A0A5K4F6X5_SCHMA Loading...

Chromatin assembly factor 1 subunit A

AlphaFold DB , UniProt , Accession A0A5K4F6X5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 846 aa.

						>A0A5K4F6X5_SCHMA|A0A5K4F6X5
MERIEPKPTSGKIGSDYQKTHRRAELERLRIAREHQRKLERKQRELEKERQQRERQEKRDAEERKKEEKRMKRKEEQRKKEEERENERKKKEEEKRKKEEEKLQKEQGKKREEELKTQREEKQRAVLLGFLVKSESKKETNTISGTDCGPFIQFEVRKDMRMAPLHRMSQALLSSKQSNIEDLRHAWVNGNNKDAASSLGLLKFGRANYLHELRTGQILPLSYPSTWPIEPPEVQYLGDNIYPVINSIALKQHGNRGGGGTVWLHAKLFQFVENYRPAYYGTWRRRSRIVTGRRPFARDDYQLDYSIDSDDEWEEEEPGESITQSNNEDEEDEDEEKDGDQDDDDDQFFVPHGYLSDDEGVAVEEGEGPIPDEMKQLRQQLSVAEYEAAHRRGLQRLKPSLLGPLWLPEAVECCMPSCNATNATTNNHHFEENKENIELPERFILSKQTNGKAEFQLMKSVLSVYRVHLWTTNFPISVEPDIVAITTPSRRPKKSIPEEAMAYFIHLVHRSPLGKHKLAFEFRVFWHRHTTGILPECLQYMEYKKCNASTVGSSISRGGLSVLSGPGWDSLPLSQSLVLSKLAEIAVFTEGRWIVNAEILQKYASRVCNLCNIQQLSGGISGNSDKVDKDHFNNLIFPSWEYLTDVAVTSIRVNRGASTTNRRSLEVPQSQLPPTVDRLHEPRKNIMTTNNSPVVLLQPLQSSDVVSSKQTDKKLSIHKNEPLLQSKKIHSSEKDINLSVSMSQENCSSKVTTTITSTSSSHTPSRRKGVTNKIPTSEKDASSFGNNNKEDCSSPKLTTATTGSSKTAGRKRVTLDSFLIPPAKRSNVNLSSEIQSDEDCVIIDSK
					

Structure Viewer

Loading PAE data...

