	0.745	S	S	*	*			trans	73.1	146.2	132.1	-61.5	3.2	0	0	0	120.6
635	C	28.1	Very low	31.5	Very low	111 Å²	111	125.1 Å²	125.1	75%	0.75	74%	0.74	S	S	*	*			cis	173.8	134.9	-33.6	-110.9	0	0	0	0	106.6
636	A	32.3	Very low	31.5	Very low	99 Å²	99	122.8 Å²	122.8	82%	0.818	74%	0.737	S	S	*	*			trans	62.1	157.6	170.4	0	0	0	0	0	115.7
637	S	31.1	Very low	31.5	Very low	84 Å²	84	119 Å²	119	59%	0.587	73%	0.726	S	S	*	*			cis	-161.5	166.8	-26.3	48.7	0	0	0	0	108.6
638	E	31.2	Very low	31.1	Very low	157 Å²	157	121.7 Å²	121.7	73%	0.734	73%	0.734	S	S	*	*			trans	66.4	142	147.4	-73.6	150.4	159.8	0	0	120.2
639	N	33.2	Very low	31.1	Very low	136 Å²	136	120.8 Å²	120.8	73%	0.727	73%	0.729	S	S	*	*			trans	68.2	147.7	157	-51.4	-11.2	0	0	0	117.2
640	D	35.9	Very low	30.9	Very low	119 Å²	119	124.4 Å²	124.4	64%	0.636	73%	0.733	S	S	*	*			cis	-159.7	163.6	-22.4	-113.7	-34.6	0	0	0	109.5
641	N	34	Very low	30.8	Very low	121 Å²	121	127.9 Å²	127.9	65%	0.647	74%	0.735	S	S	*	*			trans	15.8	127.6	149.8	-46.6	-49.8	0	0	0	120.5
642	D	34.5	Very low	30.7	Very low	145 Å²	145	129.7 Å²	129.7	78%	0.775	74%	0.736	S	S	*	*				62.2	99.9	128	-56.7	-19.4	0	0	0	121.5
643	N	30.2	Very low	30.3	Very low	151 Å²	151	129 Å²	129	81%	0.807	74%	0.736	S	S	*	*				79	116.4	111.1	-155.9	4	0	0	0	120.7
644	C	26.4	Very low	30.2	Very low	100 Å²	100	128.7 Å²	128.7	68%	0.676	74%	0.741	S	S	*	*			trans	76.8	150.8	155.5	-153.8	0	0	0	0	121.9
645	C	26.5	Very low	29.9	Very low	107 Å²	107	126.7 Å²	126.7	72%	0.723	74%	0.738	S	S	*	*			trans	79.8	65	134.2	-62.9	0	0	0	0	119.3
646	C	30	Very low	29.9	Very low	121 Å²	121	129.3 Å²	129.3	82%	0.818	74%	0.741	S	S	*	*			trans	-155.8	127.3	142.3	-99.7	0	0	0	0	109.9
647	S	30.7	Very low	29.8	Very low	101 Å²	101	131.4 Å²	131.4	71%	0.706	74%	0.744	S	S	*	*				73.4	84.6	71.6	-64.2	0	0	0	0	114.7
648	T	25.7	Very low	29.7	Very low	136 Å²	136	133.8 Å²	133.8	83%	0.834	76%	0.755	S	S	*	*			trans	59.8	157.8	131.4	-39.1	0	0	0	0	120
649	V	28	Very low	29.8	Very low	102 Å²	102	132.3 Å²	132.3	62%	0.618	76%	0.759	S	S	*	*			trans	104	84.5	158.9	-168.5	0	0	0	0	117.9
650	R	27.4	Very low	29.6	Very low	209 Å²	209	130.8 Å²	130.8	79%	0.789	77%	0.765	S	S	*	*			trans	80.8	143.9	131	-65.3	174.4	-172	149.8	-0.1	122.3
651	R	29.1	Very low	29.1	Very low	222 Å²	222	131.3 Å²	131.3	84%	0.838	77%	0.773	S	S	*	*			trans	75.3	130.5	150.1	-76	163.3	-177.8	-171.1	-1.8	116.2
652	S	30.5	Very low	28.9	Very low	113 Å²	113	131 Å²	131	79%	0.79	78%	0.777	S	S	*	*			cis	-146.8	150.8	4.1	-68.3	0	0	0	0	112.9
653	S	26.5	Very low	28.6	Very low	106 Å²	106	130.7 Å²	130.7	74%	0.741	78%	0.781	S	S	*	*			trans	-77.5	167.6	161.3	-38	0	0	0	0	110.3
654	P	30.5	Very low	28.4	Very low	125 Å²	125	128.9 Å²	128.9	81%	0.812	78%	0.775	S	S	*	*				-117.6	159.6	52.8	27.6	-10.9	0	0	0	113.8
655	S	27	Very low	28.3	Very low	95 Å²	95	130 Å²	130	66%	0.664	78%	0.783	S	S	*	*			cis	90.8	101.1	24.5	-172.1	0	0	0	0	115.8
656	M	26.9	Very low	28.2	Very low	166 Å²	166	133.6 Å²	133.6	82%	0.818	79%	0.787	S	S	*	*			trans	52.8	118.9	143.7	-58.7	-72.5	97.3	0	0	120.2
657	T	30.2	Very low	28.3	Very low	143 Å²	143	132.4 Å²	132.4	88%	0.877	78%	0.778	S	S	*	*				-155.7	147.3	109.7	21.7	0	0	0	0	113.8
658	T	28.9	Very low	28.3	Very low	134 Å²	134	136.1 Å²	136.1	82%	0.822	78%	0.783	S	S	*	*			trans	-51	178.7	175	18.5	0	0	0	0	117.2
659	P	33	Very low	28.4	Very low	127 Å²	127	136.7 Å²	136.7	83%	0.825	78%	0.777	S	S	*	*			trans	-111.9	169.6	-139	42.9	-38.5	0	0	0	116.7
660	A	29.7	Very low	28.3	Very low	103 Å²	103	139 Å²	139	85%	0.851	79%	0.785	S	S	*	*			trans	-145.1	134.6	164.7	0	0	0	0	0	113.8
661	T	26.2	Very low	28.3	Very low	130 Å²	130	133.1 Å²	133.1	80%	0.798	78%	0.775	S	S	*	*			trans	-108.6	169.2	161.7	53.2	0	0	0	0	108.9
662	P	30.2	Very low	28.3	Very low	114 Å²	114	128.7 Å²	128.7	74%	0.74	77%	0.768	S	S	*	*			cis	-131.9	132.1	-48	34.9	-19.4	0	0	0	111.2
663	T	27.5	Very low	28.1	Very low	139 Å²	139	131.2 Å²	131.2	85%	0.853	77%	0.768	S	S	*	*			trans	-105.3	123.2	-176.8	-51	0	0	0	0	113.2
664	V	26.1	Very low	28.4	Very low	113 Å²	113	137 Å²	137	69%	0.685	78%	0.775	S	S	*	*			trans	-82.6	132.1	171.9	170.1	0	0	0	0	110	F666	V664-F666 HydrophobicContact CG1-CB 3.78Å; V664-F666 HydrophobicContact CG1-CD2 4.18Å
665	C	24.9	Very low	28.3	Very low	125 Å²	125	135.3 Å²	135.3	85%	0.845	77%	0.766	S	S	*	*			trans	-112.6	83.9	164.6	-71.1	0	0	0	0	110.4
666	F	24.3	Very low	28.3	Very low	181 Å²	181	137 Å²	137	79%	0.794	77%	0.768	S	S	*	*			trans	-134.2	161.2	170.5	-99.6	-57.4	0	0	0	106.3	V664	V664-F666 HydrophobicContact CG1-CB 3.78Å; V664-F666 HydrophobicContact CG1-CD2 4.18Å
667	P	31.7	Very low	28.4	Very low	97 Å²	97	135.7 Å²	135.7	63%	0.63	76%	0.764	S	S	*	*				-122.2	170.7	-95.7	40.4	-30.2	0	0	0	114.3
668	H	30.2	Very low	28.6	Very low	179 Å²	179	135.7 Å²	135.7	83%	0.829	76%	0.758	S	S	*	*			trans	-130.7	123.9	158.1	-81.2	-96.2	0	0	0	107.9
669	Q	27.5	Very low	28.7	Very low	148 Å²	148	135.7 Å²	135.7	69%	0.692	75%	0.753	S	S	*	*			cis	75.1	114.4	44.5	-73.6	-156	-19.1	0	0	115.6
670	L	27.1	Very low	28.6	Very low	151 Å²	151	136.3 Å²	136.3	79%	0.791	75%	0.748	S	S	*	*			trans	67.2	153.7	145.3	-58.1	167.3	0	0	0	117.8
671	S	26.4	Very low	28.8	Very low	84 Å²	84	136.1 Å²	136.1	59%	0.587	74%	0.741	S	S	*	*			cis	-169.3	-172.3	-28	56.6	0	0	0	0	108.6
672	N	28.7	Very low	28.9	Very low	129 Å²	129	136.9 Å²	136.9	69%	0.69	74%	0.74	S	S	*	*			trans	77.6	115	169.4	-57	23.2	0	0	0	114.1
673	E	27.3	Very low	28.9	Very low	166 Å²	166	137.7 Å²	137.7	78%	0.776	74%	0.742	S	S	*	*				74.2	105.7	74.2	-73.8	-172.5	142.8	0	0	114
674	Y	31.2	Very low	29	Very low	229 Å²	229	135.2 Å²	135.2	90%	0.898	74%	0.736	S	S	*	*			trans	-175.9	106.7	138.8	-107.6	-77.3	0	0	0	106.2
675	S	28.6	Very low	29.2	Very low	89 Å²	89	137.8 Å²	137.8	62%	0.622	74%	0.741	S	S	*	*				57.8	112.1	93.5	-124.9	0	0	0	0	115.4
676	D	28.8	Very low	29.5	Very low	131 Å²	131	138.2 Å²	138.2	70%	0.701	73%	0.733	S	S	*	*			trans	59.7	133.6	145.3	-58.4	-58.3	0	0	0	123
677	N	28.2	Very low	30	Very low	138 Å²	138	134.9 Å²	134.9	74%	0.738	72%	0.724	S	S	*	*			trans	67.6	125.4	147.6	-68	-41.8	0	0	0	120.9	N679	N677-N679 PolarHBondContact O-N 3.3Å
678	N	33.5	Very low	30	Very low	142 Å²	142	137.6 Å²	137.6	76%	0.759	73%	0.725	S	S	*	*				2.1	107.9	126.4	-62.1	-32.2	0	0	0	116
679	N	31	Very low	30.2	Very low	134 Å²	134	138 Å²	138	72%	0.717	73%	0.725	S	S	*	*				-167.6	123.3	101.2	-99.9	-22.1	0	0	0	115.2	N677	N677-N679 PolarHBondContact O-N 3.3Å
680	I	30.9	Very low	30.5	Very low	141 Å²	141	135.6 Å²	135.6	72%	0.723	73%	0.73	S	S	*	*			trans	76	148	133.6	-63.4	167.5	0	0	0	119
681	S	33.6	Very low	30.8	Very low	98 Å²	98	133.2 Å²	133.2	69%	0.685	73%	0.726	S	S	*	*			trans	67.8	115.3	175.9	37.1	0	0	0	0	116.2
682	N	28.8	Very low	31.1	Very low	147 Å²	147	134 Å²	134	79%	0.786	73%	0.727	S	S	*	*				69.4	104.9	53.7	-62.6	-5.2	0	0	0	111.2
683	V	30.4	Very low	31.5	Very low	130 Å²	130	135.7 Å²	135.7	79%	0.788	74%	0.736	S	S	*	*				92.6	108.9	68	161.9	0	0	0	0	111.4
684	A	30.7	Very low	31.7	Very low	88 Å²	88	134.3 Å²	134.3	73%	0.727	73%	0.73	S	S	*	*			trans	63.6	176	149.2	0	0	0	0	0	120.7
685	E	30.4	Very low	31.7	Very low	167 Å²	167	130 Å²	130	78%	0.78	72%	0.718	S	S	*	*			trans	74.4	99.8	161.2	-59.8	-153.2	122.3	0	0	121.2
686	I	30.9	Very low	31.7	Very low	134 Å²	134	131 Å²	131	69%	0.687	72%	0.72	S	S	*	*				76.5	137.2	113.2	-69.6	167.6	0	0	0	120.1
687	D	33.3	Very low	31.7	Very low	111 Å²	111	132 Å²	132	59%	0.594	73%	0.725	S	S	*	*			trans	77.4	108.7	155.3	-84.9	-4.5	0	0	0	123.3
688	K	32.6	Very low	31.8	Very low	153 Å²	153	130.4 Å²	130.4	67%	0.665	72%	0.72	S	S	*	*				78.1	118.8	117.1	-73.3	176.2	-179.2	89.8	0	120.7
689	K	34.6	Very low	31.5	Very low	189 Å²	189	131.1 Å²	131.1	82%	0.822	72%	0.723	S	S	*	*				89	131.2	128.1	-78.2	179.9	172.3	-172.6	0	119.4
690	A	33.6	Very low	31.3	Very low	96 Å²	96	128.3 Å²	128.3	79%	0.793	73%	0.726	S	S	*	*			trans	68.3	139.4	147.4	0	0	0	0	0	116.5
691	S	33.3	Very low	31.4	Very low	101 Å²	101	128.6 Å²	128.6	71%	0.706	73%	0.734	S	S	*	*			cis	-163.9	161.7	-8.4	42	0	0	0	0	108.8
692	V	33.8	Very low	31.2	Very low	102 Å²	102	127.1 Å²	127.1	62%	0.618	73%	0.734	S	S	*	*			trans	37.6	110.9	142.8	178.6	0	0	0	0	114.9	E694	V692-E694 HydrophobicContact CG1-CG 4.48Å
693	D	35.6	Very low	31.1	Very low	164 Å²	164	126.3 Å²	126.3	88%	0.877	74%	0.735	S	S	*	*				-115.2	148.3	70.9	-81.4	-51.3	0	0	0	119.4
694	E	32.4	Very low	31	Very low	137 Å²	137	127.5 Å²	127.5	64%	0.64	74%	0.736	S	S	*	*			trans	-78.6	167.1	170.2	-66.6	-173.6	139.1	0	0	110.8	V692	V692-E694 HydrophobicContact CG1-CG 4.48Å
695	Q	30.6	Very low	30.7	Very low	139 Å²	139	128.7 Å²	128.7	65%	0.65	73%	0.733	S	S	*	*			cis	-160.6	145.7	-15.1	-114.2	169.9	27.3	0	0	110.3
696	T	29.2	Very low	30.4	Very low	109 Å²	109	128.2 Å²	128.2	67%	0.669	74%	0.736	S	S	*	*				20.3	154.5	126.3	62.1	0	0	0	0	121.3
697	L	28.8	Very low	30.1	Very low	152 Å²	152	125.6 Å²	125.6	80%	0.796	73%	0.734	S	S	*	*			cis	174.7	-174.9	-9.1	-179.4	68.1	0	0	0	106.3
698	V	29.4	Very low	29.8	Very low	104 Å²	104	126.6 Å²	126.6	63%	0.63	74%	0.743	S	S	*	*			trans	79.5	101.3	157.2	-167.2	0	0	0	0	117.1
699	D	27.5	Very low	29.5	Very low	157 Å²	157	125.2 Å²	125.2	84%	0.84	74%	0.739	S	S	*	*				34.3	153	119.5	-39.8	-30.1	0	0	0	122.2
700	G	27.3	Very low	29.2	Very low	75 Å²	75	125.8 Å²	125.8	77%	0.773	74%	0.736	S	S	*	*			trans	130.8	47.4	135	0	0	0	0	0	119.3
701	V	32	Very low	29.2	Very low	147 Å²	147	124.4 Å²	124.4	89%	0.891	73%	0.731	S	S	*	*			trans	-135.2	136.4	166.3	-169.1	0	0	0	0	108.9
702	G	29.9	Very low	29	Very low	67 Å²	67	126.4 Å²	126.4	69%	0.691	73%	0.734	S	S	*	*			cis	134.1	138.4	4.7	0	0	0	0	0	110.2
703	T	25.9	Very low	28.7	Very low	131 Å²	131	125.8 Å²	125.8	80%	0.804	73%	0.734	S	S	*	*			trans	-72.6	178.4	175.3	-39.9	0	0	0	0	110.7
704	I	28.5	Very low	28.6	Very low	155 Å²	155	123.9 Å²	123.9	80%	0.795	73%	0.729	S	S	*	*			trans	87.5	132.7	173	-55.7	161.4	0	0	0	111.8
705	V	25.4	Very low	28.5	Very low	112 Å²	112	122.7 Å²	122.7	68%	0.679	74%	0.736	S	S	*	*			cis	147.9	138.9	-8.1	137.2	0	0	0	0	104.7
706	L	24.2	Very low	28.5	Very low	158 Å²	158	121.3 Å²	121.3	83%	0.827	74%	0.741	S	S	*	*			trans	50.8	104.5	168.7	-67.4	165.6	0	0	0	117.3
707	A	24.5	Very low	28.5	Very low	78 Å²	78	126 Å²	126	65%	0.645	75%	0.753	S	S	*	*				89	167.1	80.1	0	0	0	0	0	113.4
708	V	26.2	Very low	28.7	Very low	132 Å²	132	122.6 Å²	122.6	80%	0.8	75%	0.754	S	S	*	*			trans	70.7	137.1	169.8	174.3	0	0	0	0	114.9
709	E	26.9	Very low	28.8	Very low	125 Å²	125	126 Å²	126	58%	0.584	76%	0.763	S	S	*	*			cis	-165.3	158.8	-16.6	-111.7	-167.2	132.7	0	0	111.2
710	R	27.4	Very low	29	Very low	200 Å²	200	126.9 Å²	126.9	76%	0.755	76%	0.762	S	S	*	*			trans	63.7	171.4	149.6	-65.5	170.5	-159.7	176.2	17.1	119.8
711	G	34	Very low	29.2	Very low	67 Å²	67	131.7 Å²	131.7	69%	0.691	76%	0.762	S	S	*	*			trans	95.5	74.6	-172.3	0	0	0	0	0	111.6
712	D	29	Very low	29.1	Very low	143 Å²	143	131.8 Å²	131.8	77%	0.765	76%	0.756	S	S	*	*				52.9	132	53.4	-66.5	-50.7	0	0	0	113.9
713	S	28.7	Very low	29.1	Very low	89 Å²	89	131.7 Å²	131.7	62%	0.622	75%	0.749	S	S	*	*			cis	-169.4	173.3	-12.2	57.8	0	0	0	0	109.9
714	T	32.8	Very low	29.4	Very low	125 Å²	125	133.4 Å²	133.4	77%	0.767	75%	0.748	S	S	*	*			trans	66.1	139.8	171.8	71.6	0	0	0	0	116.9
715	S	30.6	Very low	29.6	Very low	111 Å²	111	132 Å²	132	78%	0.776	74%	0.74	S	S	*	*			cis	84.9	101.7	15.2	88.5	0	0	0	0	117.4
716	S	29.5	Very low	29.9	Very low	110 Å²	110	133.7 Å²	133.7	77%	0.769	75%	0.746	S	S	*	*			trans	-161	128	159.7	-166.9	0	0	0	0	114
717	F	29.3	Very low	30.2	Very low	209 Å²	209	129.8 Å²	129.8	92%	0.917	74%	0.736	S	S	*	*			trans	20.4	145	148.9	-66.4	-94	0	0	0	123.6
718	G	33.9	Very low	30.4	Very low	79 Å²	79	131.4 Å²	131.4	81%	0.814	74%	0.742	S	S	*	*			trans	174.5	70.2	168.4	0	0	0	0	0	113.9
719	E	30.9	Very low	30.7	Very low	175 Å²	175	131.6 Å²	131.6	82%	0.818	74%	0.738	S	S	*	*			trans	-81.7	172.8	175.1	-73.4	-163.4	120.5	0	0	113.5
720	Q	32.3	Very low	30.9	Very low	176 Å²	176	130.7 Å²	130.7	82%	0.822	75%	0.746	S	S	*	*			trans	92	151.9	160.5	-56.1	-174.9	42.1	0	0	117.2
721	K	30.4	Very low	31.2	Very low	176 Å²	176	126.8 Å²	126.8	77%	0.765	75%	0.746	S	S	*	*			cis	-176.3	175	-28.7	-161.6	176.5	176.6	177.2	0	106.1
722	L	31.1	Very low	31.4	Very low	149 Å²	149	128.3 Å²	128.3	78%	0.78	74%	0.744	S	S	*	*			trans	68	161.5	173.9	-86.4	54.2	0	0	0	115.7
723	A	29.2	Very low	31.5	Very low	65 Å²	65	126.9 Å²	126.9	54%	0.537	74%	0.74	S	S	.	*			cis	-178.4	167.1	-41.8	0	0	0	0	0	109
724	H	32.5	Very low	31.8	Very low	168 Å²	168	129.7 Å²	129.7	78%	0.778	75%	0.747	S	S	*	*			trans	68.8	155.2	162.3	-59.5	-64.8	0	0	0	115.9
725	I	32.1	Very low	31.9	Very low	124 Å²	124	129.6 Å²	129.6	64%	0.636	74%	0.741	S	S	*	*			cis	-158.7	145.2	-15.2	-119.3	168.2	0	0	0	109.4
726	N	31.5	Very low	31.8	Very low	149 Å²	149	133 Å²	133	80%	0.797	74%	0.742	S	S	*	*			trans	54.6	160.4	155.6	-66.9	1.5	0	0	0	120.6