(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	43.5	Very low	49.9	Very low	249 Å²	249	151.1 Å²	151.1	100%	1.227	80%	0.798	S	S	*	*				0	109.2	0	-67.2	176.2	173.4	0	0	104.5
2	E	43.8	Very low	50.4	Low	187 Å²	187	151.5 Å²	151.5	87%	0.874	79%	0.788	S	S	*	*				-162.1	151.1	50	-170.2	172.8	-167.2	0	0	107.6	I4	E2-I4 PolarHBondContact O-N 3.28Å
3	R	43	Very low	51	Low	227 Å²	227	147.1 Å²	147.1	86%	0.857	77%	0.765	S	S	*	*			trans	-64.8	123.5	178.9	-69.3	175.6	-178.4	-142.2	-0.5	109.7
4	I	51.4	Low	51.6	Low	166 Å²	166	139.6 Å²	139.6	85%	0.851	74%	0.742	S	S	*	*			trans	-105.8	101.8	157.2	-60.1	177.7	0	0	0	106.2	E2	E2-I4 PolarHBondContact O-N 3.28Å
5	E	45.5	Very low	52.9	Low	152 Å²	152	133.1 Å²	133.1	71%	0.71	71%	0.712	S	S	*	*			trans	-57.9	139.3	171.8	-65.2	-172.6	159	0	0	110.6	K7	E5-K7 PolarHBondContact O-N 3.16Å
6	P	54.7	Low	54.3	Low	126 Å²	126	130.1 Å²	130.1	82%	0.818	70%	0.696	S	S	*	*			trans	-69.4	105.1	172.8	28.7	-30.7	0	0	0	108.4
7	K	50.5	Low	55.4	Low	184 Å²	184	132.2 Å²	132.2	80%	0.8	69%	0.693	S	S	*	*			trans	-57.2	133.8	176.6	-79.5	-177.2	177.4	174.8	0	110.4	E5 T9	E5-K7 PolarHBondContact O-N 3.16Å; K7-T9 PolarHBondContact O-N 3.19Å; K7-T9 VanDerWaalsContact O-N 3.11Å
8	P	49	Very low	56.8	Low	120 Å²	120	133.5 Å²	133.5	78%	0.779	70%	0.695	S	S	*	*			trans	-73.1	104	-179.1	29.7	-32.8	0	0	0	109.8
9	T	55.3	Low	58.1	Low	99 Å²	99	132.7 Å²	132.7	61%	0.607	69%	0.685	S	S	*	*			trans	-97.8	-9.1	175.1	52.6	0	0	0	0	113.3	K7 G11 K12	K7-T9 PolarHBondContact O-N 3.19Å; K7-T9 VanDerWaalsContact O-N 3.11Å; T9-G11 VanDerWaalsContact C-N 3.33Å; T9-G11 PolarHBondContact O-N 3.1Å; T9-K12 PolarHBondContact O-N 3.4Å
10	S	55.9	Low	59.3	Low	93 Å²	93	130.2 Å²	130.2	65%	0.65	68%	0.676	S	S	*	*	H	α-helix	trans	-66	-29.7	-175.8	60.1	0	0	0	0	114.1	K12 I13 G14	S10-K12 VanDerWaalsContact C-N 3.29Å; S10-K12 PolarHBondContact O-N 3.36Å; S10-I13 PolarHBondContact O-N 3.18Å; S10-G14 PolarHBondContact O-N 3.31Å
11	G	55.8	Low	60.3	Low	59 Å²	59	129.5 Å²	129.5	61%	0.608	67%	0.67	S	S	*	*	H	α-helix	trans	-65.7	-26.5	178	0	0	0	0	0	114.3	T9 S15	T9-G11 VanDerWaalsContact C-N 3.33Å; T9-G11 PolarHBondContact O-N 3.1Å; G11-S15 PolarHBondContact O-N 2.93Å
12	K	56.8	Low	62.3	Low	156 Å²	156	126.2 Å²	126.2	68%	0.678	64%	0.643	S	S	*	*	H	α-helix	trans	-75.2	-41.1	177.7	-72.8	-175.9	177.8	179	0	111.8	T9 S10 G14 S15 D16	T9-K12 PolarHBondContact O-N 3.4Å; S10-K12 VanDerWaalsContact C-N 3.29Å; S10-K12 PolarHBondContact O-N 3.36Å; K12-G14 PolarHBondContact O-N 2.94Å; K12-S15 WeakPolarHBondContact O-CB 3.44Å; K12-S15 PolarHBondContact O-N 3.45Å; K12-D16 PolarHBondContact O-N 3.01Å
13	I	57.6	Low	64.3	Low	94 Å²	94	126.2 Å²	126.2	48%	0.482	64%	0.635	S	S	.	*	H	α-helix	trans	-61.8	-47.2	-177.4	-59.6	170.5	0	0	0	110.4	S10 S15 D16 Y17	S10-I13 PolarHBondContact O-N 3.18Å; I13-S15 PolarHBondContact O-N 3.05Å; I13-D16 PolarHBondContact O-N 2.76Å; I13-Y17 HydrophobicContact CG2-CD2 3.74Å; I13-Y17 HydrophobicContact CG2-CE2 3.41Å; I13-Y17 VanDerWaalsContact CG2-CE2 3.41Å; I13-Y17 WeakPolarHBondContact O-CD2 3.34Å; I13-Y17 PolarHBondContact O-N 3.22Å
14	G	59.5	Low	66.4	Low	43 Å²	43	117.7 Å²	117.7	44%	0.443	61%	0.614	S	S	.	*	H	α-helix	trans	-60.9	-42.2	175.6	0	0	0	0	0	113.3	S10 K12 D16 Y17 Q18	S10-G14 PolarHBondContact O-N 3.31Å; K12-G14 PolarHBondContact O-N 2.94Å; G14-D16 VanDerWaalsContact C-N 3.32Å; G14-D16 PolarHBondContact O-N 3.18Å; G14-Y17 PolarHBondContact O-N 3.28Å; G14-Q18 PolarHBondContact O-N 3.23Å