727	A	31.3	Very low	32	Very low	76 Å²	76	137.5 Å²	137.5	63%	0.628	75%	0.748	S	S	*	*			cis	-166.4	168.2	-25.3	0	0	0	0	0	109.3
728	C	28	Very low	31.9	Very low	112 Å²	112	132.7 Å²	132.7	76%	0.757	74%	0.74	S	S	*	*			trans	67.9	143.5	162.6	-66.6	0	0	0	0	117.4
729	N	33.9	Very low	31.8	Very low	136 Å²	136	137.1 Å²	137.1	73%	0.727	74%	0.744	S	S	*	*			cis	-151.4	135.9	-3.3	-109	-13.2	0	0	0	113.1
730	S	31.3	Very low	31.6	Very low	105 Å²	105	133.2 Å²	133.2	73%	0.734	74%	0.737	S	S	*	*			trans	71.5	148.6	140.8	-60.1	0	0	0	0	122.4
731	P	33.4	Very low	31.4	Very low	118 Å²	118	129.2 Å²	129.2	77%	0.766	73%	0.728	S	S	*	*			trans	-139.5	-135.8	-144.8	35.1	-6.1	0	0	0	113.3
732	P	38	Very low	31.4	Very low	100 Å²	100	127.2 Å²	127.2	65%	0.649	73%	0.726	S	S	*	*				-147.5	-168.5	-92	49.1	-32.1	0	0	0	117
733	V	31.3	Very low	31.2	Very low	112 Å²	112	126.7 Å²	126.7	68%	0.679	72%	0.722	S	S	*	*			trans	63.5	136.3	147.1	-177.7	0	0	0	0	116.5	L735	V733-L735 HydrophobicContact CG1-CG 4.4Å
734	L	35.3	Very low	31.4	Very low	149 Å²	149	130.8 Å²	130.8	78%	0.78	74%	0.735	S	S	*	*				-166	116.4	83.9	-75	155.5	0	0	0	109.3
735	L	33.4	Very low	31.3	Very low	122 Å²	122	130.4 Å²	130.4	64%	0.639	74%	0.738	S	S	*	*				84.4	108.2	100	-71.1	-175.8	0	0	0	118.2	V733	V733-L735 HydrophobicContact CG1-CG 4.4Å
736	K	30.1	Very low	31.3	Very low	183 Å²	183	130.4 Å²	130.4	80%	0.796	75%	0.746	S	S	*	*				39.1	125.5	124.4	-55.5	-179.5	-170.1	176.6	0	119.2
737	K	33.1	Very low	31.2	Very low	205 Å²	205	131.5 Å²	131.5	89%	0.891	75%	0.746	S	S	*	*				-158.8	169	91.5	-106.2	173.3	-177.3	-179.9	0	112.1
738	S	27.4	Very low	31.4	Very low	107 Å²	107	134.8 Å²	134.8	75%	0.748	75%	0.752	S	S	*	*			trans	-132.6	178.4	-171.8	-48.6	0	0	0	0	109.5
739	L	30.9	Very low	31.5	Very low	172 Å²	172	135.9 Å²	135.9	90%	0.901	75%	0.749	S	S	*	*			trans	78	140	-179.2	-49.8	165.8	0	0	0	112.6
740	S	27	Very low	31.4	Very low	94 Å²	94	136.4 Å²	136.4	66%	0.657	75%	0.752	S	S	*	*			cis	129.7	149.2	0.5	176.9	0	0	0	0	108.5
741	S	27.8	Very low	31.3	Very low	92 Å²	92	140.3 Å²	140.3	64%	0.643	76%	0.755	S	S	*	*			trans	83.9	133	159.9	-37.4	0	0	0	0	118.2
742	D	30.1	Very low	31.4	Very low	134 Å²	134	140 Å²	140	72%	0.717	75%	0.753	S	S	*	*			trans	77.7	102.1	140.8	-50.7	-21.5	0	0	0	122.1
743	I	27.7	Very low	30.9	Very low	137 Å²	137	139.9 Å²	139.9	70%	0.703	76%	0.755	S	S	*	*				47.3	111.4	115.4	-55.4	156.9	0	0	0	116.6
744	N	32.4	Very low	30.8	Very low	152 Å²	152	139.5 Å²	139.5	81%	0.813	76%	0.757	S	S	*	*				-173.2	142.6	115.1	-98.3	-62.3	0	0	0	111.6
745	L	30.2	Very low	30.6	Very low	159 Å²	159	140.3 Å²	140.3	83%	0.832	76%	0.761	S	S	*	*			trans	-93.9	155.8	156.7	-129.2	74.7	0	0	0	107.3
746	P	34	Very low	30.5	Very low	124 Å²	124	141.1 Å²	141.1	81%	0.805	76%	0.764	S	S	*	*				-150	-176.4	97.7	39.3	-21.3	0	0	0	116.4
747	E	28.1	Very low	30.8	Very low	172 Å²	172	138.2 Å²	138.2	80%	0.804	76%	0.764	S	S	*	*			trans	-74.3	-163	-176.4	-165.7	168	-157.5	0	0	114.7
748	I	34.9	Very low	30.8	Very low	145 Å²	145	134.9 Å²	134.9	74%	0.744	76%	0.756	S	S	*	*			trans	91.1	96.8	175.9	-52.3	168.1	0	0	0	113.1
749	I	30.8	Very low	31.2	Very low	136 Å²	136	136.9 Å²	136.9	70%	0.697	76%	0.758	S	S	*	*				69.2	113.5	76.7	-58.7	162.5	0	0	0	110.8
750	D	31.9	Very low	31.5	Very low	147 Å²	147	134.4 Å²	134.4	79%	0.786	75%	0.75	S	S	*	*				-169.7	-167.7	66.7	-143.3	-35.7	0	0	0	114.2
751	K	30	Very low	31.8	Very low	187 Å²	187	136.3 Å²	136.3	81%	0.813	76%	0.758	S	S	*	*			trans	-101	-170.2	178	-54.8	170.5	177.4	164.1	0	111.8
752	P	34.8	Very low	32.3	Very low	110 Å²	110	136.4 Å²	136.4	71%	0.714	76%	0.764	S	S	*	*			cis	-136.2	-177.5	-8.6	36.6	-15.2	0	0	0	116.8
753	S	28.4	Very low	32.5	Very low	98 Å²	98	135.8 Å²	135.8	69%	0.685	77%	0.766	S	S	*	*			trans	63.1	115.9	145.9	56	0	0	0	0	123.1
754	S	27.5	Very low	32.8	Very low	104 Å²	104	135.6 Å²	135.6	73%	0.727	77%	0.771	S	S	*	*			trans	47	124.5	138.1	63.4	0	0	0	0	122.1
755	I	31.1	Very low	32.9	Very low	167 Å²	167	132.9 Å²	132.9	86%	0.856	76%	0.764	S	S	*	*				-171.5	159	117.2	-97.6	156.1	0	0	0	110.7
756	I	32.5	Very low	33.1	Very low	138 Å²	138	130.7 Å²	130.7	71%	0.708	76%	0.757	S	S	*	*			trans	-84.7	147.5	-178	-59.3	160	0	0	0	111.3
757	P	35.6	Very low	33	Very low	123 Å²	123	131.7 Å²	131.7	80%	0.799	76%	0.756	S	S	*	*			trans	-117.2	152.8	146.5	33.4	-23	0	0	0	113.2
758	N	33.9	Very low	33.1	Very low	135 Å²	135	127.9 Å²	127.9	72%	0.722	75%	0.748	S	S	*	*			trans	-102.7	-176.8	-168.6	-67.3	-30.3	0	0	0	114
759	N	35.7	Very low	33.1	Very low	149 Å²	149	127 Å²	127	80%	0.797	75%	0.745	S	S	*	*			trans	110.4	145.8	155	-54.3	-23.4	0	0	0	114.7
760	T	36.6	Very low	33.2	Very low	120 Å²	120	126.5 Å²	126.5	74%	0.736	74%	0.744	S	S	*	*			cis	-151.1	149.3	16.5	-26.7	0	0	0	0	114
761	T	34.5	Very low	33.3	Very low	133 Å²	133	125.8 Å²	125.8	82%	0.816	74%	0.74	S	S	*	*			trans	51.1	122.8	151.2	37.7	0	0	0	0	123.1
762	A	36.8	Very low	33.4	Very low	94 Å²	94	123 Å²	123	78%	0.777	73%	0.734	S	S	*	*				-163.9	102.1	121	0	0	0	0	0	113.5
763	T	35	Very low	33.3	Very low	121 Å²	121	124.5 Å²	124.5	74%	0.742	74%	0.736	S	S	*	*			trans	22.3	124.1	146.5	51.7	0	0	0	0	123.7
764	T	33.9	Very low	33.4	Very low	133 Å²	133	123.2 Å²	123.2	82%	0.816	74%	0.739	S	S	*	*			trans	63.5	145.6	138.2	49.1	0	0	0	0	121.3
765	S	34.2	Very low	33.8	Very low	95 Å²	95	128 Å²	128	66%	0.664	75%	0.747	S	S	*	*			cis	-159.9	150.2	0.1	43.4	0	0	0	0	114.1
766	T	34.1	Very low	33.8	Very low	113 Å²	113	126.5 Å²	126.5	69%	0.693	74%	0.74	S	S	*	*			trans	55.3	108.5	147.1	54.8	0	0	0	0	122.1
767	N	32	Very low	33.7	Very low	146 Å²	146	124.8 Å²	124.8	78%	0.781	74%	0.741	S	S	*	*				79.5	140.7	120.8	-59.9	6.6	0	0	0	122.7
768	S	31.6	Very low	33.6	Very low	92 Å²	92	124 Å²	124	64%	0.643	74%	0.738	S	S	*	*			trans	77.8	104.1	142.7	-76.3	0	0	0	0	121.6
769	D	34.8	Very low	33.7	Very low	127 Å²	127	125.2 Å²	125.2	68%	0.679	74%	0.737	S	S	*	*				82	114.2	110.1	-57.7	-29.4	0	0	0	121.8
770	N	33.4	Very low	33.6	Very low	125 Å²	125	125 Å²	125	67%	0.668	73%	0.731	S	S	*	*				75.2	108	127.4	-61.7	-26.5	0	0	0	121.5
771	N	33.1	Very low	33.7	Very low	132 Å²	132	127 Å²	127	71%	0.706	73%	0.731	S	S	*	*				79.6	120	122.8	-58.5	-12.8	0	0	0	121.7
772	N	31.6	Very low	33.8	Very low	127 Å²	127	126.7 Å²	126.7	68%	0.679	73%	0.725	S	S	*	*				80.5	126.8	129.3	-72.9	49.3	0	0	0	122.7
773	D	33.4	Very low	33.7	Very low	142 Å²	142	128.4 Å²	128.4	76%	0.759	73%	0.726	S	S	*	*				65.2	82.7	129.4	-53.2	-23.4	0	0	0	120.9
774	G	30.9	Very low	33.4	Very low	72 Å²	72	129.6 Å²	129.6	74%	0.742	73%	0.725	S	S	*	*				86.1	140.2	120.6	0	0	0	0	0	119.3
775	F	34.8	Very low	33.4	Very low	205 Å²	205	133.9 Å²	133.9	90%	0.899	73%	0.726	S	S	*	*				-157	178.3	115.2	-127.8	-99.7	0	0	0	111.3
776	N	31.4	Very low	33.2	Very low	135 Å²	135	138.3 Å²	138.3	72%	0.722	73%	0.733	S	S	*	*			trans	-97.2	169.7	-163.7	-75.4	-65.3	0	0	0	115.6
777	S	31	Very low	32.9	Very low	102 Å²	102	142.1 Å²	142.1	71%	0.713	74%	0.74	S	S	*	*			trans	95.1	102.5	139	69	0	0	0	0	122.1
778	S	32.4	Very low	32.7	Very low	105 Å²	105	147.1 Å²	147.1	73%	0.734	75%	0.748	S	S	*	*				78.4	150.6	122.3	71.4	0	0	0	0	122.2
779	K	36	Very low	32.6	Very low	162 Å²	162	149.7 Å²	149.7	70%	0.704	76%	0.755	S	S	*	*			trans	80.6	110.6	170.2	-58.2	-163.7	156.6	-106.7	0	115.3
780	E	34.2	Very low	32.2	Very low	144 Å²	144	152.5 Å²	152.5	67%	0.673	76%	0.761	S	S	*	*				75.1	123	85.1	-69	158.9	170.6	0	0	110
781	H	38.5	Very low	31.8	Very low	161 Å²	161	152 Å²	152	75%	0.745	77%	0.767	S	S	*	*			cis	-144	156.7	28	-107.6	-85.6	0	0	0	114.2
782	D	36.7	Very low	31.4	Very low	127 Å²	127	154.5 Å²	154.5	68%	0.679	78%	0.775	S	S	*	*			trans	31.7	153.7	138	-80.6	-57.1	0	0	0	124.8
783	V	34.8	Very low	31.1	Very low	131 Å²	131	154 Å²	154	79%	0.794	78%	0.777	S	S	*	*			cis	-125.5	149.6	5.8	-176.1	0	0	0	0	112
784	M	29.4	Very low	30.7	Very low	146 Å²	146	154.7 Å²	154.7	72%	0.719	78%	0.779	S	S	*	*			trans	-38.4	156.4	165.4	-65.9	-85.9	-111.2	0	0	116
785	R	32.3	Very low	30.5	Very low	222 Å²	222	156.4 Å²	156.4	84%	0.838	77%	0.77	S	S	*	*			cis	-152.9	133.7	26	-161.2	175.3	-70.6	164.9	-0.8	111.8
786	K	30.9	Very low	30	Very low	189 Å²	189	153.3 Å²	153.3	82%	0.822	76%	0.762	S	S	*	*			trans	-107.5	150.9	-179.1	-84.7	-174.5	177.8	174.9	0	114.1
787	F	27.7	Very low	29.7	Very low	192 Å²	192	152.1 Å²	152.1	84%	0.842	76%	0.764	S	S	*	*			trans	15.9	131.3	148.4	-67.8	-102	0	0	0	120
788	R	28.5	Very low	29.4	Very low	251 Å²	251	156.9 Å²	156.9	95%	0.947	77%	0.767	S	S	*	*			trans	-151.8	125.9	133.9	-125.4	175.9	-168.8	-175.1	3.7	114.8
789	N	28.9	Very low	29.1	Very low	147 Å²	147	160 Å²	160	79%	0.786	77%	0.774	S	S	*	*			trans	-74.7	170.5	162.5	-93.6	-39.2	0	0	0	111.3
790	K	26.7	Very low	28.6	Very low	186 Å²	186	157.4 Å²	157.4	81%	0.809	77%	0.774	S	S	*	*			trans	95.7	99.8	169.2	-58.3	-179.3	177.5	-177.9	0	116.7	Q792	K790-Q792 PolarHBondContact O-N 3.45Å
791	S	24.6	Very low	28.1	Very low	114 Å²	114	156.1 Å²	156.1	80%	0.797	78%	0.781	S	S	*	*				23.2	96.6	123.8	60.2	0	0	0	0	117.2
792	Q	25.1	Very low	27.4	Very low	184 Å²	184	154.6 Å²	154.6	86%	0.86	78%	0.783	S	S	*	*			trans	-126.2	108.3	153.1	-78.7	-168.2	-20.9	0	0	110	K790 L794	K790-Q792 PolarHBondContact O-N 3.45Å; Q792-L794 PolarHBondContact O-N 2.88Å
793	T	24.2	Very low	26.8	Very low	118 Å²	118	153.9 Å²	153.9	72%	0.724	79%	0.788	S	S	*	*			trans	-64.1	116.2	158.4	-3.6	0	0	0	0	107.9	I795	T793-I795 HydrophobicContact CG2-CD1 3.98Å; T793-I795 HydrophobicContact CG2-CG1 3.98Å; T793-I795 PolarHBondContact O-N 3.07Å
794	L	26.3	Very low	26.4	Very low	155 Å²	155	153.2 Å²	153.2	81%	0.812	79%	0.789	S	S	*	*			trans	-74.5	75.5	162.1	-86.7	173.1	0	0	0	109.4	Q792 L796	Q792-L794 PolarHBondContact O-N 2.88Å; L794-L796 HydrophobicContact CD2-CD1 3.81Å
795	I	25.7	Very low	26.1	Very low	109 Å²	109	154.6 Å²	154.6	56%	0.559	79%	0.791	S	S	*	*			trans	-94.8	88.8	159.5	-61.7	173	0	0	0	106.5	T793 R798	T793-I795 HydrophobicContact CG2-CD1 3.98Å; T793-I795 HydrophobicContact CG2-CG1 3.98Å; T793-I795 PolarHBondContact O-N 3.07Å; I795-R798 HydrophobicContact CG2-CG 4.43Å
796	L	24.5	Very low	26	Very low	140 Å²	140	152 Å²	152	73%	0.733	79%	0.792	S	S	*	*			trans	-120.8	128.8	158	-83.8	87.6	0	0	0	107.3	L794	L794-L796 HydrophobicContact CD2-CD1 3.81Å
797	S	25.5	Very low	25.7	Very low	109 Å²	109	150.8 Å²	150.8	76%	0.762	78%	0.784	S	S	*	*			cis	-131.1	140.1	-0.5	-67.4	0	0	0	0	110.9
798	R	25.4	Very low	26	Very low	202 Å²	202	149.7 Å²	149.7	76%	0.762	79%	0.786	S	S	*	*			trans	-86	166.1	164.9	-81.8	-176.4	168.5	-175.7	-3.4	110.1	I795	I795-R798 HydrophobicContact CG2-CG 4.43Å
799	L	25	Very low	26	Very low	171 Å²	171	142.9 Å²	142.9	90%	0.895	76%	0.764	S	S	*	*			trans	79.4	151.1	171.8	-55.9	129.3	0	0	0	115.8
800	P	24.7	Very low	26	Very low	108 Å²	108	139.9 Å²	139.9	70%	0.701	76%	0.755	S	S	*	*			cis	-106	162	-10.4	38.5	-30.2	0	0	0	113
801	S	24.9	Very low	26.2	Very low	116 Å²	116	141.1 Å²	141.1	81%	0.811	76%	0.755	S	S	*	*			trans	-83.3	113.5	164.2	51.2	0	0	0	0	110.7
802	T	24	Very low	26.3	Very low	129 Å²	129	143.2 Å²	143.2	79%	0.791	75%	0.751	S	S	*	*			trans	-153.4	138.6	162.4	6.7	0	0	0	0	113.9
803	S	23.7	Very low	26.4	Very low	112 Å²	112	139.1 Å²	139.1	78%	0.783	75%	0.749	S	S	*	*			trans	-47.5	133.4	170.1	146.4	0	0	0	0	114.7
804	S	26.2	Very low	26.5	Very low	117 Å²	117	138.8 Å²	138.8	82%	0.818	75%	0.751	S	S	*	*			trans	-161.9	154	135.2	36.7	0	0	0	0	111.9
805	K	24	Very low	26.6	Very low	176 Å²	176	139.1 Å²	139.1	77%	0.765	75%	0.753	S	S	*	*			trans	-108.7	124	-173.6	-55.7	165.6	-176.6	170.2	0	110.8	Y807	K805-Y807 HydrophobicContact CB-CD2 4.3Å
806	I	29.9	Very low	26.7	Very low	168 Å²	168	139.8 Å²	139.8	86%	0.862	76%	0.764	S	S	*	*			trans	-146.9	102.6	156.8	-49.8	179.1	0	0	0	105.7
807	Y	24.3	Very low	26.8	Very low	163 Å²	163	140 Å²	140	64%	0.639	77%	0.767	S	S	*	*			cis	88.5	60.8	20.4	-119.1	-95.4	0	0	0	116.5	K805 H809	K805-Y807 HydrophobicContact CB-CD2 4.3Å; Y807-H809 AromaticContact CD1-CE1 3.94Å; Y807-H809 AromaticContact CD1-ND1 3.75Å; Y807-H809 AromaticContact CE1-CE1 3.2Å; Y807-H809 WeakPolarHBondContact CE1-CE1 3.4Å; Y807-H809 AromaticContact CE1-ND1 3.5Å; Y807-H809 AromaticContact CE1-NE2 3.72Å; Y807-H809 AromaticContact CZ-CE1 3.47Å; Y807-H809 VanDerWaalsContact CZ-CE1 3.47Å
808	L	34.1	Very low	27.1	Very low	168 Å²	168	139.4 Å²	139.4	88%	0.88	76%	0.76	S	S	*	*			trans	-133.6	106.2	148.4	-71.8	175	0	0	0	105.2
809	H	27.7	Very low	27.1	Very low	108 Å²	108	136.8 Å²	136.8	50%	0.5	76%	0.761	S	S	.	*			cis	53.3	121.8	47.2	-84	54.7	0	0	0	111.3	Y807	Y807-H809 AromaticContact CD1-CE1 3.94Å; Y807-H809 AromaticContact CD1-ND1 3.75Å; Y807-H809 AromaticContact CE1-CE1 3.2Å; Y807-H809 WeakPolarHBondContact CE1-CE1 3.4Å; Y807-H809 AromaticContact CE1-ND1 3.5Å; Y807-H809 AromaticContact CE1-NE2 3.72Å; Y807-H809 AromaticContact CZ-CE1 3.47Å; Y807-H809 VanDerWaalsContact CZ-CE1 3.47Å
810	S	28.6	Very low	27.2	Very low	84 Å²	84	134.7 Å²	134.7	59%	0.587	76%	0.755	S	S	*	*			cis	-153.6	168.1	24.6	-84.1	0	0	0	0	109.9
811	R	31.3	Very low	27.3	Very low	213 Å²	213	134.9 Å²	134.9	80%	0.804	76%	0.758	S	S	*	*			cis	-155.1	130	-5.3	-103.7	152.2	-157.1	-157.5	0.5	105.9
812	H	27.6	Very low	27.3	Very low	158 Å²	158	134.2 Å²	134.2	73%	0.731	75%	0.753	S	S	*	*				67.6	126.7	86.8	-77.1	-77.4	0	0	0	117
813	A	26.5	Very low	27.5	Very low	97 Å²	97	135.8 Å²	135.8	80%	0.802	76%	0.757	S	S	*	*			trans	68.1	145	153.1	0	0	0	0	0	118.2
814	S	26.8	Very low	27.6	Very low	111 Å²	111	136.5 Å²	136.5	78%	0.776	76%	0.757	S	S	*	*			cis	-161.4	164.1	-12	39.6	0	0	0	0	110.9
815	L	28.8	Very low	27.6	Very low	163 Å²	163	136.9 Å²	136.9	85%	0.853	75%	0.754	S	S	*	*			trans	-56.4	160	168.1	-69.7	154.1	0	0	0	111.8
816	P	27.8	Very low	27.9	Very low	122 Å²	122	136.2 Å²	136.2	79%	0.792	76%	0.757	S	S	*	*				-123.2	158.4	112.9	35.4	-33.3	0	0	0	114.5
817	N	26	Very low	27.8	Very low	146 Å²	146	135.6 Å²	135.6	78%	0.781	75%	0.754	S	S	*	*			trans	-77.4	163.5	175.9	-141.2	28	0	0	0	110.6
818	P	31.6	Very low	28.1	Very low	95 Å²	95	131 Å²	131	62%	0.617	76%	0.755	S	S	*	*	S	Bend	trans	-74.5	168.5	168.2	32.2	-33.4	0	0	0	112
819	N	25.6	Very low	27.9	Very low	148 Å²	148	130.5 Å²	130.5	79%	0.791	75%	0.754	S	S	*	*			trans	72.7	135.6	-170.3	-41.5	-34.4	0	0	0	111.3
820	T	28	Very low	28.1	Very low	127 Å²	127	128.8 Å²	128.8	78%	0.779	77%	0.765	S	S	*	*			cis	-162.8	166.9	37.2	-33.6	0	0	0	0	110.9
821	C	25.5	Very low	28.2	Very low	112 Å²	112	132.5 Å²	132.5	76%	0.757	78%	0.777	S	S	*	*			trans	63.5	105.8	159.7	-67.6	0	0	0	0	121.2
822	S	24.7	Very low	28.1	Very low	102 Å²	102	128 Å²	128	71%	0.713	78%	0.778	S	S	*	*				33.3	121.4	118	-43.9	0	0	0	0	121.3
823	N	28.8	Very low	28.1	Very low	162 Å²	162	126 Å²	126	87%	0.866	78%	0.782	S	S	*	*				-172.8	176.8	105.9	-91.7	-16.1	0	0	0	112.6
824	T	25.1	Very low	28.2	Very low	126 Å²	126	132.4 Å²	132.4	77%	0.773	79%	0.785	S	S	*	*			trans	-120.5	-177.5	-158.3	-40.6	0	0	0	0	112.7
825	V	26.3	Very low	28.3	Very low	125 Å²	125	134 Å²	134	76%	0.758	78%	0.781	S	S	*	*			trans	71.1	153.9	167.5	-121.3	0	0	0	0	113.6
826	I	31.4	Very low	28.4	Very low	162 Å²	162	134 Å²	134	83%	0.831	78%	0.776	S	S	*	*			cis	-137.2	166.4	16.1	-51	169.1	0	0	0	112.1
827	I	26.8	Very low	28.5	Very low	156 Å²	156	132.7 Å²	132.7	80%	0.8	77%	0.77	S	S	*	*			trans	-97.4	158.2	-174.6	-64.7	157.9	0	0	0	112.8
828	G	30.2	Very low	28.5	Very low	65 Å²	65	136.9 Å²	136.9	67%	0.67	78%	0.776	S	S	*	*			trans	150.8	152.2	149.5	0	0	0	0	0	113.2
829	D	30.4	Very low	28.3	Very low	158 Å²	158	136.6 Å²	136.6	85%	0.845	78%	0.782	S	S	*	*			cis	179	145.1	-27.1	-124.1	-37.1	0	0	0	104.6
830	G	32.4	Very low	28.4	Very low	72 Å²	72	137 Å²	137	74%	0.742	78%	0.784	S	S	*	*			trans	-165.7	20.7	-163	0	0	0	0	0	120.3
831	I	30.2	Very low	28.4	Very low	162 Å²	162	138.2 Å²	138.2	83%	0.831	79%	0.792	S	S	*	*			trans	21	113.2	156.7	-31.1	175.5	0	0	0	119.3
832	S	29.7	Very low	28.5	Very low	120 Å²	120	136.1 Å²	136.1	84%	0.839	79%	0.789	S	S	*	*				-168.9	130.2	127.5	-168.6	0	0	0	0	111
833	S	27.6	Very low	28.7	Very low	116 Å²	116	137.9 Å²	137.9	81%	0.811	80%	0.795	S	S	*	*			trans	-116.3	142	-174.8	-57.5	0	0	0	0	112.4
834	R	27.9	Very low	28.5	Very low	230 Å²	230	137.2 Å²	137.2	87%	0.868	79%	0.791	S	S	*	*			trans	-155.2	142.3	139.2	-159.1	162.8	-173.7	163.5	2.5	111.2
835	E	29.8	Very low	28.7	Very low	146 Å²	146	139.3 Å²	139.3	68%	0.682	79%	0.792	S	S	*	*			trans	-76.9	153.1	-178.1	-51.9	112.8	126.7	0	0	112.9
836	H	31.4	Very low	28.7	Very low	162 Å²	162	137.7 Å²	137.7	75%	0.75	79%	0.786	S	S	*	*				178.6	129.3	100	-84	-56.7	0	0	0	112.3
837	S	28.9	Very low	28.4	Very low	95 Å²	95	140.3 Å²	140.3	66%	0.664	79%	0.786	S	S	*	*			trans	55.6	131.6	145.2	-52.8	0	0	0	0	121.6
838	Y	26.2	Very low	28.3	Very low	233 Å²	233	141.1 Å²	141.1	91%	0.914	79%	0.786	S	S	*	*			trans	85.8	145.7	168.8	-62.3	-81.3	0	0	0	119.2
839	A	27.9	Very low	28.2	Very low	90 Å²	90	145.5 Å²	145.5	74%	0.744	79%	0.789	S	S	*	*	S	Bend	trans	73.6	124.8	173.1	0	0	0	0	0	119.2
840	N	27.7	Very low	28	Very low	156 Å²	156	145.6 Å²	145.6	83%	0.834	79%	0.79	S	S	*	*			trans	55.9	92.3	157.3	-64.7	-5.1	0	0	0	119.5	G842	N840-G842 PolarHBondContact O-N 3.48Å
841	T	26.9	Very low	27.8	Very low	153 Å²	153	149 Å²	149	94%	0.939	79%	0.79	S	S	*	*			trans	-44.2	119.2	146	45.7	0	0	0	0	111.9
842	G	28.5	Very low	27.6	Very low	67 Å²	67	146.1 Å²	146.1	69%	0.691	78%	0.784	S	S	*	*			trans	-120.1	119.5	176.2	0	0	0	0	0	112.5	N840	N840-G842 PolarHBondContact O-N 3.48Å
843	V	29.2	Very low	27.5	Very low	139 Å²	139	150.8 Å²	150.8	84%	0.842	79%	0.79	S	S	*	*			trans	47.9	102.8	152.4	-166.6	0	0	0	0	117.9
844	N	24.5	Very low	27.3	Very low	148 Å²	148	153.5 Å²	153.5	79%	0.791	78%	0.782	S	S	*	*			trans	-154.3	171	136.9	-111.1	-46.8	0	0	0	110.5
845	H	28.9	Very low	27.5	Very low	171 Å²	171	148.2 Å²	148.2	79%	0.792	78%	0.775	S	S	*	*			trans	74.7	130.7	-168.1	-49.3	-64.5	0	0	0	114.2
846	S	26	Very low	27.4	Very low	90 Å²	90	149.5 Å²	149.5	63%	0.629	79%	0.787	S	S	*	*			cis	84	119.4	18.6	93.8	0	0	0	0	116.4
847	R	25.4	Very low	27.6	Very low	218 Å²	218	150.5 Å²	150.5	82%	0.823	79%	0.789	S	S	*	*			trans	68	127.4	167.2	-61.2	-178.8	172.2	179.6	-3	117.2
848	Q	24.9	Very low	28.2	Very low	173 Å²	173	155.9 Å²	155.9	81%	0.808	80%	0.801	S	S	*	*			trans	64	172.1	161.7	-58.1	155.9	-99.7	0	0	111.5
849	E	28.4	Very low	29.1	Very low	156 Å²	156	149.1 Å²	149.1	73%	0.729	78%	0.779	S	S	*	*			cis	-135.8	173.2	12.7	-66.4	173.2	135.7	0	0	111.5	L851	E849-L851 PolarHBondContact O-N 3.39Å
850	N	25.1	Very low	30.2	Very low	161 Å²	161	148.9 Å²	148.9	86%	0.861	77%	0.77	S	S	*	*			trans	-67.3	115.6	164.8	-71.5	-45.7	0	0	0	109.4
851	L	29.1	Very low	31.1	Very low	143 Å²	143	144.6 Å²	144.6	75%	0.749	75%	0.751	S	S	*	*			trans	-119	92.4	176.1	-81.8	166.1	0	0	0	111.4	E849 F853	E849-L851 PolarHBondContact O-N 3.39Å; L851-F853 PolarHBondContact O-N 3.44Å
852	S	24.7	Very low	32.3	Very low	102 Å²	102	142.8 Å²	142.8	71%	0.713	74%	0.736	S	S	*	*			trans	-65.8	122.2	179.3	-55.1	0	0	0	0	112.1	R854	S852-R854 PolarHBondContact O-N 3.42Å
853	F	27.6	Very low	33.7	Very low	217 Å²	217	146.5 Å²	146.5	95%	0.952	73%	0.731	S	S	*	*			trans	-74.9	56.4	169.3	-86.4	-93.4	0	0	0	112.4	L851	L851-F853 PolarHBondContact O-N 3.44Å
854	R	25	Very low	35.1	Very low	174 Å²	174	141 Å²	141	66%	0.657	70%	0.696	S	S	*	*			trans	-112.7	58	166	-77	-162.9	-174.6	-176	6.3	110.8	S852 D1149 D1151	S852-R854 PolarHBondContact O-N 3.42Å; R854-D1149 IonicContact NH1-OD2 3.64Å; R854-D1151 IonicContact CZ-OD1 3.97Å; R854-D1151 IonicContact NH2-OD1 3.4Å; R854-D1151 PolarHBondContact NH2-OD1 3.34Å; R854-D1151 IonicContact NH2-OD2 2.62Å; R854-D1151 PolarHBondContact NH2-OD2 3.11Å
855	V	30.4	Very low	36.7	Very low	119 Å²	119	136.2 Å²	136.2	72%	0.721	67%	0.674	S	S	*	*			trans	-136	119.1	169.1	-176.3	0	0	0	0	111.2	K857	V855-K857 PolarHBondContact O-N 3.03Å; V855-K857 VanDerWaalsContact O-N 3.08Å
856	N	28.2	Very low	38.5	Very low	173 Å²	173	134.7 Å²	134.7	93%	0.925	67%	0.665	S	S	*	*			trans	-73.2	96.1	-179.9	-80	-49.5	0	0	0	112.6
857	K	36.7	Very low	40.5	Very low	183 Å²	183	132.8 Å²	132.8	80%	0.796	65%	0.647	S	S	*	*			trans	-128.9	114.2	160	-75.3	-175.2	176.7	176.8	0	109.9	V855 I859	V855-K857 PolarHBondContact O-N 3.03Å; V855-K857 VanDerWaalsContact O-N 3.08Å; K857-I859 PolarHBondContact O-N 3.18Å
858	K	39.9	Very low	42.7	Very low	208 Å²	208	123.7 Å²	123.7	90%	0.904	61%	0.614	S	S	*	*			trans	-62.3	116	177.3	-72.9	-176.8	176.2	-179.7	0	110
859	I	45.4	Very low	44.8	Very low	90 Å²	90	123.3 Å²	123.3	46%	0.462	61%	0.605	S	S	.	*			trans	-71.4	131.7	169.8	-58.1	177	0	0	0	108.2	K857 Y863 L864	K857-I859 PolarHBondContact O-N 3.18Å; I859-Y863 HydrophobicContact CG2-CD1 3.72Å; I859-Y863 HydrophobicContact CG2-CG 4.39Å; I859-L864 HydrophobicContact CB-CD2 4.44Å; I859-L864 HydrophobicContact CB-CG 4.35Å; I859-L864 HydrophobicContact CD1-CD2 4.42Å; I859-L864 HydrophobicContact CG2-CD2 3.96Å; I859-L864 HydrophobicContact CG2-CG 3.86Å
860	P	51.5	Low	46.6	Very low	85 Å²	85	121.5 Å²	121.5	55%	0.552	60%	0.6	S	S	*	*			trans	-61.6	141.4	178.1	-24.7	34.9	0	0	0	113.1	D862 Y863 L864	P860-D862 VanDerWaalsContact C-N 3.25Å; P860-D862 PolarHBondContact O-N 3.08Å; P860-Y863 WeakPolarHBondContact O-CB 3.25Å; P860-Y863 PolarHBondContact O-N 3.35Å; P860-L864 PolarHBondContact O-N 3.25Å
861	C	46.2	Very low	48.7	Very low	66 Å²	66	114.8 Å²	114.8	45%	0.446	56%	0.564	S	S	.	*	H	α-helix	trans	-50.7	-44.4	-179.3	-50.9	0	0	0	0	112.5	Y863 L864 C865 Y893	C861-Y863 PolarHBondContact O-N 2.87Å; C861-L864 PolarHBondContact O-N 2.97Å; C861-C865 WeakPolarHBondContact O-CB 3.36Å; C861-C865 PolarHBondContact O-N 3.3Å; C861-Y893 PolarHBondContact SG-OH 2.86Å; C861-Y893 VanDerWaalsContact SG-OH 3.36Å
862	D	53.3	Low	50.5	Low	116 Å²	116	111 Å²	111	62%	0.62	55%	0.549	S	S	*	.	H	α-helix	trans	-61.6	-30.5	-178.5	-54.9	-19.9	0	0	0	113	P860 K866	P860-D862 VanDerWaalsContact C-N 3.25Å; P860-D862 PolarHBondContact O-N 3.08Å; D862-K866 VanDerWaalsContact O-CB 3.31Å; D862-K866 WeakPolarHBondContact O-CB 3.36Å; D862-K866 WeakPolarHBondContact O-CD 3.31Å; D862-K866 WeakPolarHBondContact O-CG 3.47Å; D862-K866 PolarHBondContact O-N 3.39Å
863	Y	57	Low	52.1	Low	145 Å²	145	112.6 Å²	112.6	57%	0.569	55%	0.55	S	S	*	*	H	α-helix	trans	-76.5	-45.4	-180	-167.5	-107	0	0	0	110.6	I859 P860 C861 C865 K866 I867	I859-Y863 HydrophobicContact CG2-CD1 3.72Å; I859-Y863 HydrophobicContact CG2-CG 4.39Å; P860-Y863 WeakPolarHBondContact O-CB 3.25Å; P860-Y863 PolarHBondContact O-N 3.35Å; C861-Y863 PolarHBondContact O-N 2.87Å; Y863-C865 VanDerWaalsContact C-N 3.34Å; Y863-C865 PolarHBondContact O-N 2.95Å; Y863-K866 PolarHBondContact O-N 3.33Å; Y863-I867 HydrophobicContact CD1-CD1 3.7Å; Y863-I867 HydrophobicContact CE1-CD1 3.41Å; Y863-I867 VanDerWaalsContact CE1-CD1 3.41Å; Y863-I867 HydrophobicContact CE1-CG1 4.46Å; Y863-I867 HydrophobicContact CG-CD1 4.46Å; Y863-I867 WeakPolarHBondContact O-CG1 3.45Å; Y863-I867 PolarHBondContact O-N 3.22Å
864	L	59.6	Low	53.5	Low	24 Å²	24	104.6 Å²	104.6	13%	0.126	52%	0.521	C	S	.	.	H	α-helix	trans	-60.7	-43.1	171.9	-65.2	175.9	0	0	0	111.3	I859 P860 C861 I867 H868 I886 Y893	I859-L864 HydrophobicContact CB-CD2 4.44Å; I859-L864 HydrophobicContact CB-CG 4.35Å; I859-L864 HydrophobicContact CD1-CD2 4.42Å; I859-L864 HydrophobicContact CG2-CD2 3.96Å; I859-L864 HydrophobicContact CG2-CG 3.86Å; P860-L864 PolarHBondContact O-N 3.25Å; C861-L864 PolarHBondContact O-N 2.97Å; L864-I867 PolarHBondContact O-N 2.93Å; L864-H868 WeakPolarHBondContact O-CB 3.39Å; L864-H868 PolarHBondContact O-N 3.16Å; L864-I886 HydrophobicContact CD2-CG2 4.42Å; L864-Y893 HydrophobicContact CD1-CD2 4.3Å; L864-Y893 HydrophobicContact CD1-CE2 4.16Å
865	C	58.1	Low	55	Low	46 Å²	46	102.6 Å²	102.6	31%	0.311	53%	0.534	S	S	.	.	H	α-helix	trans	-65.4	-39.4	178.3	-169.3	0	0	0	0	112.4	C861 Y863 R869	C861-C865 WeakPolarHBondContact O-CB 3.36Å; C861-C865 PolarHBondContact O-N 3.3Å; Y863-C865 VanDerWaalsContact C-N 3.34Å; Y863-C865 PolarHBondContact O-N 2.95Å; C865-R869 VanDerWaalsContact O-CB 3.27Å; C865-R869 WeakPolarHBondContact O-CB 3.45Å; C865-R869 PolarHBondContact O-N 3.19Å
866	K	66.3	Low	56.3	Low	139 Å²	139	100.7 Å²	100.7	60%	0.604	52%	0.52	S	S	*	.	H	α-helix	trans	-64.5	-44.4	172.5	-79.1	168.8	-177.3	171.8	0	112.4	D862 Y863 R869 N870	D862-K866 VanDerWaalsContact O-CB 3.31Å; D862-K866 WeakPolarHBondContact O-CB 3.36Å; D862-K866 WeakPolarHBondContact O-CD 3.31Å; D862-K866 WeakPolarHBondContact O-CG 3.47Å; D862-K866 PolarHBondContact O-N 3.39Å; Y863-K866 PolarHBondContact O-N 3.33Å; K866-R869 PolarHBondContact O-N 3.35Å; K866-N870 WeakPolarHBondContact O-CB 3.4Å; K866-N870 PolarHBondContact O-N 3.48Å; K866-N870 PolarHBondContact O-ND2 2.84Å
867	I	67.4	Low	57.7	Low	50 Å²	50	102 Å²	102	26%	0.256	51%	0.511	S	S	.	.	H	α-helix	trans	-63.2	-50.1	176.9	-67.8	168.6	0	0	0	110.1	Y863 L864 R869 N870 L871 I886	Y863-I867 HydrophobicContact CD1-CD1 3.7Å; Y863-I867 HydrophobicContact CE1-CD1 3.41Å; Y863-I867 VanDerWaalsContact CE1-CD1 3.41Å; Y863-I867 HydrophobicContact CE1-CG1 4.46Å; Y863-I867 HydrophobicContact CG-CD1 4.46Å; Y863-I867 WeakPolarHBondContact O-CG1 3.45Å; Y863-I867 PolarHBondContact O-N 3.22Å; L864-I867 PolarHBondContact O-N 2.93Å; I867-R869 VanDerWaalsContact C-N 3.32Å; I867-R869 PolarHBondContact O-N 2.94Å; I867-N870 PolarHBondContact O-N 3.38Å; I867-N870 VanDerWaalsContact O-N 3.11Å; I867-L871 HydrophobicContact CG2-CD1 3.62Å; I867-L871 HydrophobicContact CG2-CG 4.06Å; I867-L871 WeakPolarHBondContact O-CG 3.31Å; I867-L871 PolarHBondContact O-N 3.04Å; I867-I886 HydrophobicContact CG2-CD1 3.47Å; I867-I886 VanDerWaalsContact CG2-CD1 3.47Å
868	H	72.6	Confident	58.9	Low	27 Å²	27	100.4 Å²	100.4	13%	0.125	51%	0.505	C	S	.	.	H	α-helix	trans	-55.5	-46.6	177.6	-170.5	-46.2	0	0	0	111.2	L864 N870 L871 S872 L883	L864-H868 WeakPolarHBondContact O-CB 3.39Å; L864-H868 PolarHBondContact O-N 3.16Å; H868-N870 VanDerWaalsContact C-N 3.34Å; H868-N870 PolarHBondContact O-N 3.05Å; H868-L871 PolarHBondContact O-N 3.2Å; H868-S872 PolarHBondContact CE1-OG 3.4Å; H868-S872 VanDerWaalsContact CE1-OG 3.22Å; H868-S872 PolarHBondContact ND1-OG 2.87Å; H868-S872 VanDerWaalsContact O-CB 3.32Å; H868-S872 WeakPolarHBondContact O-CB 3.17Å; H868-S872 PolarHBondContact O-N 2.89Å; H868-S872 PolarHBondContact O-OG 3.1Å; H868-L883 HydrophobicContact CB-CD2 4.28Å
869	R	67.5	Low	60.1	Low	166 Å²	166	92.1 Å²	92.1	63%	0.626	47%	0.47	S	S	*	.	H	α-helix	trans	-64.6	-35.2	178.4	-168.8	173.2	-173.7	138.4	-1.2	113.3	C865 K866 I867 N873	C865-R869 VanDerWaalsContact O-CB 3.27Å; C865-R869 WeakPolarHBondContact O-CB 3.45Å; C865-R869 PolarHBondContact O-N 3.19Å; K866-R869 PolarHBondContact O-N 3.35Å; I867-R869 VanDerWaalsContact C-N 3.32Å; I867-R869 PolarHBondContact O-N 2.94Å; R869-N873 PolarHBondContact O-ND2 2.98Å
870	N	66.5	Low	61	Low	118 Å²	118	90.3 Å²	90.3	63%	0.631	47%	0.466	S	S	*	.	H	α-helix	trans	-71.7	-40.7	176.2	-72	-10.2	0	0	0	111.9	K866 I867 H868	K866-N870 WeakPolarHBondContact O-CB 3.4Å; K866-N870 PolarHBondContact O-N 3.48Å; K866-N870 PolarHBondContact O-ND2 2.84Å; I867-N870 PolarHBondContact O-N 3.38Å; I867-N870 VanDerWaalsContact O-N 3.11Å; H868-N870 VanDerWaalsContact C-N 3.34Å; H868-N870 PolarHBondContact O-N 3.05Å
871	L	70.7	Confident	61.6	Low	19 Å²	19	90.5 Å²	90.5	10%	0.099	46%	0.462	C	S	.	.	H	α-helix	trans	-74.2	-37.6	179.1	-62.5	176.4	0	0	0	112.3	I867 H868 N873 S874 N879 M882 L883 I886	I867-L871 HydrophobicContact CG2-CD1 3.62Å; I867-L871 HydrophobicContact CG2-CG 4.06Å; I867-L871 WeakPolarHBondContact O-CG 3.31Å; I867-L871 PolarHBondContact O-N 3.04Å; H868-L871 PolarHBondContact O-N 3.2Å; L871-N873 PolarHBondContact O-N 3.3Å; L871-S874 VanDerWaalsContact O-CB 3.28Å; L871-S874 WeakPolarHBondContact O-CB 3.19Å; L871-S874 PolarHBondContact O-N 3.04Å; L871-N879 HydrophobicContact CB-CB 4.42Å; L871-N879 HydrophobicContact CD2-CB 3.7Å; L871-N879 WeakPolarHBondContact CD2-OD1 3.32Å; L871-M882 HydrophobicContact CD1-CB 3.83Å; L871-M882 HydrophobicContact CD2-CE 3.88Å; L871-L883 HydrophobicContact CB-CD1 3.9Å; L871-L883 HydrophobicContact CB-CD2 3.92Å; L871-L883 HydrophobicContact CB-CG 3.61Å; L871-L883 HydrophobicContact CD1-CD2 4.43Å; L871-L883 HydrophobicContact CD1-CG 4.16Å; L871-I886 HydrophobicContact CD1-CD1 3.68Å
872	S	66.5	Low	62.5	Low	63 Å²	63	91 Å²	91	44%	0.441	46%	0.458	S	S	.	.	H	α-helix	trans	-64.8	-18.6	179.1	-64.2	0	0	0	0	114	H868 S874	H868-S872 PolarHBondContact CE1-OG 3.4Å; H868-S872 VanDerWaalsContact CE1-OG 3.22Å; H868-S872 PolarHBondContact ND1-OG 2.87Å; H868-S872 VanDerWaalsContact O-CB 3.32Å; H868-S872 WeakPolarHBondContact O-CB 3.17Å; H868-S872 PolarHBondContact O-N 2.89Å; H868-S872 PolarHBondContact O-OG 3.1Å; S872-S874 VanDerWaalsContact C-N 3.32Å
873	N	58.4	Low	63.2	Low	137 Å²	137	86.7 Å²	86.7	73%	0.733	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	1.8	173.2	-68.9	-18.6	0	0	0	112.9	R869 L871	R869-N873 PolarHBondContact O-ND2 2.98Å; L871-N873 PolarHBondContact O-N 3.3Å
874	S	57.2	Low	63.5	Low	49 Å²	49	83.8 Å²	83.8	34%	0.343	43%	0.43	S	S	.	.			trans	-100.8	134.6	-177.7	-165.2	0	0	0	0	112.4	L871 S872 D876 N879	L871-S874 VanDerWaalsContact O-CB 3.28Å; L871-S874 WeakPolarHBondContact O-CB 3.19Å; L871-S874 PolarHBondContact O-N 3.04Å; S872-S874 VanDerWaalsContact C-N 3.32Å; S874-D876 PolarHBondContact OG-N 3.44Å; S874-N879 WeakPolarHBondContact CB-ND2 3.48Å; S874-N879 PolarHBondContact OG-ND2 2.85Å
875	S	55.2	Low	63.6	Low	132 Å²	132	87.4 Å²	87.4	92%	0.923	45%	0.447	S	S	*	.			trans	-88.2	-0.9	168.6	52.8	0	0	0	0	113.7
876	D	57.2	Low	63.9	Low	79 Å²	79	86.8 Å²	86.8	42%	0.422	44%	0.441	S	S	.	.			trans	-76	126	175.5	-170.5	-19.9	0	0	0	110	S874 K878 N879 S880	S874-D876 PolarHBondContact OG-N 3.44Å; D876-K878 PolarHBondContact O-N 3.19Å; D876-K878 PolarHBondContact OD1-N 3.21Å; D876-N879 WeakPolarHBondContact O-CA 3.32Å; D876-N879 WeakPolarHBondContact O-CB 3.41Å; D876-N879 PolarHBondContact O-N 2.63Å; D876-S880 PolarHBondContact O-N 3.32Å
877	R	57.8	Low	63.7	Low	199 Å²	199	82.9 Å²	82.9	75%	0.751	43%	0.428	S	S	*	.	H	α-helix	trans	-57.2	-32.4	-179.3	-158.6	175.2	-167.5	165	4.2	112.8	N879 S880 D881	R877-N879 PolarHBondContact O-N 2.79Å; R877-S880 PolarHBondContact O-N 3.38Å; R877-S880 PolarHBondContact O-OG 2.83Å; R877-D881 PolarHBondContact O-N 2.83Å
878	K	61.7	Low	63.2	Low	150 Å²	150	84.2 Å²	84.2	65%	0.652	43%	0.433	S	S	*	.	H	α-helix	trans	-61.3	-26.9	174.7	-66.1	176.2	178.9	176.1	0	112.8	D876 M882	D876-K878 PolarHBondContact O-N 3.19Å; D876-K878 PolarHBondContact OD1-N 3.21Å; K878-M882 PolarHBondContact O-N 3.02Å
879	N	66.4	Low	62	Low	35 Å²	35	91.5 Å²	91.5	19%	0.187	46%	0.461	C	S	.	.	H	α-helix	trans	-87	-26.3	-179.3	-65.6	-26.4	0	0	0	112.3	L871 S874 D876 R877 M882 L883	L871-N879 HydrophobicContact CB-CB 4.42Å; L871-N879 HydrophobicContact CD2-CB 3.7Å; L871-N879 WeakPolarHBondContact CD2-OD1 3.32Å; S874-N879 WeakPolarHBondContact CB-ND2 3.48Å; S874-N879 PolarHBondContact OG-ND2 2.85Å; D876-N879 WeakPolarHBondContact O-CA 3.32Å; D876-N879 WeakPolarHBondContact O-CB 3.41Å; D876-N879 PolarHBondContact O-N 2.63Å; R877-N879 PolarHBondContact O-N 2.79Å; N879-M882 WeakPolarHBondContact OD1-CE 3.27Å; N879-L883 WeakPolarHBondContact O-CG 3.37Å; N879-L883 PolarHBondContact O-N 3.37Å
880	S	64.6	Low	61.1	Low	52 Å²	52	84.3 Å²	84.3	36%	0.364	44%	0.437	S	S	.	.	H	α-helix	trans	-67.9	-42.3	164.1	56.4	0	0	0	0	111.4	D876 R877 M882 L883 D884	D876-S880 PolarHBondContact O-N 3.32Å; R877-S880 PolarHBondContact O-N 3.38Å; R877-S880 PolarHBondContact O-OG 2.83Å; S880-M882 VanDerWaalsContact C-N 3.25Å; S880-M882 PolarHBondContact O-N 3.03Å; S880-L883 WeakPolarHBondContact O-CB 3.07Å; S880-L883 PolarHBondContact O-N 2.97Å; S880-D884 PolarHBondContact O-N 3.27Å
881	D	63.2	Low	59.7	Low	88 Å²	88	83.7 Å²	83.7	47%	0.471	44%	0.439	S	S	.	.	H	α-helix	trans	-62.7	-34	179	-56.4	-16.1	0	0	0	111.4	R877 M885	R877-D881 PolarHBondContact O-N 2.83Å; D881-M885 PolarHBondContact O-N 3.3Å
882	M	65.3	Low	58.1	Low	76 Å²	76	93.2 Å²	93.2	37%	0.374	48%	0.475	S	S	.	.	H	α-helix	trans	-72.9	-35.5	170.4	-77.8	-167.5	-69.7	0	0	114.1	L871 K878 N879 S880 M885 I886	L871-M882 HydrophobicContact CD1-CB 3.83Å; L871-M882 HydrophobicContact CD2-CE 3.88Å; K878-M882 PolarHBondContact O-N 3.02Å; N879-M882 WeakPolarHBondContact OD1-CE 3.27Å; S880-M882 VanDerWaalsContact C-N 3.25Å; S880-M882 PolarHBondContact O-N 3.03Å; M882-M885 HydrophobicContact CG-CE 4.04Å; M882-M885 PolarHBondContact O-N 3Å; M882-I886 WeakPolarHBondContact O-CB 3.41Å; M882-I886 WeakPolarHBondContact O-CD1 3.43Å; M882-I886 VanDerWaalsContact O-CG1 3.22Å; M882-I886 WeakPolarHBondContact O-CG1 3.44Å; M882-I886 PolarHBondContact O-N 3.27Å
883	L	68.7	Low	56.5	Low	26 Å²	26	95 Å²	95	14%	0.136	47%	0.473	C	S	.	.	H	α-helix	trans	-62.3	-43.8	173.8	-84.1	164	0	0	0	111.8	H868 L871 N879 S880 I886 T887	H868-L883 HydrophobicContact CB-CD2 4.28Å; L871-L883 HydrophobicContact CB-CD1 3.9Å; L871-L883 HydrophobicContact CB-CD2 3.92Å; L871-L883 HydrophobicContact CB-CG 3.61Å; L871-L883 HydrophobicContact CD1-CD2 4.43Å; L871-L883 HydrophobicContact CD1-CG 4.16Å; N879-L883 WeakPolarHBondContact O-CG 3.37Å; N879-L883 PolarHBondContact O-N 3.37Å; S880-L883 WeakPolarHBondContact O-CB 3.07Å; S880-L883 PolarHBondContact O-N 2.97Å; L883-I886 PolarHBondContact O-N 3.42Å; L883-T887 WeakPolarHBondContact O-CB 3.5Å; L883-T887 PolarHBondContact O-N 3.04Å; L883-T887 PolarHBondContact O-OG1 2.84Å
884	D	62.8	Low	55.5	Low	84 Å²	84	94.4 Å²	94.4	45%	0.449	47%	0.47	S	S	.	.	H	α-helix	trans	-62.5	-45.4	177.1	-83.1	-9	0	0	0	110.8	S880 T887 E888	S880-D884 PolarHBondContact O-N 3.27Å; D884-T887 PolarHBondContact O-N 3.4Å; D884-E888 VanDerWaalsContact O-CB 3.27Å; D884-E888 WeakPolarHBondContact O-CB 3.17Å; D884-E888 PolarHBondContact O-N 3.06Å
885	M	62.6	Low	54.6	Low	100 Å²	100	94.1 Å²	94.1	49%	0.493	46%	0.464	S	S	.	.	H	α-helix	trans	-58	-49.8	172	-82.6	-165.8	-68	0	0	112.5	D881 M882 T887 E888 Y889	D881-M885 PolarHBondContact O-N 3.3Å; M882-M885 HydrophobicContact CG-CE 4.04Å; M882-M885 PolarHBondContact O-N 3Å; M885-T887 VanDerWaalsContact C-N 3.25Å; M885-T887 PolarHBondContact O-N 3.26Å; M885-E888 PolarHBondContact O-N 2.95Å; M885-Y889 HydrophobicContact CB-CD2 4.33Å; M885-Y889 HydrophobicContact CG-CE2 4.45Å; M885-Y889 VanDerWaalsContact O-CD2 3.25Å; M885-Y889 WeakPolarHBondContact O-CD2 3.32Å; M885-Y889 PolarHBondContact O-N 3.19Å
886	I	62.5	Low	53.7	Low	34 Å²	34	92.7 Å²	92.7	17%	0.174	45%	0.454	C	S	.	.	H	α-helix	trans	-61.1	-38.9	-178.1	-71.8	162.8	0	0	0	110.7	L864 I867 L871 M882 L883 S890	L864-I886 HydrophobicContact CD2-CG2 4.42Å; I867-I886 HydrophobicContact CG2-CD1 3.47Å; I867-I886 VanDerWaalsContact CG2-CD1 3.47Å; L871-I886 HydrophobicContact CD1-CD1 3.68Å; M882-I886 WeakPolarHBondContact O-CB 3.41Å; M882-I886 WeakPolarHBondContact O-CD1 3.43Å; M882-I886 VanDerWaalsContact O-CG1 3.22Å; M882-I886 WeakPolarHBondContact O-CG1 3.44Å; M882-I886 PolarHBondContact O-N 3.27Å; L883-I886 PolarHBondContact O-N 3.42Å; I886-S890 WeakPolarHBondContact O-CB 3.47Å; I886-S890 PolarHBondContact O-N 3.06Å; I886-S890 PolarHBondContact O-OG 2.76Å
887	T	63	Low	52.7	Low	56 Å²	56	91.5 Å²	91.5	34%	0.344	45%	0.45	S	S	.	.	H	α-helix	trans	-69.1	-39.4	177.5	-53.2	0	0	0	0	111.5	L883 D884 M885 S890	L883-T887 WeakPolarHBondContact O-CB 3.5Å; L883-T887 PolarHBondContact O-N 3.04Å; L883-T887 PolarHBondContact O-OG1 2.84Å; D884-T887 PolarHBondContact O-N 3.4Å; M885-T887 VanDerWaalsContact C-N 3.25Å; M885-T887 PolarHBondContact O-N 3.26Å; T887-S890 PolarHBondContact O-N 3.42Å
888	E	56.3	Low	51.7	Low	78 Å²	78	83.9 Å²	83.9	36%	0.364	43%	0.427	S	S	.	.	H	α-helix	trans	-72.2	-39.3	-179.7	-169.9	162.9	143.1	0	0	113.3	D884 M885 S890 R1168	D884-E888 VanDerWaalsContact O-CB 3.27Å; D884-E888 WeakPolarHBondContact O-CB 3.17Å; D884-E888 PolarHBondContact O-N 3.06Å; M885-E888 PolarHBondContact O-N 2.95Å; E888-S890 VanDerWaalsContact C-N 3.27Å; E888-S890 PolarHBondContact O-N 2.96Å; E888-R1168 IonicContact OE2-CZ 3.83Å; E888-R1168 IonicContact OE2-NH1 3.72Å; E888-R1168 PolarHBondContact OE2-NH1 3.49Å; E888-R1168 IonicContact OE2-NH2 3.79Å; E888-R1168 PolarHBondContact OE2-NH2 3.21Å
889	Y	47.3	Very low	50.4	Low	180 Å²	180	81.8 Å²	81.8	71%	0.706	43%	0.429	S	S	*	.	S	Bend	trans	-78.5	-5.6	175.1	-74.8	-70	0	0	0	114	M885 P891	M885-Y889 HydrophobicContact CB-CD2 4.33Å; M885-Y889 HydrophobicContact CG-CE2 4.45Å; M885-Y889 VanDerWaalsContact O-CD2 3.25Å; M885-Y889 WeakPolarHBondContact O-CD2 3.32Å; M885-Y889 PolarHBondContact O-N 3.19Å; Y889-P891 WeakPolarHBondContact O-CD 3.02Å
890	S	48.2	Very low	49	Very low	16 Å²	16	83.7 Å²	83.7	11%	0.112	44%	0.436	C	S	.	.			trans	-117	44	-175.8	-55.1	0	0	0	0	115	I886 T887 E888 Y892 Y893	I886-S890 WeakPolarHBondContact O-CB 3.47Å; I886-S890 PolarHBondContact O-N 3.06Å; I886-S890 PolarHBondContact O-OG 2.76Å; T887-S890 PolarHBondContact O-N 3.42Å; E888-S890 VanDerWaalsContact C-N 3.27Å; E888-S890 PolarHBondContact O-N 2.96Å; S890-Y892 PolarHBondContact O-N 3.22Å; S890-Y893 PolarHBondContact O-N 3.17Å
891	P	38.8	Very low	47.6	Very low	105 Å²	105	83.7 Å²	83.7	68%	0.682	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-12.2	-170.9	28.8	-37.2	0	0	0	115	Y889 Y893	Y889-P891 WeakPolarHBondContact O-CD 3.02Å; P891-Y893 VanDerWaalsContact C-N 3.33Å
892	Y	35.7	Very low	46.2	Very low	218 Å²	218	82 Å²	82	86%	0.855	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-11.9	173.2	-69.1	-80.9	0	0	0	114	S890	S890-Y892 PolarHBondContact O-N 3.22Å
893	Y	34.6	Very low	44.8	Very low	101 Å²	101	83.8 Å²	83.8	40%	0.396	44%	0.441	S	S	.	.	S	Bend	trans	-110.8	114.8	175.9	-62	-72.7	0	0	0	109.6	C861 L864 S890 P891 L895	C861-Y893 PolarHBondContact SG-OH 2.86Å; C861-Y893 VanDerWaalsContact SG-OH 3.36Å; L864-Y893 HydrophobicContact CD1-CD2 4.3Å; L864-Y893 HydrophobicContact CD1-CE2 4.16Å; S890-Y893 PolarHBondContact O-N 3.17Å; P891-Y893 VanDerWaalsContact C-N 3.33Å; Y893-L895 PolarHBondContact O-N 3.21Å
894	N	37.4	Very low	43.2	Very low	124 Å²	124	90 Å²	90	66%	0.663	47%	0.469	S	S	*	.			trans	-78.5	56.7	-173.3	-159	6.5	0	0	0	112.1	S896 T897	N894-S896 PolarHBondContact O-N 3.44Å; N894-S896 VanDerWaalsContact O-N 3.16Å; N894-S896 PolarHBondContact OD1-OG 3Å; N894-T897 PolarHBondContact O-N 3.48Å
895	L	36.8	Very low	41.6	Very low	43 Å²	43	90.9 Å²	90.9	23%	0.225	47%	0.473	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-8.7	-173.7	-71.4	160.6	0	0	0	113.7	Y893 T897	Y893-L895 PolarHBondContact O-N 3.21Å; L895-T897 PolarHBondContact O-N 3.17Å
896	S	37.6	Very low	40	Very low	103 Å²	103	94.7 Å²	94.7	72%	0.72	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	5.1	175.9	59.1	0	0	0	0	114.4	N894	N894-S896 PolarHBondContact O-N 3.44Å; N894-S896 VanDerWaalsContact O-N 3.16Å; N894-S896 PolarHBondContact OD1-OG 3Å
897	T	35.5	Very low	38.4	Very low	53 Å²	53	97.2 Å²	97.2	33%	0.325	51%	0.509	S	S	.	.	S	Bend	trans	-65.5	148	161.6	57.6	0	0	0	0	110.6	N894 L895 T901	N894-T897 PolarHBondContact O-N 3.48Å; L895-T897 PolarHBondContact O-N 3.17Å; T897-T901 HydrophobicContact CG2-CG2 4.4Å
898	S	35.8	Very low	36.7	Very low	40 Å²	40	101.5 Å²	101.5	28%	0.28	54%	0.535	S	S	.	.			trans	-57.5	159.4	-167.2	80.7	0	0	0	0	113.6	Q900 T901 L902	S898-Q900 PolarHBondContact O-N 3.02Å; S898-Q900 PolarHBondContact OG-N 3.48Å; S898-T901 PolarHBondContact N-OG1 2.92Å; S898-T901 WeakPolarHBondContact O-CA 3.5Å; S898-T901 WeakPolarHBondContact O-CB 3.36Å; S898-T901 PolarHBondContact O-N 3.17Å; S898-T901 PolarHBondContact OG-N 2.82Å; S898-T901 PolarHBondContact OG-OG1 3.3Å; S898-L902 PolarHBondContact O-N 2.7Å
899	P	35.7	Very low	35.4	Very low	105 Å²	105	100.8 Å²	100.8	68%	0.682	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-11.2	173.2	22.8	-34.5	0	0	0	114.2	T903	P899-T903 PolarHBondContact O-OG1 3.12Å
900	Q	36.8	Very low	34.3	Very low	75 Å²	75	100.9 Å²	100.9	35%	0.35	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.7	-22.6	172.4	-60.8	156.5	-26.6	0	0	112.7	T338 S898 T903 Q904	T338-Q900 PolarHBondContact OG1-NE2 3.31Å; T338-Q900 VanDerWaalsContact OG1-NE2 3.12Å; T338-Q900 PolarHBondContact OG1-OE1 3.22Å; S898-Q900 PolarHBondContact O-N 3.02Å; S898-Q900 PolarHBondContact OG-N 3.48Å; Q900-T903 WeakPolarHBondContact CA-OG1 3.44Å; Q900-T903 PolarHBondContact O-OG1 2.89Å; Q900-T903 VanDerWaalsContact O-OG1 3.06Å; Q900-Q904 WeakPolarHBondContact O-CG 3.46Å; Q900-Q904 PolarHBondContact O-N 3.22Å
901	T	34.7	Very low	33.4	Very low	53 Å²	53	106.4 Å²	106.4	33%	0.325	60%	0.598	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.9	-38.6	169.8	-39.3	0	0	0	0	110.4	T897 S898 T903 Q904 I905	T897-T901 HydrophobicContact CG2-CG2 4.4Å; S898-T901 PolarHBondContact N-OG1 2.92Å; S898-T901 WeakPolarHBondContact O-CA 3.5Å; S898-T901 WeakPolarHBondContact O-CB 3.36Å; S898-T901 PolarHBondContact O-N 3.17Å; S898-T901 PolarHBondContact OG-N 2.82Å; S898-T901 PolarHBondContact OG-OG1 3.3Å; T901-T903 PolarHBondContact O-N 3.42Å; T901-Q904 PolarHBondContact O-N 2.79Å; T901-I905 PolarHBondContact O-N 2.78Å
902	L	34.7	Very low	33	Very low	51 Å²	51	108.2 Å²	108.2	27%	0.267	61%	0.607	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.2	-17	173.9	-106.9	159.8	0	0	0	114.2	S898	S898-L902 PolarHBondContact O-N 2.7Å
903	T	35.3	Very low	32.5	Very low	115 Å²	115	102.7 Å²	102.7	71%	0.706	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	-7.8	170.1	52.5	0	0	0	0	114.1	P899 Q900 T901	P899-T903 PolarHBondContact O-OG1 3.12Å; Q900-T903 WeakPolarHBondContact CA-OG1 3.44Å; Q900-T903 PolarHBondContact O-OG1 2.89Å; Q900-T903 VanDerWaalsContact O-OG1 3.06Å; T901-T903 PolarHBondContact O-N 3.42Å
904	Q	34.8	Very low	32.3	Very low	157 Å²	157	106.7 Å²	106.7	73%	0.734	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	-15	174.2	-75.6	-175.3	-18	0	0	113.8	Q900 T901 Q906	Q900-Q904 WeakPolarHBondContact O-CG 3.46Å; Q900-Q904 PolarHBondContact O-N 3.22Å; T901-Q904 PolarHBondContact O-N 2.79Å; Q904-Q906 PolarHBondContact O-N 3.49Å
905	I	29.6	Very low	31.8	Very low	102 Å²	102	107 Å²	107	52%	0.523	63%	0.629	S	S	.	*	S	Bend	trans	-63.2	107.6	164	-64.5	170.9	0	0	0	107.7	T901 C907	T901-I905 PolarHBondContact O-N 2.78Å; I905-C907 VanDerWaalsContact C-N 3.28Å; I905-C907 PolarHBondContact O-N 2.98Å
906	Q	29.7	Very low	31.4	Very low	179 Å²	179	112.1 Å²	112.1	84%	0.836	66%	0.655	S	S	*	*			trans	-68.9	83.9	176.5	-73.9	-174.2	-40.8	0	0	110.6	Q904 T908	Q904-Q906 PolarHBondContact O-N 3.49Å; Q906-T908 PolarHBondContact O-N 3.44Å
907	C	27.6	Very low	31	Very low	87 Å²	87	113 Å²	113	59%	0.588	66%	0.657	S	S	*	*			trans	-61	105.6	157.4	-67.8	0	0	0	0	107.8	I905 G909	I905-C907 VanDerWaalsContact C-N 3.28Å; I905-C907 PolarHBondContact O-N 2.98Å; C907-G909 PolarHBondContact O-N 3.3Å
908	T	28.4	Very low	30.7	Very low	147 Å²	147	116.4 Å²	116.4	90%	0.902	68%	0.682	S	S	*	*			trans	-72.3	70.1	178.2	51.6	0	0	0	0	110.6	Q906	Q906-T908 PolarHBondContact O-N 3.44Å
909	G	28.3	Very low	30.5	Very low	63 Å²	63	119.8 Å²	119.8	65%	0.649	71%	0.706	S	S	*	*			trans	-149.3	111.8	-178.6	0	0	0	0	0	110.1	C907 C911	C907-G909 PolarHBondContact O-N 3.3Å; G909-C911 PolarHBondContact O-N 2.93Å
910	L	25.5	Very low	30.3	Very low	181 Å²	181	122.7 Å²	122.7	95%	0.948	72%	0.715	S	S	*	*			trans	-62.5	125.6	-175.1	-70.1	150.4	0	0	0	112.4
911	C	27.8	Very low	30.2	Very low	133 Å²	133	125.1 Å²	125.1	90%	0.899	74%	0.737	S	S	*	*			trans	-164.3	150.3	141.1	-112.3	0	0	0	0	110.5	G909	G909-C911 PolarHBondContact O-N 2.93Å
912	T	30.3	Very low	30	Very low	142 Å²	142	126 Å²	126	87%	0.871	76%	0.757	S	S	*	*			trans	-89	154.8	-164	46	0	0	0	0	115
913	S	26.4	Very low	29.9	Very low	102 Å²	102	133 Å²	133	71%	0.713	79%	0.788	S	S	*	*			trans	-71.5	143.8	-178.4	52.7	0	0	0	0	115.2
914	Q	30.4	Very low	29.6	Very low	186 Å²	186	134.3 Å²	134.3	87%	0.869	79%	0.791	S	S	*	*			trans	-131.8	131.9	142	-77.6	-167	-6.2	0	0	109.9
915	T	25.8	Very low	29.2	Very low	131 Å²	131	133.3 Å²	133.3	80%	0.804	79%	0.791	S	S	*	*			trans	-103.3	125.6	177.9	-54.6	0	0	0	0	108.5
916	I	28.8	Very low	29.3	Very low	149 Å²	149	137.9 Å²	137.9	76%	0.764	81%	0.81	S	S	*	*			trans	-129.2	131.8	170.2	-60	-176.8	0	0	0	109.3
917	T	28.6	Very low	29.2	Very low	123 Å²	123	138.7 Å²	138.7	76%	0.755	81%	0.81	S	S	*	*			trans	-79.8	144.8	-179.2	43.8	0	0	0	0	111.8	S919	T917-S919 PolarHBondContact O-N 3.33Å
918	S	29.1	Very low	29	Very low	124 Å²	124	140 Å²	140	87%	0.867	82%	0.82	S	S	*	*			trans	-76.9	102	175.7	58	0	0	0	0	111.7
919	S	31.8	Very low	29.1	Very low	111 Å²	111	140.3 Å²	140.3	78%	0.776	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-83.5	173.7	164.7	48.9	0	0	0	0	111.9	T917	T917-S919 PolarHBondContact O-N 3.33Å
920	L	33.1	Very low	28.9	Very low	165 Å²	165	145.7 Å²	145.7	86%	0.864	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-69.5	157.4	-170.6	-95.6	64.4	0	0	0	113.8
921	P	32.9	Very low	29.2	Very low	127 Å²	127	142.8 Å²	142.8	83%	0.825	82%	0.816	S	S	*	*	S	Bend	trans	-80.2	141.3	-175	32.2	-35.3	0	0	0	113.6
922	G	32	Very low	29.1	Very low	71 Å²	71	141.6 Å²	141.6	73%	0.732	81%	0.81	S	S	*	*			trans	99.9	40.4	137.9	0	0	0	0	0	119.6
923	E	31.1	Very low	29.1	Very low	198 Å²	198	140.4 Å²	140.4	93%	0.925	81%	0.807	S	S	*	*			trans	-98.8	154.2	147.5	-76.3	-156.9	125.9	0	0	111.2
924	N	28.9	Very low	29.4	Very low	142 Å²	142	141.9 Å²	141.9	76%	0.759	81%	0.812	S	S	*	*			trans	-93.1	151.2	-159.6	-69.9	-67	0	0	0	114.5
925	N	27.5	Very low	29.4	Very low	137 Å²	137	137.6 Å²	137.6	73%	0.733	80%	0.802	S	S	*	*			trans	65.7	107.9	158.4	-54.2	-39.7	0	0	0	118.4
926	Q	30.6	Very low	29.3	Very low	198 Å²	198	136.8 Å²	136.8	93%	0.925	80%	0.8	S	S	*	*				-161.8	164.1	118.4	-107.5	151.4	82.6	0	0	114.3
927	K	29.1	Very low	29.4	Very low	195 Å²	195	137.3 Å²	137.3	85%	0.848	80%	0.804	S	S	*	*			trans	-72.1	144.4	-161.1	-64.1	171.7	176.7	175.2	0	114
928	C	22.9	Very low	29.6	Very low	116 Å²	116	136.1 Å²	136.1	78%	0.784	80%	0.798	S	S	*	*			trans	-80.2	147.9	156.1	-65.7	0	0	0	0	110.6
929	I	29.5	Very low	29.4	Very low	152 Å²	152	136.4 Å²	136.4	78%	0.779	80%	0.795	S	S	*	*			trans	-132.2	125.7	167.5	-59.1	178.1	0	0	0	107.1
930	H	25.8	Very low	29.4	Very low	177 Å²	177	135.2 Å²	135.2	82%	0.819	79%	0.792	S	S	*	*			trans	-103.5	144.7	172.6	-80.6	-119.6	0	0	0	110.1
931	S	30.8	Very low	29.2	Very low	119 Å²	119	133.7 Å²	133.7	83%	0.832	79%	0.785	S	S	*	*			trans	-136.9	146.7	167.3	-62.1	0	0	0	0	108.5
932	S	26.4	Very low	29.1	Very low	109 Å²	109	138.1 Å²	138.1	76%	0.762	79%	0.786	S	S	*	*			trans	-127.9	173.7	-160.8	53.9	0	0	0	0	113.9
933	S	30.8	Very low	29	Very low	116 Å²	116	140.1 Å²	140.1	81%	0.811	79%	0.787	S	S	*	*			trans	71.4	158.7	-177.3	78.7	0	0	0	0	114.6
934	V	30.8	Very low	29	Very low	134 Å²	134	137.8 Å²	137.8	81%	0.812	79%	0.785	S	S	*	*			cis	-129.1	-173.5	15.2	-175.5	0	0	0	0	111
935	S	30.7	Very low	29.2	Very low	95 Å²	95	136.7 Å²	136.7	66%	0.664	79%	0.789	S	S	*	*			trans	-120.7	149.8	-155.1	54.8	0	0	0	0	117.9
936	C	25.3	Very low	29.4	Very low	114 Å²	114	133.7 Å²	133.7	77%	0.77	79%	0.79	S	S	*	*			trans	69.3	110.6	137.9	-71.4	0	0	0	0	123.9
937	L	29.1	Very low	29.4	Very low	161 Å²	161	131 Å²	131	84%	0.843	78%	0.782	S	S	*	*				77	164.1	120.4	-108.9	79	0	0	0	120.3
938	P	32.8	Very low	29.4	Very low	98 Å²	98	128.1 Å²	128.1	64%	0.636	78%	0.776	S	S	*	*				-139.7	-175.6	-96.1	47.4	-30.7	0	0	0	117.5
939	T	26.3	Very low	29.9	Very low	129 Å²	129	129.6 Å²	129.6	79%	0.791	78%	0.775	S	S	*	*			trans	67.7	112	149.9	-51	0	0	0	0	119.9
940	A	30.4	Very low	29.8	Very low	86 Å²	86	127.5 Å²	127.5	71%	0.711	77%	0.774	S	S	*	*				179.2	127.5	119.2	0	0	0	0	0	114.7
941	N	30.5	Very low	30.1	Very low	134 Å²	134	130 Å²	130	72%	0.717	78%	0.776	S	S	*	*			trans	57.1	108.8	132.5	-69.2	8.8	0	0	0	124.3
942	Y	29.5	Very low	29.9	Very low	219 Å²	219	131.7 Å²	131.7	86%	0.859	77%	0.773	S	S	*	*			trans	73.1	141.9	142.8	-70.1	-81.3	0	0	0	122.1
943	P	29.9	Very low	30.1	Very low	114 Å²	114	131.5 Å²	131.5	74%	0.74	77%	0.771	S	S	*	*			trans	-107.5	155.9	-178.8	40.6	-32.8	0	0	0	114.3
944	V	32.3	Very low	30	Very low	148 Å²	148	135.7 Å²	135.7	90%	0.897	77%	0.771	S	S	*	*			trans	-139.7	146.1	162	-179.5	0	0	0	0	109.9
945	S	31.6	Very low	30	Very low	120 Å²	120	134.9 Å²	134.9	84%	0.839	77%	0.77	S	S	*	*			trans	-56.2	159.2	176.8	-40.8	0	0	0	0	114.8
946	G	31.8	Very low	29.9	Very low	73 Å²	73	135.1 Å²	135.1	75%	0.753	77%	0.771	S	S	*	*			trans	161	73.5	166.7	0	0	0	0	0	117.2
947	D	32.3	Very low	30.1	Very low	142 Å²	142	134.7 Å²	134.7	76%	0.759	77%	0.769	S	S	*	*			trans	24.4	123.2	131.3	-78.2	29.9	0	0	0	121.8
948	N	29.1	Very low	30.3	Very low	135 Å²	135	137.8 Å²	137.8	72%	0.722	77%	0.771	S	S	*	*				84.4	143.5	125.7	-75.7	-46.7	0	0	0	123.6
949	I	33.2	Very low	30.1	Very low	147 Å²	147	138.3 Å²	138.3	75%	0.754	78%	0.777	S	S	*	*			trans	72.9	88	152.7	-61.4	153.9	0	0	0	118.8
950	S	27.2	Very low	30.5	Very low	108 Å²	108	140.5 Å²	140.5	76%	0.755	78%	0.776	S	S	*	*				27.9	107.6	115	-49.3	0	0	0	0	120.7
951	R	31	Very low	30.7	Very low	228 Å²	228	143.7 Å²	143.7	86%	0.86	78%	0.776	S	S	*	*			trans	-162.2	119	139.5	-103.3	157.7	-177.9	-163.9	0.1	107.9
952	M	28.1	Very low	30.5	Very low	156 Å²	156	142.8 Å²	142.8	77%	0.768	78%	0.78	S	S	*	*				86.9	148.2	59	-171.9	167.5	78.2	0	0	112.4
953	S	30.4	Very low	31	Very low	104 Å²	104	137.8 Å²	137.8	73%	0.727	77%	0.774	S	S	*	*			trans	77.2	145	178.5	78.8	0	0	0	0	116.6
954	Y	28.3	Very low	31	Very low	205 Å²	205	138.8 Å²	138.8	80%	0.804	77%	0.772	S	S	*	*			cis	-163.6	-174.4	-27.4	-118.2	-61.2	0	0	0	109.2
955	C	30.8	Very low	30.9	Very low	117 Å²	117	139.7 Å²	139.7	79%	0.791	77%	0.767	S	S	*	*			trans	71.4	116.1	170.6	-60.6	0	0	0	0	116.2
956	S	29.1	Very low	30.8	Very low	99 Å²	99	139.8 Å²	139.8	69%	0.692	76%	0.762	S	S	*	*			cis	114.4	136.1	7	-63	0	0	0	0	113.5
957	S	29.1	Very low	30.8	Very low	105 Å²	105	140.4 Å²	140.4	73%	0.734	76%	0.76	S	S	*	*			trans	70.8	141.4	166.1	-48.1	0	0	0	0	115.8
958	Y	32.9	Very low	30.7	Very low	227 Å²	227	143.9 Å²	143.9	89%	0.89	76%	0.763	S	S	*	*			cis	-133.7	150.8	28	-107.4	-91.4	0	0	0	115
959	S	29.6	Very low	31	Very low	108 Å²	108	143.6 Å²	143.6	76%	0.755	76%	0.761	S	S	*	*			trans	-90	158.1	175.2	-44.9	0	0	0	0	112.8
960	K	34.6	Very low	30.9	Very low	175 Å²	175	145 Å²	145	76%	0.761	76%	0.764	S	S	*	*			trans	169.9	147.7	138.8	-97.4	-177.8	179.2	-94	0	109.9
961	E	33.3	Very low	31.3	Very low	154 Å²	154	144.9 Å²	144.9	72%	0.72	76%	0.761	S	S	*	*			cis	-156.7	162.8	-24.7	-137.3	159.7	-166.7	0	0	107.1
962	S	27.7	Very low	31.3	Very low	114 Å²	114	139.1 Å²	139.1	80%	0.797	76%	0.756	S	S	*	*			trans	-106.4	-140.6	-166.6	-57.2	0	0	0	0	114.6
963	P	39.6	Very low	31.8	Very low	114 Å²	114	137.4 Å²	137.4	74%	0.74	76%	0.756	S	S	*	*				-116.6	-117	-116.9	35.4	-16.1	0	0	0	113
964	I	30.4	Very low	31.8	Very low	136 Å²	136	137.1 Å²	137.1	70%	0.697	75%	0.754	S	S	*	*			trans	94.1	105.1	157.6	-75.1	163.7	0	0	0	119.4
965	Q	29.9	Very low	32	Very low	167 Å²	167	134.1 Å²	134.1	78%	0.78	76%	0.757	S	S	*	*				103	108.1	125.4	-88.6	-178.1	19.1	0	0	125.4
966	T	28.7	Very low	32	Very low	122 Å²	122	132.2 Å²	132.2	75%	0.748	75%	0.75	S	S	*	*				68.7	143.6	126.8	17.3	0	0	0	0	125.4
967	A	31.4	Very low	32	Very low	85 Å²	85	132.8 Å²	132.8	70%	0.702	75%	0.753	S	S	*	*			trans	77.8	149.3	138.5	0	0	0	0	0	117.3
968	R	30.9	Very low	32.1	Very low	216 Å²	216	133 Å²	133	82%	0.815	76%	0.755	S	S	*	*			cis	-160.9	168	-5.3	-131.5	178.4	172.8	147.2	-4.9	109.8
969	N	35.5	Very low	31.8	Very low	129 Å²	129	127.2 Å²	127.2	69%	0.69	75%	0.748	S	S	*	*			trans	67.9	154.6	156.2	-57.8	-10.8	0	0	0	117.3
970	Q	31.5	Very low	31.8	Very low	176 Å²	176	128.5 Å²	128.5	82%	0.822	75%	0.751	S	S	*	*			cis	-151.7	169	-29.5	-107.8	-151.4	-24.8	0	0	108.6
971	P	35.6	Very low	31.3	Very low	106 Å²	106	126.2 Å²	126.2	69%	0.688	75%	0.752	S	S	*	*			trans	-119.7	-150.4	-155.1	42.2	-28.3	0	0	0	112.9
972	S	30.1	Very low	31	Very low	106 Å²	106	125.6 Å²	125.6	74%	0.741	75%	0.752	S	S	*	*			trans	109.3	152.6	156.6	-45.5	0	0	0	0	115
973	P	38.3	Very low	30.8	Very low	121 Å²	121	124.8 Å²	124.8	79%	0.786	75%	0.746	S	S	*	*				-142.7	-126.4	-124.4	43.3	-20.5	0	0	0	113
974	S	31.1	Very low	30.1	Very low	98 Å²	98	125 Å²	125	69%	0.685	75%	0.745	S	S	*	*			trans	95.7	121.8	161.7	86.7	0	0	0	0	115.5
975	V	31.2	Very low	29.9	Very low	141 Å²	141	124.8 Å²	124.8	86%	0.855	75%	0.746	S	S	*	*				90.4	135	87	164.1	0	0	0	0	110.4
976	A	31.6	Very low	29.7	Very low	78 Å²	78	123.1 Å²	123.1	65%	0.645	74%	0.741	S	S	*	*			cis	-142	174.6	11.1	0	0	0	0	0	113.9
977	S	29.2	Very low	29.6	Very low	110 Å²	110	121.7 Å²	121.7	77%	0.769	74%	0.736	S	S	*	*			trans	1.7	157.6	130.9	-34.5	0	0	0	0	119.6
978	S	31.7	Very low	29.4	Very low	111 Å²	111	123.4 Å²	123.4	78%	0.776	74%	0.738	S	S	*	*			cis	-155.3	166.1	27.4	-52.4	0	0	0	0	113.7
979	S	25.9	Very low	29.3	Very low	105 Å²	105	118.7 Å²	118.7	73%	0.734	73%	0.733	S	S	*	*			trans	-49.5	152.2	157.9	52.9	0	0	0	0	115
980	V	29.4	Very low	29	Very low	134 Å²	134	117.2 Å²	117.2	81%	0.812	73%	0.729	S	S	*	*				-174.4	148.3	112.7	142.9	0	0	0	0	112
981	T	24.1	Very low	29	Very low	127 Å²	127	115 Å²	115	78%	0.779	72%	0.722	S	S	*	*			trans	-74.7	-178.6	178.6	-37.6	0	0	0	0	112.7
982	I	26.5	Very low	28.8	Very low	142 Å²	142	115.6 Å²	115.6	73%	0.728	72%	0.72	S	S	*	*			trans	106.9	100.4	159.1	-55.7	161.7	0	0	0	116
983	S	23.8	Very low	28.9	Very low	96 Å²	96	116.4 Å²	116.4	67%	0.671	72%	0.716	S	S	*	*				36.6	137.1	125.4	-44.9	0	0	0	0	123.2
984	T	24.9	Very low	28.5	Very low	118 Å²	118	116.9 Å²	116.9	72%	0.724	72%	0.717	S	S	*	*			trans	74.8	134.3	137.7	46.6	0	0	0	0	121.9
985	N	25.8	Very low	28.5	Very low	133 Å²	133	115.9 Å²	115.9	71%	0.711	72%	0.715	S	S	*	*			trans	92.3	123.8	134	-78.2	-3.7	0	0	0	122.7
986	I	26.1	Very low	28.3	Very low	131 Å²	131	115 Å²	115	67%	0.672	71%	0.71	S	S	*	*				87	81.5	125.5	-65.8	172.4	0	0	0	119.1
987	S	26.7	Very low	28.3	Very low	93 Å²	93	117.4 Å²	117.4	65%	0.65	72%	0.716	S	S	*	*				79	-175.5	114.6	82.9	0	0	0	0	121.1
988	V	27.3	Very low	28.3	Very low	121 Å²	121	117.5 Å²	117.5	73%	0.733	72%	0.717	S	S	*	*			trans	59.1	132.2	170.5	-80.5	0	0	0	0	118.5
989	T	28.3	Very low	28.4	Very low	116 Å²	116	118 Å²	118	71%	0.712	72%	0.718	S	S	*	*			cis	-153	-147.5	-16.9	-5.2	0	0	0	0	108
990	T	30.7	Very low	28.4	Very low	99 Å²	99	118 Å²	118	61%	0.607	72%	0.718	S	S	*	*			cis	-162.5	142.9	8.7	-15.5	0	0	0	0	110.4
991	N	31.2	Very low	28.4	Very low	129 Å²	129	119.8 Å²	119.8	69%	0.69	72%	0.721	S	S	*	*			trans	65.1	151	144.9	-66.7	2.8	0	0	0	120.1
992	N	31.3	Very low	28.5	Very low	119 Å²	119	117.5 Å²	117.5	64%	0.636	72%	0.715	S	S	*	*			cis	-160.3	168.2	-6.2	-119	-3.8	0	0	0	113.4
993	N	32.4	Very low	28.6	Very low	122 Å²	122	116.3 Å²	116.3	65%	0.652	71%	0.714	S	S	*	*			trans	67.3	109	153.1	-64.6	1.5	0	0	0	117.8
994	T	29.5	Very low	28.8	Very low	131 Å²	131	116.5 Å²	116.5	80%	0.804	72%	0.716	S	S	*	*				70	143.2	74.2	68.2	0	0	0	0	113.6
995	A	30.3	Very low	29.1	Very low	78 Å²	78	116.5 Å²	116.5	65%	0.645	72%	0.716	S	S	*	*			cis	-155.5	153.6	20.9	0	0	0	0	0	115.5
996	T	27.6	Very low	29.1	Very low	123 Å²	123	115.3 Å²	115.3	76%	0.755	71%	0.713	S	S	*	*			trans	60	141.6	134.9	53.4	0	0	0	0	125.5
997	T	31.1	Very low	29.2	Very low	127 Å²	127	115 Å²	115	78%	0.779	72%	0.718	S	S	*	*			trans	73.5	105.7	139.8	46.7	0	0	0	0	122.2
998	S	30.4	Very low	29.5	Very low	112 Å²	112	116.6 Å²	116.6	78%	0.783	72%	0.724	S	S	*	*			trans	-55.6	160.9	135.5	-37	0	0	0	0	111.3
999	P	32.8	Very low	29.9	Very low	123 Å²	123	116.8 Å²	116.8	80%	0.799	73%	0.725	S	S	*	*				-142.4	169.1	88.6	39.5	-26	0	0	0	115.4
1000	S	26.9	Very low	30.1	Very low	104 Å²	104	117.2 Å²	117.2	73%	0.727	73%	0.73	S	S	*	*			trans	-67.4	153.6	163	52.5	0	0	0	0	112.7
1001	I	28	Very low	29.9	Very low	171 Å²	171	123.2 Å²	123.2	88%	0.877	74%	0.741	S	S	*	*			trans	-165.2	160	132.1	-102.3	151.8	0	0	0	110.6
1002	A	26.9	Very low	29.7	Very low	79 Å²	79	128.3 Å²	128.3	65%	0.653	75%	0.751	S	S	*	*			trans	-59.3	-173.6	-176.9	0	0	0	0	0	114.6
1003	T	28.3	Very low	29.5	Very low	117 Å²	117	129 Å²	129	72%	0.718	76%	0.759	S	S	*	*			cis	-168.4	158.6	30.1	-21.1	0	0	0	0	110.5
1004	S	27.4	Very low	29.4	Very low	101 Å²	101	127 Å²	127	71%	0.706	77%	0.768	S	S	*	*			trans	65.2	158.8	146.8	-63.6	0	0	0	0	118.5
1005	T	31.1	Very low	29.3	Very low	117 Å²	117	128 Å²	128	72%	0.718	77%	0.769	S	S	*	*			cis	-152.1	140.4	-3.2	-1.9	0	0	0	0	111
1006	T	27.8	Very low	29.2	Very low	108 Å²	108	132.2 Å²	132.2	66%	0.663	78%	0.779	S	S	*	*			trans	28.1	139.8	141	55.9	0	0	0	0	123.6
1007	T	28.2	Very low	29.1	Very low	125 Å²	125	129.6 Å²	129.6	77%	0.767	78%	0.777	S	S	*	*			trans	70.5	155	142.6	52.4	0	0	0	0	118.6
1008	T	32.4	Very low	28.9	Very low	127 Å²	127	129.6 Å²	129.6	78%	0.779	78%	0.78	S	S	*	*			cis	-143.1	158.1	8.2	-22.5	0	0	0	0	112.2
1009	V	34.4	Very low	28.8	Very low	125 Å²	125	131.9 Å²	131.9	76%	0.758	78%	0.778	S	S	*	*			trans	-87.4	149.8	170	-178.6	0	0	0	0	110.3
1010	P	32.5	Very low	28.8	Very low	124 Å²	124	133.4 Å²	133.4	81%	0.805	78%	0.78	S	S	*	*			trans	-130.9	134.7	134.5	30.9	-18.1	0	0	0	113.7
1011	R	27.5	Very low	28.9	Very low	225 Å²	225	134.7 Å²	134.7	85%	0.849	78%	0.778	S	S	*	*			trans	-77.7	147	160.4	-66.5	165.8	161.3	168.5	-9.1	108.7
1012	R	27.5	Very low	29	Very low	236 Å²	236	135.3 Å²	135.3	89%	0.891	78%	0.775	S	S	*	*				178.9	142.1	112.2	-102.2	175.7	176.3	178.6	-1.1	115.2
1013	T	26.6	Very low	29.2	Very low	133 Å²	133	139.7 Å²	139.7	82%	0.816	78%	0.782	S	S	*	*			trans	0.4	129.2	146.3	53	0	0	0	0	119.5
1014	G	30.6	Very low	29.3	Very low	82 Å²	82	142.1 Å²	142.1	85%	0.845	78%	0.783	S	S	*	*			trans	-156.8	133.1	157.4	0	0	0	0	0	109.5
1015	N	27.5	Very low	29.5	Very low	151 Å²	151	142.8 Å²	142.8	81%	0.807	79%	0.785	S	S	*	*			trans	-127.4	166.6	-179	-164.1	10.6	0	0	0	109.3
1016	L	27.4	Very low	29.3	Very low	167 Å²	167	142.3 Å²	142.3	87%	0.874	78%	0.782	S	S	*	*			trans	70.8	140.3	176.8	-53.9	119.5	0	0	0	117.7
1017	G	24.9	Very low	29.6	Very low	68 Å²	68	142.7 Å²	142.7	70%	0.701	79%	0.789	S	S	*	*			trans	141.7	116.2	131.5	0	0	0	0	0	119
1018	C	28.5	Very low	29.5	Very low	126 Å²	126	145 Å²	145	85%	0.851	79%	0.793	S	S	*	*			trans	67.6	104.9	139.2	-56.7	0	0	0	0	121.5
1019	H	28.2	Very low	29.4	Very low	160 Å²	160	146.8 Å²	146.8	74%	0.741	80%	0.797	S	S	*	*				9.6	140.9	128	-73.5	-94	0	0	0	120.2
1020	N	32.3	Very low	29	Very low	156 Å²	156	148.5 Å²	148.5	83%	0.834	80%	0.796	S	S	*	*				-159.6	163.5	104.4	-98.9	-35.6	0	0	0	113.6
1021	N	28.3	Very low	28.7	Very low	130 Å²	130	152.7 Å²	152.7	70%	0.695	80%	0.798	S	S	*	*			trans	-90.5	-162.2	-172.5	-59.9	-46.5	0	0	0	112.9
1022	F	30.4	Very low	28.8	Very low	185 Å²	185	146 Å²	146	81%	0.811	79%	0.791	S	S	*	*			trans	100.2	130.9	-179.6	-62.7	-66.5	0	0	0	114.5
1023	E	30.9	Very low	28.8	Very low	171 Å²	171	141.3 Å²	141.3	80%	0.799	79%	0.788	S	S	*	*			cis	-157.6	177.9	-14.8	-155.9	160.6	-151.6	0	0	109.9
1024	K	31.7	Very low	28.9	Very low	167 Å²	167	141.3 Å²	141.3	73%	0.726	78%	0.783	S	S	*	*			trans	-143	137.8	-170.9	-171.7	-171.2	-176.3	-178	0	112.9	T1026	K1024-T1026 HydrophobicContact CD-CG2 4.16Å; K1024-T1026 HydrophobicContact CG-CG2 4.23Å
1025	P	31.6	Very low	28.8	Very low	116 Å²	116	144.7 Å²	144.7	75%	0.753	78%	0.781	S	S	*	*			trans	-132	142.3	138	35.5	-24.6	0	0	0	111.6
1026	T	26.9	Very low	29	Very low	106 Å²	106	145 Å²	145	65%	0.65	78%	0.776	S	S	*	*			cis	83.6	83.3	29.1	72.4	0	0	0	0	116.9	K1024	K1024-T1026 HydrophobicContact CD-CG2 4.16Å; K1024-T1026 HydrophobicContact CG-CG2 4.23Å
1027	S	33.3	Very low	29.1	Very low	117 Å²	117	140.2 Å²	140.2	82%	0.818	77%	0.767	S	S	*	*			trans	-161.8	117.4	138.1	29.2	0	0	0	0	106.9
1028	M	25.9	Very low	29.3	Very low	173 Å²	173	145.2 Å²	145.2	85%	0.852	78%	0.775	S	S	*	*				65.7	97.8	65.2	-88.7	-173.2	62.8	0	0	115.4
1029	L	30	Very low	29.4	Very low	165 Å²	165	146.6 Å²	146.6	86%	0.864	77%	0.773	S	S	*	*			trans	-150	146.3	130	-106.9	166.2	0	0	0	108.2
1030	H	26.5	Very low	29.6	Very low	160 Å²	160	144.6 Å²	144.6	74%	0.741	77%	0.772	S	S	*	*			trans	-116.1	-168.5	-170.5	-108.8	93.9	0	0	0	111.2
1031	Y	26.7	Very low	29.4	Very low	213 Å²	213	142.5 Å²	142.5	84%	0.835	77%	0.767	S	S	*	*			trans	85.8	137.9	175.4	-45.6	-64.5	0	0	0	116.5
1032	A	28.9	Very low	29.6	Very low	84 Å²	84	144.9 Å²	144.9	69%	0.694	77%	0.774	S	S	*	*			cis	-160	127.2	-27.9	0	0	0	0	0	107.2
1033	T	27.5	Very low	29.6	Very low	138 Å²	138	142 Å²	142	85%	0.847	77%	0.772	S	S	*	*			trans	-98.5	120.9	174.4	-35.1	0	0	0	0	108.5
1034	L	29.8	Very low	29.4	Very low	133 Å²	133	137.9 Å²	137.9	70%	0.696	76%	0.762	S	S	*	*			trans	-99.6	103.8	177	-71.4	171.6	0	0	0	110	F1036	L1034-F1036 HydrophobicContact CB-CD2 4.21Å; L1034-F1036 HydrophobicContact CB-CE2 3.66Å; L1034-F1036 HydrophobicContact CB-CZ 4.23Å; L1034-F1036 HydrophobicContact CD1-CE2 4.06Å; L1034-F1036 HydrophobicContact CD1-CZ 4.21Å; L1034-F1036 HydrophobicContact CD2-CZ 4.42Å; L1034-F1036 HydrophobicContact CG-CE2 4.34Å
1035	D	27.6	Very low	29.5	Very low	152 Å²	152	138.2 Å²	138.2	81%	0.813	77%	0.766	S	S	*	*			trans	-77.6	137	162	-86.4	-55.3	0	0	0	109.9
1036	F	31.2	Very low	29.3	Very low	159 Å²	159	141.5 Å²	141.5	70%	0.697	76%	0.764	S	S	*	*			trans	-130.3	75.2	174.7	-74	-67.9	0	0	0	110.4	L1034	L1034-F1036 HydrophobicContact CB-CD2 4.21Å; L1034-F1036 HydrophobicContact CB-CE2 3.66Å; L1034-F1036 HydrophobicContact CB-CZ 4.23Å; L1034-F1036 HydrophobicContact CD1-CE2 4.06Å; L1034-F1036 HydrophobicContact CD1-CZ 4.21Å; L1034-F1036 HydrophobicContact CD2-CZ 4.42Å; L1034-F1036 HydrophobicContact CG-CE2 4.34Å
1037	G	30.7	Very low	29.3	Very low	66 Å²	66	146 Å²	146	68%	0.68	77%	0.77	S	S	*	*			trans	-82.4	147.7	161.2	0	0	0	0	0	110.7	I1039	G1037-I1039 PolarHBondContact O-N 3.03Å
1038	I	29	Very low	29.2	Very low	172 Å²	172	145.6 Å²	145.6	88%	0.882	76%	0.758	S	S	*	*			trans	-71.2	123.7	-179	-58.8	170.8	0	0	0	109.5
1039	I	30.9	Very low	29.3	Very low	156 Å²	156	144.7 Å²	144.7	80%	0.8	75%	0.752	S	S	*	*			trans	-122.3	115	170.7	-62.2	178.3	0	0	0	107.9	G1037	G1037-I1039 PolarHBondContact O-N 3.03Å
1040	T	30.7	Very low	29.3	Very low	117 Å²	117	142 Å²	142	72%	0.718	75%	0.747	S	S	*	*			trans	-70.7	143.8	167.1	42.5	0	0	0	0	110.1
1041	P	29.1	Very low	29.5	Very low	113 Å²	113	144.7 Å²	144.7	73%	0.734	75%	0.752	S	S	*	*			trans	-74.9	144.7	-173.1	32.4	-36.3	0	0	0	111.8
1042	E	32.3	Very low	29.7	Very low	180 Å²	180	139 Å²	139	84%	0.841	74%	0.743	S	S	*	*				-171.3	169.7	102.6	-102.3	176.2	-162.5	0	0	113.9
1043	T	31.5	Very low	29.7	Very low	124 Å²	124	142 Å²	142	76%	0.761	75%	0.748	S	S	*	*			trans	-45.5	159.6	177.7	48.8	0	0	0	0	116.9
1044	S	26.6	Very low	29.9	Very low	85 Å²	85	143.9 Å²	143.9	59%	0.594	75%	0.749	S	S	*	*			cis	-176	178.3	-12.3	58.1	0	0	0	0	109.6
1045	Q	32.2	Very low	30	Very low	173 Å²	173	145.4 Å²	145.4	81%	0.808	76%	0.758	S	S	*	*			trans	73.4	147.7	162.1	-66.4	170.1	63.2	0	0	118.5
1046	Y	27.6	Very low	30	Very low	185 Å²	185	142.5 Å²	142.5	73%	0.725	76%	0.755	S	S	*	*			cis	-169.4	131.7	-31	-143.4	-96.3	0	0	0	109.6
1047	R	28.4	Very low	30	Very low	202 Å²	202	141 Å²	141	76%	0.762	76%	0.758	S	S	*	*			trans	61	164.9	164.2	-82.8	-179.2	175.6	151.6	-2.2	118.4
1048	N	29.6	Very low	29.8	Very low	107 Å²	107	148.8 Å²	148.8	57%	0.572	77%	0.767	S	S	*	*			cis	-153.9	148.4	-34.8	-122.5	29.5	0	0	0	110.4
1049	E	29	Very low	30	Very low	155 Å²	155	151.9 Å²	151.9	72%	0.724	77%	0.768	S	S	*	*			trans	43.3	142.8	138.3	-65.5	164.1	179.8	0	0	123.6
1050	S	30.3	Very low	29.8	Very low	108 Å²	108	150.5 Å²	150.5	76%	0.755	76%	0.762	S	S	*	*			trans	79.4	145.5	142.4	78.2	0	0	0	0	119.3
1051	Y	29.9	Very low	30.1	Very low	216 Å²	216	151.5 Å²	151.5	85%	0.847	76%	0.763	S	S	*	*			cis	-157.1	161	-3.7	-139.7	-129.2	0	0	0	113.1
1052	S	31.3	Very low	30.1	Very low	93 Å²	93	152 Å²	152	65%	0.65	76%	0.76	S	S	*	*			trans	38.7	132	150.7	62.8	0	0	0	0	124.2
1053	D	29.4	Very low	30.2	Very low	148 Å²	148	150.5 Å²	150.5	79%	0.791	76%	0.756	S	S	*	*			trans	-15.5	140.9	141.7	-80	-58.9	0	0	0	118.5
1054	M	31.4	Very low	30.2	Very low	178 Å²	178	152.2 Å²	152.2	88%	0.877	76%	0.755	S	S	*	*				-178.2	140.4	106.6	-97.4	-66.9	178.4	0	0	112.9
1055	N	30.8	Very low	30.5	Very low	165 Å²	165	153.8 Å²	153.8	88%	0.882	76%	0.757	S	S	*	*			trans	-88.1	118.4	167	-89.7	-59.5	0	0	0	110.8
1056	A	28.9	Very low	30.4	Very low	90 Å²	90	151.7 Å²	151.7	74%	0.744	75%	0.75	S	S	*	*			trans	-174.1	165.6	147.4	0	0	0	0	0	112.7
1057	V	31	Very low	30.6	Very low	127 Å²	127	148.4 Å²	148.4	77%	0.77	75%	0.745	S	S	*	*			trans	59.7	98.8	162.8	-164.8	0	0	0	0	115.8
1058	R	25.8	Very low	30.7	Very low	230 Å²	230	144.7 Å²	144.7	87%	0.868	74%	0.74	S	S	*	*				64.5	78.5	59.7	-164.3	-155.1	-166.3	-175.8	7.1	114.7
1059	W	32.9	Very low	30.8	Very low	237 Å²	237	144.8 Å²	144.8	90%	0.898	74%	0.744	S	S	*	*			trans	-144.7	128.2	144.1	-98.7	12.4	0	0	0	106.4
1060	N	28.2	Very low	30.9	Very low	127 Å²	127	144.8 Å²	144.8	68%	0.679	74%	0.744	S	S	*	*				54.4	85.1	64.8	-83.8	30.9	0	0	0	114
1061	N	35.1	Very low	30.8	Very low	138 Å²	138	146.3 Å²	146.3	74%	0.738	75%	0.749	S	S	*	*				-158.2	120.5	115.8	-89.6	-39.9	0	0	0	107.1
1062	N	29.3	Very low	30.9	Very low	125 Å²	125	139.4 Å²	139.4	67%	0.668	74%	0.744	S	S	*	*				92.7	149.6	58.8	-94.4	-30.9	0	0	0	111.7
1063	I	35.4	Very low	30.7	Very low	148 Å²	148	140.3 Å²	140.3	76%	0.759	75%	0.75	S	S	*	*			trans	71.4	98.9	176.8	-59	145.7	0	0	0	111.7
1064	H	31.3	Very low	30.6	Very low	159 Å²	159	138 Å²	138	74%	0.736	75%	0.745	S	S	*	*				82.2	151.7	66.3	-100.7	-101.2	0	0	0	113.8
1065	D	32.1	Very low	30.5	Very low	119 Å²	119	139.7 Å²	139.7	64%	0.636	74%	0.742	S	S	*	*			trans	75.9	143.2	146.4	-69.2	-0.6	0	0	0	120.3
1066	I	31.2	Very low	30.5	Very low	129 Å²	129	137.6 Å²	137.6	66%	0.662	73%	0.73	S	S	*	*			cis	-159.1	158.4	-28.2	-146.3	169.4	0	0	0	109.4
1067	D	31.6	Very low	30.4	Very low	115 Å²	115	139.5 Å²	139.5	62%	0.615	72%	0.724	S	S	*	*			trans	68.2	149	145.3	-91.5	16.4	0	0	0	124.7
1068	N	30.6	Very low	30.2	Very low	124 Å²	124	141 Å²	141	66%	0.663	72%	0.72	S	S	*	*			trans	72.4	133.9	138.1	-63	-19.1	0	0	0	120.9
1069	T	31.7	Very low	30.2	Very low	109 Å²	109	136.6 Å²	136.6	67%	0.669	71%	0.713	S	S	*	*			cis	-154.6	149.9	-6.7	1.5	0	0	0	0	114.2
1070	H	29.9	Very low	30	Very low	156 Å²	156	130.3 Å²	130.3	72%	0.722	70%	0.704	S	S	*	*			trans	20.1	127.3	137.5	-65.4	-37.8	0	0	0	122.5
1071	T	29.7	Very low	29.9	Very low	140 Å²	140	129.2 Å²	129.2	86%	0.859	71%	0.706	S	S	*	*			trans	67.9	155.8	133	63.7	0	0	0	0	118.6
1072	G	31.7	Very low	29.6	Very low	71 Å²	71	129.4 Å²	129.4	73%	0.732	71%	0.705	S	S	*	*			cis	166.8	170.8	-9	0	0	0	0	0	113.5
1073	S	27.4	Very low	29.6	Very low	111 Å²	111	129.5 Å²	129.5	78%	0.776	71%	0.706	S	S	*	*			trans	-7.5	122.3	167.8	-160.7	0	0	0	0	120
1074	S	27.8	Very low	29.3	Very low	99 Å²	99	128 Å²	128	69%	0.692	70%	0.699	S	S	*	*			trans	85.1	139.9	135.3	81.6	0	0	0	0	122
1075	R	27.6	Very low	29.1	Very low	215 Å²	215	126 Å²	126	81%	0.811	70%	0.699	S	S	*	*			trans	72.5	140.1	138.4	-116	178	179.7	160	0.7	119.4
1076	N	30.6	Very low	29.1	Very low	120 Å²	120	126.3 Å²	126.3	64%	0.642	70%	0.704	S	S	*	*			trans	69.7	151.4	154.7	-62.4	-28.9	0	0	0	116.2
1077	Q	27.8	Very low	29.2	Very low	131 Å²	131	125.4 Å²	125.4	61%	0.612	71%	0.705	S	S	*	*			cis	-162.2	158.1	-28.2	-121.7	176.8	65.2	0	0	107.5
1078	K	27.2	Very low	29.1	Very low	157 Å²	157	127 Å²	127	68%	0.683	71%	0.714	S	S	*	*			trans	59.7	124.3	142.9	-75.5	177.1	174.6	163.9	0	121.6
1079	I	26.3	Very low	29.2	Very low	139 Å²	139	124.7 Å²	124.7	71%	0.713	71%	0.712	S	S	*	*				83.4	147.2	121.1	-67.2	173	0	0	0	119
1080	C	27.4	Very low	29.2	Very low	105 Å²	105	126.2 Å²	126.2	71%	0.709	72%	0.716	S	S	*	*			trans	66.4	108.1	177.4	-71.5	0	0	0	0	114.3
1081	S	27	Very low	29.3	Very low	104 Å²	104	124.5 Å²	124.5	73%	0.727	71%	0.712	S	S	*	*			cis	74.1	149.5	34.3	-41.4	0	0	0	0	115.1
1082	I	28	Very low	29.5	Very low	142 Å²	142	123.7 Å²	123.7	73%	0.728	70%	0.702	S	S	*	*			trans	82.6	114.7	149.6	-81.1	165.7	0	0	0	116.9
1083	N	29	Very low	29.6	Very low	127 Å²	127	127.2 Å²	127.2	68%	0.679	71%	0.705	S	S	*	*			trans	76	150.7	144.8	-66.7	16.5	0	0	0	118.5
1084	N	28.8	Very low	29.9	Very low	116 Å²	116	127.2 Å²	127.2	62%	0.62	70%	0.704	S	S	*	*			cis	-161.8	145	-5.6	-120.8	-0.9	0	0	0	112.6
1085	T	28.3	Very low	30.1	Very low	118 Å²	118	130.3 Å²	130.3	72%	0.724	71%	0.708	S	S	*	*			trans	58.8	163.6	149.7	60.1	0	0	0	0	117.4
1086	V	31.1	Very low	30.2	Very low	124 Å²	124	125.7 Å²	125.7	75%	0.752	70%	0.699	S	S	*	*			cis	-146.3	162	5.2	-127.3	0	0	0	0	106.1
1087	T	34	Very low	30.1	Very low	110 Å²	110	126.3 Å²	126.3	68%	0.675	70%	0.702	S	S	*	*			cis	-152.6	174.6	11	-21.8	0	0	0	0	110
1088	N	29.7	Very low	30.3	Very low	150 Å²	150	127.3 Å²	127.3	80%	0.802	71%	0.711	S	S	*	*			trans	13.1	142.3	146.4	-65.8	2.6	0	0	0	122.2
1089	A	32.4	Very low	30.3	Very low	75 Å²	75	125.5 Å²	125.5	62%	0.62	71%	0.709	S	S	*	*			cis	-169.5	151.8	-8.9	0	0	0	0	0	112.8
1090	N	32.2	Very low	30.6	Very low	141 Å²	141	125.4 Å²	125.4	75%	0.754	71%	0.71	S	S	*	*			trans	61.7	144.8	154	-61.6	3.9	0	0	0	119.2
1091	N	32.6	Very low	30.6	Very low	120 Å²	120	124.5 Å²	124.5	64%	0.642	70%	0.704	S	S	*	*			cis	-161.1	151.2	-12.4	-116.2	-4.7	0	0	0	111.4
1092	N	33.4	Very low	30.7	Very low	122 Å²	122	129.9 Å²	129.9	65%	0.652	71%	0.71	S	S	*	*			trans	60.5	132.5	156.9	-59.5	-26.5	0	0	0	119
1093	N	32.8	Very low	30.7	Very low	146 Å²	146	128.2 Å²	128.2	78%	0.781	71%	0.71	S	S	*	*				70.9	138.1	52	-67.7	-33.7	0	0	0	114.1
1094	S	33.3	Very low	30.8	Very low	110 Å²	110	127.3 Å²	127.3	77%	0.769	71%	0.714	S	S	*	*			cis	-168.5	166.5	-9.7	49.3	0	0	0	0	113.2
1095	H	33.1	Very low	30.8	Very low	165 Å²	165	133 Å²	133	76%	0.764	73%	0.727	S	S	*	*			trans	-44.3	152.3	173.6	-95.4	-84.9	0	0	0	120.5
1096	N	29.5	Very low	30.9	Very low	117 Å²	117	134.9 Å²	134.9	63%	0.626	73%	0.73	S	S	*	*			trans	90.7	124	132.3	-74.1	-3.4	0	0	0	124.5
1097	N	28.9	Very low	30.7	Very low	133 Å²	133	140 Å²	140	71%	0.711	74%	0.738	S	S	*	*			trans	72.8	167.6	130.8	-64.7	-8.1	0	0	0	121.2
1098	L	30.6	Very low	30.4	Very low	153 Å²	153	138 Å²	138	80%	0.801	74%	0.739	S	S	*	*			trans	78.7	136.2	167.5	-53.8	-179	0	0	0	114.2
1099	N	28.6	Very low	30.2	Very low	119 Å²	119	137 Å²	137	64%	0.636	74%	0.739	S	S	*	*			cis	-164.2	-179.9	-9.4	-141.9	31.9	0	0	0	111.1
1100	D	31.5	Very low	29.9	Very low	136 Å²	136	140.8 Å²	140.8	73%	0.727	75%	0.748	S	S	*	*			trans	68	155.7	147.7	-69.2	-35.9	0	0	0	119.6
1101	S	28.3	Very low	29.6	Very low	86 Å²	86	139.3 Å²	139.3	60%	0.601	74%	0.744	S	S	*	*			cis	-166.3	138.2	-23.6	178.5	0	0	0	0	111.5
1102	Y	28.4	Very low	29.4	Very low	217 Å²	217	140 Å²	140	85%	0.851	75%	0.748	S	S	*	*			trans	72.8	162.1	152.7	-90.2	-133.4	0	0	0	122.1
1103	C	28.9	Very low	29.1	Very low	107 Å²	107	139.2 Å²	139.2	72%	0.723	75%	0.747	S	S	*	*			trans	80.6	97.3	159	-74	0	0	0	0	122.1
1104	S	31.1	Very low	29	Very low	108 Å²	108	140.2 Å²	140.2	76%	0.755	75%	0.752	S	S	*	*				94.1	88.9	119.6	-57.9	0	0	0	0	121.6
1105	R	27.6	Very low	28.9	Very low	236 Å²	236	141.9 Å²	141.9	89%	0.891	75%	0.747	S	S	*	*				39.5	110.8	121.7	-77.2	-176.2	172.8	176.7	-1.5	119.3
1106	I	31.5	Very low	28.6	Very low	157 Å²	157	137.4 Å²	137.4	81%	0.805	74%	0.735	S	S	*	*				167.4	144	112.3	-88.6	153.1	0	0	0	112
1107	Y	26.9	Very low	28.8	Very low	231 Å²	231	139.8 Å²	139.8	91%	0.906	74%	0.741	S	S	*	*			trans	-24	134.3	176.2	-67.5	-98.7	0	0	0	119.8
1108	G	26.5	Very low	28.7	Very low	68 Å²	68	137.6 Å²	137.6	70%	0.701	74%	0.737	S	S	*	*			trans	161.1	110.1	154.5	0	0	0	0	0	117.7
1109	T	25.7	Very low	28.8	Very low	130 Å²	130	138.4 Å²	138.4	80%	0.798	74%	0.74	S	S	*	*			trans	41.2	130.6	144.5	52.7	0	0	0	0	124.2
1110	L	25.6	Very low	28.8	Very low	154 Å²	154	140.9 Å²	140.9	81%	0.806	75%	0.748	S	S	*	*			trans	82.5	148.5	136.9	-72.4	168.5	0	0	0	123.2
1111	T	27.4	Very low	28.7	Very low	111 Å²	111	140.3 Å²	140.3	68%	0.681	75%	0.754	S	S	*	*			trans	71.7	121.5	150.8	42.3	0	0	0	0	123.4
1112	D	27.3	Very low	29	Very low	134 Å²	134	142 Å²	142	72%	0.717	76%	0.764	S	S	*	*				77.3	112	124.2	-57.9	-7.1	0	0	0	125
1113	T	27.9	Very low	29.1	Very low	105 Å²	105	137.7 Å²	137.7	64%	0.644	76%	0.764	S	S	*	*			trans	51.2	116.2	134.7	60.8	0	0	0	0	122.6	H1115	T1113-H1115 PolarHBondContact O-ND1 3.1Å
1114	L	30.2	Very low	29.3	Very low	167 Å²	167	140 Å²	140	87%	0.874	76%	0.764	S	S	*	*			trans	-112.9	130.8	137.2	-65.6	168.2	0	0	0	107.2
1115	H	31.5	Very low	29.3	Very low	146 Å²	146	140 Å²	140	68%	0.676	76%	0.755	S	S	*	*			cis	66.8	132.9	48.5	-67.5	99.5	0	0	0	113.2	T1113	T1113-H1115 PolarHBondContact O-ND1 3.1Å
1116	S	27.7	Very low	29.4	Very low	71 Å²	71	136.9 Å²	136.9	50%	0.497	75%	0.75	S	S	.	*			cis	-173.6	-169.9	-20.9	32	0	0	0	0	108.1
1117	H	31.8	Very low	29.3	Very low	166 Å²	166	138.9 Å²	138.9	77%	0.769	75%	0.754	S	S	*	*			trans	78.3	153.9	166	-46.3	-66	0	0	0	117.1
1118	S	28.5	Very low	29.4	Very low	88 Å²	88	133.5 Å²	133.5	62%	0.615	75%	0.75	S	S	*	*			cis	-170.6	159.8	-26.4	-94.4	0	0	0	0	107.8
1119	I	32	Very low	29.6	Very low	169 Å²	169	133.1 Å²	133.1	87%	0.867	75%	0.746	S	S	*	*			trans	-178.7	134.3	133.6	-94.4	153	0	0	0	108.5
1120	E	28.8	Very low	29.9	Very low	171 Å²	171	135.2 Å²	135.2	80%	0.799	75%	0.746	S	S	*	*			trans	-107.3	164.5	-177.5	-58.4	152.9	103.3	0	0	111.1
1121	S	29.4	Very low	30	Very low	124 Å²	124	133 Å²	133	87%	0.867	74%	0.739	S	S	*	*				-172.8	141.8	129.9	-82.7	0	0	0	0	112.7
1122	P	33.2	Very low	30.2	Very low	123 Å²	123	134.3 Å²	134.3	80%	0.799	75%	0.747	S	S	*	*			trans	-118.7	155.2	-174.7	40.9	-31.6	0	0	0	116.1
1123	C	32.2	Very low	30.4	Very low	126 Å²	126	132.4 Å²	132.4	85%	0.851	74%	0.744	S	S	*	*			trans	-168.4	157.7	169.9	-101.6	0	0	0	0	111.2
1124	H	32.9	Very low	30.6	Very low	156 Å²	156	131.5 Å²	131.5	72%	0.722	74%	0.742	S	S	*	*			cis	-164.5	159.6	-34.8	-147.3	25.7	0	0	0	111.7
1125	N	31.6	Very low	30.7	Very low	107 Å²	107	130.4 Å²	130.4	57%	0.572	74%	0.737	S	S	*	*			trans	24.5	120.5	157.4	-60	-12.5	0	0	0	124.3
1126	H	28.7	Very low	30.8	Very low	171 Å²	171	131.5 Å²	131.5	79%	0.792	75%	0.748	S	S	*	*				50.6	161.8	119.6	-71.8	-77	0	0	0	125
1127	F	29.9	Very low	30.8	Very low	199 Å²	199	133.3 Å²	133.3	87%	0.873	76%	0.76	S	S	*	*			trans	87.5	145.2	171.4	-66.7	-88.8	0	0	0	118.1
1128	S	27.9	Very low	31	Very low	118 Å²	118	132 Å²	132	83%	0.825	76%	0.763	S	S	*	*			cis	164.1	146.5	-49.7	175.9	0	0	0	0	110.7
1129	G	30.6	Very low	31.1	Very low	60 Å²	60	134.6 Å²	134.6	62%	0.619	77%	0.771	S	S	*	*			trans	101.3	151.3	179.7	0	0	0	0	0	113.2
1130	H	32.3	Very low	31	Very low	173 Å²	173	131.4 Å²	131.4	80%	0.801	76%	0.762	S	S	*	*			cis	-151.1	118.4	4.2	-101.5	-80.4	0	0	0	109.3
1131	T	28.8	Very low	31.1	Very low	108 Å²	108	131.3 Å²	131.3	66%	0.663	76%	0.762	S	S	*	*				76.2	128.6	91.7	61.3	0	0	0	0	118.7
1132	V	31.3	Very low	31.1	Very low	138 Å²	138	132.7 Å²	132.7	84%	0.836	76%	0.759	S	S	*	*			trans	63.6	154.3	163.8	-107.1	0	0	0	0	118.5
1133	S	30.9	Very low	31.2	Very low	94 Å²	94	133.8 Å²	133.8	66%	0.657	76%	0.757	S	S	*	*			cis	-156.6	145.7	3	-162.6	0	0	0	0	116
1134	S	31.4	Very low	31.2	Very low	86 Å²	86	136 Å²	136	60%	0.601	76%	0.759	S	S	*	*			trans	51.6	126.8	138.6	63.7	0	0	0	0	125.3
1135	N	32.3	Very low	31.2	Very low	144 Å²	144	138 Å²	138	77%	0.77	76%	0.76	S	S	*	*			trans	69.7	117.4	136	-53.5	1.3	0	0	0	119.3
1136	N	33.6	Very low	31.2	Very low	169 Å²	169	139.2 Å²	139.2	90%	0.904	77%	0.767	S	S	*	*				-159.3	166.7	75.2	-96.6	-24.6	0	0	0	113.7
1137	S	28.8	Very low	31.5	Very low	109 Å²	109	139.4 Å²	139.4	76%	0.762	77%	0.768	S	S	*	*			trans	-127.7	125.8	-169.6	56.5	0	0	0	0	115.1
1138	V	35.6	Very low	31.8	Very low	138 Å²	138	135 Å²	135	84%	0.836	76%	0.761	S	S	*	*			trans	-148.1	117.9	152.6	-171	0	0	0	0	104.8
1139	N	30.5	Very low	32.1	Very low	143 Å²	143	134.9 Å²	134.9	77%	0.765	75%	0.752	S	S	*	*			cis	86.8	146.5	46.2	-139.2	66.1	0	0	0	113.3
1140	C	30.5	Very low	32.6	Very low	103 Å²	103	136.6 Å²	136.6	70%	0.696	76%	0.76	S	S	*	*			trans	55.7	123.1	-159.2	68.3	0	0	0	0	115.2
1141	E	31.1	Very low	33.1	Very low	168 Å²	168	133.5 Å²	133.5	79%	0.785	75%	0.749	S	S	*	*			cis	87.1	141.9	40.6	-65.1	171.2	128.9	0	0	114.1
1142	D	29.6	Very low	34.2	Very low	153 Å²	153	133.8 Å²	133.8	82%	0.818	75%	0.746	S	S	*	*			trans	49.3	110.8	172.9	-58.7	-19.6	0	0	0	117.4
1143	I	34.3	Very low	35.4	Very low	147 Å²	147	131.5 Å²	131.5	75%	0.754	73%	0.734	S	S	*	*				-162.2	134.5	72	-86.6	159.6	0	0	0	110	R1145	I1143-R1145 HydrophobicContact CG2-CB 3.94Å
1144	I	32	Very low	36.3	Very low	172 Å²	172	131.4 Å²	131.4	88%	0.882	73%	0.734	S	S	*	*			trans	-84.3	127.5	158.6	-62.3	172.5	0	0	0	107.6
1145	R	33.8	Very low	37.9	Very low	198 Å²	198	132 Å²	132	75%	0.747	73%	0.73	S	S	*	*			trans	-145.7	134.7	169.7	-141.9	-178.2	72.3	-179.6	-0.3	110.7	I1143 E1147	I1143-R1145 HydrophobicContact CG2-CB 3.94Å; R1145-E1147 PolarHBondContact O-N 3.39Å
1146	D	31.5	Very low	39.3	Very low	133 Å²	133	132 Å²	132	71%	0.711	72%	0.72	S	S	*	*			trans	-63.1	131.2	173.4	-66.4	-73.9	0	0	0	111.2
1147	E	35.6	Very low	41	Very low	175 Å²	175	127.4 Å²	127.4	82%	0.818	70%	0.698	S	S	*	*			trans	-104	54.3	159.8	-67	-150.4	135.3	0	0	110.1	R1145 D1149	R1145-E1147 PolarHBondContact O-N 3.39Å; E1147-D1149 PolarHBondContact O-N 3.35Å
1148	S	34.7	Very low	42.9	Very low	105 Å²	105	124.1 Å²	124.1	73%	0.734	68%	0.678	S	S	*	*			trans	-84.5	40.5	174	70.2	0	0	0	0	112.6
1149	D	35.8	Very low	44.8	Very low	117 Å²	117	121.6 Å²	121.6	63%	0.626	66%	0.658	S	S	*	*			trans	-147.1	57.1	176.7	-148.3	12	0	0	0	111	R854 E1147 D1151	R854-D1149 IonicContact NH1-OD2 3.64Å; E1147-D1149 PolarHBondContact O-N 3.35Å; D1149-D1151 PolarHBondContact O-N 2.88Å
1150	A	40.9	Very low	46.9	Very low	96 Å²	96	117.2 Å²	117.2	79%	0.793	64%	0.638	S	S	*	*			trans	-72	78.3	172.6	0	0	0	0	0	110.5	L1152	A1150-L1152 PolarHBondContact O-N 3.42Å
1151	D	43.2	Very low	49.2	Very low	108 Å²	108	116.8 Å²	116.8	58%	0.578	63%	0.626	S	S	*	*			trans	-45	126.1	171.4	-100.1	-31.4	0	0	0	109.8	R854 D1149	R854-D1151 IonicContact CZ-OD1 3.97Å; R854-D1151 IonicContact NH2-OD1 3.4Å; R854-D1151 PolarHBondContact NH2-OD1 3.34Å; R854-D1151 IonicContact NH2-OD2 2.62Å; R854-D1151 PolarHBondContact NH2-OD2 3.11Å; D1149-D1151 PolarHBondContact O-N 2.88Å
1152	L	51	Low	51.6	Low	113 Å²	113	114.4 Å²	114.4	59%	0.592	62%	0.618	S	S	*	*			trans	-56.7	137.8	-179.5	-83	80.6	0	0	0	109.5	A1150 S1154 Y1156	A1150-L1152 PolarHBondContact O-N 3.42Å; L1152-S1154 PolarHBondContact O-N 2.92Å; L1152-Y1156 HydrophobicContact CD2-CD1 4.03Å
1153	P	56.4	Low	54	Low	91 Å²	91	112.5 Å²	112.5	59%	0.591	61%	0.605	S	S	*	*			trans	-48.6	131	177.8	-28.8	34.7	0	0	0	110.7	N1155 Y1156	P1153-N1155 PolarHBondContact O-N 2.84Å; P1153-Y1156 WeakPolarHBondContact O-CA 3.37Å; P1153-Y1156 VanDerWaalsContact O-CB 3.3Å; P1153-Y1156 WeakPolarHBondContact O-CB 3.45Å; P1153-Y1156 PolarHBondContact O-N 3.18Å
1154	S	50	Low	56.1	Low	92 Å²	92	108 Å²	108	64%	0.643	58%	0.584	S	S	*	*	H	α-helix	trans	-53.5	-32.3	-176.5	52.4	0	0	0	0	112.8	L1152 Y1156 V1157 A1158	L1152-S1154 PolarHBondContact O-N 2.92Å; S1154-Y1156 VanDerWaalsContact C-N 3.29Å; S1154-Y1156 PolarHBondContact O-N 2.92Å; S1154-V1157 PolarHBondContact O-N 3.28Å; S1154-A1158 WeakPolarHBondContact O-CB 3.49Å; S1154-A1158 PolarHBondContact O-N 3.03Å
1155	N	63.8	Low	58.6	Low	98 Å²	98	105.1 Å²	105.1	52%	0.524	57%	0.57	S	S	.	*	H	α-helix	trans	-54.4	-39.1	170.5	-66.2	-15.7	0	0	0	113.2	P1153 A1158 I1159	P1153-N1155 PolarHBondContact O-N 2.84Å; N1155-A1158 PolarHBondContact O-N 3.2Å; N1155-I1159 WeakPolarHBondContact O-CB 3.26Å; N1155-I1159 WeakPolarHBondContact O-CD1 3.29Å; N1155-I1159 WeakPolarHBondContact O-CG1 3.49Å; N1155-I1159 PolarHBondContact O-N 3.03Å
1156	Y	62	Low	60.7	Low	143 Å²	143	98.2 Å²	98.2	56%	0.561	56%	0.555	S	S	*	*	H	α-helix	trans	-69.5	-43.2	179.8	-153.7	-82.6	0	0	0	111.5	L1152 P1153 S1154 I1159 C1160	L1152-Y1156 HydrophobicContact CD2-CD1 4.03Å; P1153-Y1156 WeakPolarHBondContact O-CA 3.37Å; P1153-Y1156 VanDerWaalsContact O-CB 3.3Å; P1153-Y1156 WeakPolarHBondContact O-CB 3.45Å; P1153-Y1156 PolarHBondContact O-N 3.18Å; S1154-Y1156 VanDerWaalsContact C-N 3.29Å; S1154-Y1156 PolarHBondContact O-N 2.92Å; Y1156-I1159 PolarHBondContact O-N 3.22Å; Y1156-C1160 PolarHBondContact O-N 2.78Å; Y1156-C1160 PolarHBondContact O-SG 2.86Å; Y1156-C1160 VanDerWaalsContact O-SG 3.38Å
1157	V	70.8	Confident	62.9	Low	74 Å²	74	97.2 Å²	97.2	45%	0.448	55%	0.547	S	S	.	.	H	α-helix	trans	-61.9	-44.9	173.7	-178.2	0	0	0	0	110.4	S1154 I1159 C1160 Q1161	S1154-V1157 PolarHBondContact O-N 3.28Å; V1157-I1159 VanDerWaalsContact C-N 3.35Å; V1157-I1159 PolarHBondContact O-N 2.86Å; V1157-C1160 PolarHBondContact O-N 3.22Å; V1157-Q1161 WeakPolarHBondContact O-CG 3.49Å; V1157-Q1161 PolarHBondContact O-N 2.89Å
1158	A	68.5	Low	64.9	Low	40 Å²	40	93.1 Å²	93.1	33%	0.331	52%	0.524	S	S	.	.	H	α-helix	trans	-62.7	-37.8	176.1	0	0	0	0	0	112.8	S1154 N1155 Q1161 L1162	S1154-A1158 WeakPolarHBondContact O-CB 3.49Å; S1154-A1158 PolarHBondContact O-N 3.03Å; N1155-A1158 PolarHBondContact O-N 3.2Å; A1158-Q1161 PolarHBondContact O-N 3.38Å; A1158-L1162 WeakPolarHBondContact O-CB 3.35Å; A1158-L1162 PolarHBondContact O-N 3.47Å
1159	I	74.4	Confident	66.9	Low	84 Å²	84	91 Å²	91	43%	0.431	51%	0.513	S	S	.	.	H	α-helix	trans	-65.1	-45.1	173.6	-73.9	161.9	0	0	0	110.7	N1155 Y1156 V1157 Q1161 L1162 Q1163	N1155-I1159 WeakPolarHBondContact O-CB 3.26Å; N1155-I1159 WeakPolarHBondContact O-CD1 3.29Å; N1155-I1159 WeakPolarHBondContact O-CG1 3.49Å; N1155-I1159 PolarHBondContact O-N 3.03Å; Y1156-I1159 PolarHBondContact O-N 3.22Å; V1157-I1159 VanDerWaalsContact C-N 3.35Å; V1157-I1159 PolarHBondContact O-N 2.86Å; I1159-Q1161 VanDerWaalsContact C-N 3.34Å; I1159-Q1161 PolarHBondContact O-N 3.22Å; I1159-L1162 PolarHBondContact O-N 3.25Å; I1159-Q1163 HydrophobicContact CG2-CG 4.4Å; I1159-Q1163 WeakPolarHBondContact O-CB 3.23Å; I1159-Q1163 VanDerWaalsContact O-CG 3.31Å; I1159-Q1163 WeakPolarHBondContact O-CG 3.42Å; I1159-Q1163 PolarHBondContact O-N 2.86Å
1160	C	74.5	Confident	68.8	Low	51 Å²	51	89.8 Å²	89.8	35%	0.345	51%	0.51	S	S	.	.	H	α-helix	trans	-63.1	-38.4	176	-69.6	0	0	0	0	112.3	Y1156 V1157 T1164	Y1156-C1160 PolarHBondContact O-N 2.78Å; Y1156-C1160 PolarHBondContact O-SG 2.86Å; Y1156-C1160 VanDerWaalsContact O-SG 3.38Å; V1157-C1160 PolarHBondContact O-N 3.22Å; C1160-T1164 VanDerWaalsContact O-CB 3.3Å; C1160-T1164 WeakPolarHBondContact O-CB 3.43Å; C1160-T1164 PolarHBondContact O-N 2.97Å; C1160-T1164 PolarHBondContact O-OG1 3.04Å
1161	Q	78.4	Confident	70.4	Confident	94 Å²	94	90.5 Å²	90.5	44%	0.439	50%	0.5	S	S	.	.	H	α-helix	trans	-65.9	-45.4	173.1	-75.3	177.1	-30.9	0	0	111.7	V1157 A1158 I1159 Q1163 T1164 L1165	V1157-Q1161 WeakPolarHBondContact O-CG 3.49Å; V1157-Q1161 PolarHBondContact O-N 2.89Å; A1158-Q1161 PolarHBondContact O-N 3.38Å; I1159-Q1161 VanDerWaalsContact C-N 3.34Å; I1159-Q1161 PolarHBondContact O-N 3.22Å; Q1161-Q1163 PolarHBondContact O-N 3.45Å; Q1161-T1164 PolarHBondContact O-N 3.27Å; Q1161-L1165 WeakPolarHBondContact O-CB 3.27Å; Q1161-L1165 PolarHBondContact O-N 3.31Å
1162	L	81.6	Confident	71.9	Confident	118 Å²	118	89.7 Å²	89.7	62%	0.618	50%	0.503	S	S	*	.	H	α-helix	trans	-61.8	-41.7	175.3	-89.1	161.4	0	0	0	112.7	A1158 I1159 A1166	A1158-L1162 WeakPolarHBondContact O-CB 3.35Å; A1158-L1162 PolarHBondContact O-N 3.47Å; I1159-L1162 PolarHBondContact O-N 3.25Å; L1162-A1166 WeakPolarHBondContact O-CB 3.32Å; L1162-A1166 PolarHBondContact O-N 3.24Å
1163	Q	80.5	Confident	72.9	Confident	114 Å²	114	88.1 Å²	88.1	53%	0.533	51%	0.506	S	S	.	.	H	α-helix	trans	-64.9	-40	173.9	-73.9	178	-2.9	0	0	111.6	I1159 Q1161 A1166 M1167	I1159-Q1163 HydrophobicContact CG2-CG 4.4Å; I1159-Q1163 WeakPolarHBondContact O-CB 3.23Å; I1159-Q1163 VanDerWaalsContact O-CG 3.31Å; I1159-Q1163 WeakPolarHBondContact O-CG 3.42Å; I1159-Q1163 PolarHBondContact O-N 2.86Å; Q1161-Q1163 PolarHBondContact O-N 3.45Å; Q1163-A1166 PolarHBondContact O-N 3.29Å; Q1163-M1167 HydrophobicContact CB-CE 4.43Å; Q1163-M1167 WeakPolarHBondContact O-CB 3.28Å; Q1163-M1167 WeakPolarHBondContact O-CE 3.49Å; Q1163-M1167 WeakPolarHBondContact O-CG 3.49Å; Q1163-M1167 PolarHBondContact O-N 3.37Å
1164	T	79.7	Confident	73.4	Confident	53 Å²	53	88.6 Å²	88.6	33%	0.325	51%	0.507	S	S	.	.	H	α-helix	trans	-67.1	-43.6	176.7	-59.2	0	0	0	0	111.6	C1160 Q1161 M1167 R1168	C1160-T1164 VanDerWaalsContact O-CB 3.3Å; C1160-T1164 WeakPolarHBondContact O-CB 3.43Å; C1160-T1164 PolarHBondContact O-N 2.97Å; C1160-T1164 PolarHBondContact O-OG1 3.04Å; Q1161-T1164 PolarHBondContact O-N 3.27Å; T1164-M1167 PolarHBondContact O-N 2.85Å; T1164-R1168 WeakPolarHBondContact O-CG 3.47Å; T1164-R1168 PolarHBondContact O-N 2.93Å
1165	L	82.6	Confident	73.6	Confident	110 Å²	110	90.8 Å²	90.8	58%	0.576	52%	0.517	S	S	*	.	H	α-helix	trans	-64	-41.9	175.2	-163.8	92.3	0	0	0	111.3	Q1161 R1168 A1169	Q1161-L1165 WeakPolarHBondContact O-CB 3.27Å; Q1161-L1165 PolarHBondContact O-N 3.31Å; L1165-R1168 PolarHBondContact O-N 3.09Å; L1165-A1169 WeakPolarHBondContact O-CB 3.36Å; L1165-A1169 PolarHBondContact O-N 3.07Å
1166	A	78.3	Confident	74.1	Confident	53 Å²	53	90.5 Å²	90.5	44%	0.438	52%	0.517	S	S	.	.	H	α-helix	trans	-64.4	-41.7	174.6	0	0	0	0	0	111.8	L1162 Q1163 A1169 V1170	L1162-A1166 WeakPolarHBondContact O-CB 3.32Å; L1162-A1166 PolarHBondContact O-N 3.24Å; Q1163-A1166 PolarHBondContact O-N 3.29Å; A1166-A1169 PolarHBondContact O-N 2.92Å; A1166-V1170 WeakPolarHBondContact O-CB 3.2Å; A1166-V1170 WeakPolarHBondContact O-CG2 3.24Å; A1166-V1170 PolarHBondContact O-N 3.03Å
1167	M	78.5	Confident	74.7	Confident	112 Å²	112	87.7 Å²	87.7	55%	0.552	51%	0.514	S	S	*	.	H	α-helix	trans	-64.8	-41.7	173.5	-76.4	-173.9	-73.4	0	0	111.9	Q1163 T1164 V1170 L1171	Q1163-M1167 HydrophobicContact CB-CE 4.43Å; Q1163-M1167 WeakPolarHBondContact O-CB 3.28Å; Q1163-M1167 WeakPolarHBondContact O-CE 3.49Å; Q1163-M1167 WeakPolarHBondContact O-CG 3.49Å; Q1163-M1167 PolarHBondContact O-N 3.37Å; T1164-M1167 PolarHBondContact O-N 2.85Å; M1167-V1170 PolarHBondContact O-N 3.24Å; M1167-L1171 WeakPolarHBondContact O-CB 3.3Å; M1167-L1171 WeakPolarHBondContact O-CD1 3.42Å; M1167-L1171 WeakPolarHBondContact O-CG 3.14Å; M1167-L1171 PolarHBondContact O-N 3.49Å
1168	R	77.7	Confident	74.9	Confident	89 Å²	89	88.4 Å²	88.4	34%	0.336	52%	0.518	S	S	.	.	H	α-helix	trans	-60.8	-43.4	171.9	-75.9	-171.1	-170.7	143.4	13.2	111.9	E888 T1164 L1165 L1171 S1172	E888-R1168 IonicContact OE2-CZ 3.83Å; E888-R1168 IonicContact OE2-NH1 3.72Å; E888-R1168 PolarHBondContact OE2-NH1 3.49Å; E888-R1168 IonicContact OE2-NH2 3.79Å; E888-R1168 PolarHBondContact OE2-NH2 3.21Å; T1164-R1168 WeakPolarHBondContact O-CG 3.47Å; T1164-R1168 PolarHBondContact O-N 2.93Å; L1165-R1168 PolarHBondContact O-N 3.09Å; R1168-L1171 PolarHBondContact O-N 3.35Å; R1168-S1172 VanDerWaalsContact O-CB 3.25Å; R1168-S1172 WeakPolarHBondContact O-CB 3.5Å; R1168-S1172 PolarHBondContact O-N 3.43Å
1169	A	75.8	Confident	75.3	Confident	60 Å²	60	91.3 Å²	91.3	50%	0.496	53%	0.529	S	S	.	.	H	α-helix	trans	-66.4	-38.1	178.5	0	0	0	0	0	112.6	L1165 A1166 A1173	L1165-A1169 WeakPolarHBondContact O-CB 3.36Å; L1165-A1169 PolarHBondContact O-N 3.07Å; A1166-A1169 PolarHBondContact O-N 2.92Å; A1169-A1173 VanDerWaalsContact O-CB 3.25Å; A1169-A1173 WeakPolarHBondContact O-CB 3.34Å; A1169-A1173 PolarHBondContact O-N 2.88Å; A1169-A1173 VanDerWaalsContact O-N 3.08Å
1170	V	77.1	Confident	75.4	Confident	93 Å²	93	91.8 Å²	91.8	56%	0.564	54%	0.535	S	S	*	.	H	α-helix	trans	-68.4	-42.5	173.1	169.7	0	0	0	0	111.1	A1166 M1167 A1173 T1174	A1166-V1170 WeakPolarHBondContact O-CB 3.2Å; A1166-V1170 WeakPolarHBondContact O-CG2 3.24Å; A1166-V1170 PolarHBondContact O-N 3.03Å; M1167-V1170 PolarHBondContact O-N 3.24Å; V1170-A1173 CarbonylContact O-C 3.57Å; V1170-A1173 PolarHBondContact O-N 3.14Å; V1170-T1174 WeakPolarHBondContact O-CG2 3.17Å; V1170-T1174 PolarHBondContact O-N 2.81Å; V1170-T1174 VanDerWaalsContact O-N 3.13Å; V1170-T1174 PolarHBondContact O-OG1 3.28Å
1171	L	73.2	Confident	75.4	Confident	111 Å²	111	94.5 Å²	94.5	58%	0.581	55%	0.548	S	S	*	.	H	α-helix	trans	-60.2	-51.2	174.5	-73.7	165.8	0	0	0	110.8	M1167 R1168 A1173 T1174 T1175	M1167-L1171 WeakPolarHBondContact O-CB 3.3Å; M1167-L1171 WeakPolarHBondContact O-CD1 3.42Å; M1167-L1171 WeakPolarHBondContact O-CG 3.14Å; M1167-L1171 PolarHBondContact O-N 3.49Å; R1168-L1171 PolarHBondContact O-N 3.35Å; L1171-A1173 PolarHBondContact O-N 3.27Å; L1171-A1173 VanDerWaalsContact O-N 3.12Å; L1171-T1174 PolarHBondContact O-N 3.29Å; L1171-T1174 PolarHBondContact O-OG1 3.17Å; L1171-T1174 VanDerWaalsContact O-OG1 3.09Å; L1171-T1175 PolarHBondContact O-N 3.44Å; L1171-T1175 PolarHBondContact O-OG1 2.99Å
1172	S	75.9	Confident	75.2	Confident	91 Å²	91	94.5 Å²	94.5	64%	0.636	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	-9.8	176.9	-175.4	0	0	0	0	114.9	R1168 T1175	R1168-S1172 VanDerWaalsContact O-CB 3.25Å; R1168-S1172 WeakPolarHBondContact O-CB 3.5Å; R1168-S1172 PolarHBondContact O-N 3.43Å; S1172-T1175 WeakPolarHBondContact CA-OG1 3.38Å
1173	A	71.1	Confident	74.7	Confident	79 Å²	79	92.7 Å²	92.7	65%	0.653	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.8	2.4	172.6	0	0	0	0	0	112.9	A1169 V1170 L1171	A1169-A1173 VanDerWaalsContact O-CB 3.25Å; A1169-A1173 WeakPolarHBondContact O-CB 3.34Å; A1169-A1173 PolarHBondContact O-N 2.88Å; A1169-A1173 VanDerWaalsContact O-N 3.08Å; V1170-A1173 CarbonylContact O-C 3.57Å; V1170-A1173 PolarHBondContact O-N 3.14Å; L1171-A1173 PolarHBondContact O-N 3.27Å; L1171-A1173 VanDerWaalsContact O-N 3.12Å
1174	T	67.3	Low	74.2	Confident	101 Å²	101	90.9 Å²	90.9	62%	0.62	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.2	-14.6	177	52	0	0	0	0	114.1	V1170 L1171	V1170-T1174 WeakPolarHBondContact O-CG2 3.17Å; V1170-T1174 PolarHBondContact O-N 2.81Å; V1170-T1174 VanDerWaalsContact O-N 3.13Å; V1170-T1174 PolarHBondContact O-OG1 3.28Å; L1171-T1174 PolarHBondContact O-N 3.29Å; L1171-T1174 PolarHBondContact O-OG1 3.17Å; L1171-T1174 VanDerWaalsContact O-OG1 3.09Å
1175	T	53.4	Low	73.7	Confident	139 Å²	139	94.4 Å²	94.4	85%	0.853	57%	0.573	S	S	*	*			trans	-69	0	150.6	53	0	0	0	0	109.9	L1171 S1172	L1171-T1175 PolarHBondContact O-N 3.44Å; L1171-T1175 PolarHBondContact O-OG1 2.99Å; S1172-T1175 WeakPolarHBondContact CA-OG1 3.38Å

Retrieved 1,175 of 1,175 residues in 496.6 ms (Link to these results)

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