15	S	70.6	Confident	68.1	Low	42 Å²	42	114.8 Å²	114.8	29%	0.294	60%	0.597	S	S	.	*	H	α-helix	trans	-59.6	-41.7	173.7	141.4	0	0	0	0	111.8	G11 K12 I13 Q18 K19	G11-S15 PolarHBondContact O-N 2.93Å; K12-S15 WeakPolarHBondContact O-CB 3.44Å; K12-S15 PolarHBondContact O-N 3.45Å; I13-S15 PolarHBondContact O-N 3.05Å; S15-Q18 PolarHBondContact O-N 3.3Å; S15-K19 WeakPolarHBondContact O-CB 3.49Å; S15-K19 VanDerWaalsContact O-CG 3.29Å; S15-K19 WeakPolarHBondContact O-CG 3.34Å; S15-K19 PolarHBondContact O-N 3.33Å; S15-K19 PolarHBondContact OG-NZ 3.23Å
16	D	76	Confident	70.1	Confident	84 Å²	84	112.7 Å²	112.7	45%	0.449	59%	0.589	S	S	.	*	H	α-helix	trans	-70.8	-39.1	-177.3	-66.6	-21.7	0	0	0	111.4	K12 I13 G14 K19 T20	K12-D16 PolarHBondContact O-N 3.01Å; I13-D16 PolarHBondContact O-N 2.76Å; G14-D16 VanDerWaalsContact C-N 3.32Å; G14-D16 PolarHBondContact O-N 3.18Å; D16-K19 PolarHBondContact O-N 2.9Å; D16-T20 VanDerWaalsContact O-CG2 3.31Å; D16-T20 WeakPolarHBondContact O-CG2 3.5Å; D16-T20 PolarHBondContact O-N 3.48Å; D16-T20 PolarHBondContact O-OG1 2.86Å
17	Y	73.3	Confident	71.8	Confident	167 Å²	167	110.4 Å²	110.4	66%	0.655	57%	0.568	S	S	*	*	H	α-helix	trans	-61.9	-41.2	170.3	-78.9	-70.3	0	0	0	112.9	I13 G14 K19 T20 H21	I13-Y17 HydrophobicContact CG2-CD2 3.74Å; I13-Y17 HydrophobicContact CG2-CE2 3.41Å; I13-Y17 VanDerWaalsContact CG2-CE2 3.41Å; I13-Y17 WeakPolarHBondContact O-CD2 3.34Å; I13-Y17 PolarHBondContact O-N 3.22Å; G14-Y17 PolarHBondContact O-N 3.28Å; Y17-K19 VanDerWaalsContact C-N 3.34Å; Y17-K19 PolarHBondContact O-N 3.47Å; Y17-T20 WeakPolarHBondContact CA-OG1 3.43Å; Y17-T20 PolarHBondContact O-N 2.89Å; Y17-T20 PolarHBondContact O-OG1 2.86Å; Y17-H21 WeakPolarHBondContact O-CB 3.43Å; Y17-H21 PolarHBondContact O-N 2.91Å
18	Q	80.8	Confident	73.6	Confident	155 Å²	155	110.7 Å²	110.7	72%	0.724	56%	0.564	S	S	*	*	H	α-helix	trans	-66.4	-38.1	177	-130	173.3	15.5	0	0	111.5	G14 S15 R22	G14-Q18 PolarHBondContact O-N 3.23Å; S15-Q18 PolarHBondContact O-N 3.3Å; Q18-R22 WeakPolarHBondContact O-CB 3.49Å; Q18-R22 PolarHBondContact O-N 3.35Å
19	K	81.2	Confident	75.6	Confident	118 Å²	118	110.6 Å²	110.6	51%	0.513	56%	0.556	S	S	.	*	H	α-helix	trans	-66.9	-40.7	174.5	-76.2	172	-174	167.4	0	112.3	S15 D16 Y17 R23	S15-K19 WeakPolarHBondContact O-CB 3.49Å; S15-K19 VanDerWaalsContact O-CG 3.29Å; S15-K19 WeakPolarHBondContact O-CG 3.34Å; S15-K19 PolarHBondContact O-N 3.33Å; S15-K19 PolarHBondContact OG-NZ 3.23Å; D16-K19 PolarHBondContact O-N 2.9Å; Y17-K19 VanDerWaalsContact C-N 3.34Å; Y17-K19 PolarHBondContact O-N 3.47Å; K19-R23 WeakPolarHBondContact O-CB 3.48Å; K19-R23 WeakPolarHBondContact O-CG 3.13Å; K19-R23 PolarHBondContact O-N 3.18Å
20	T	81	Confident	77.4	Confident	82 Å²	82	112.6 Å²	112.6	50%	0.503	55%	0.553	S	S	.	*	H	α-helix	trans	-68.2	-41.4	177.8	54.7	0	0	0	0	111.4	D16 Y17 R23 A24	D16-T20 VanDerWaalsContact O-CG2 3.31Å; D16-T20 WeakPolarHBondContact O-CG2 3.5Å; D16-T20 PolarHBondContact O-N 3.48Å; D16-T20 PolarHBondContact O-OG1 2.86Å; Y17-T20 WeakPolarHBondContact CA-OG1 3.43Å; Y17-T20 PolarHBondContact O-N 2.89Å; Y17-T20 PolarHBondContact O-OG1 2.86Å; T20-R23 PolarHBondContact O-N 3.43Å; T20-A24 PolarHBondContact O-N 3Å
21	H	80.8	Confident	79.1	Confident	116 Å²	116	112.8 Å²	112.8	54%	0.537	55%	0.545	S	S	.	.	H	α-helix	trans	-60.5	-47.8	173.7	-169.5	-84.7	0	0	0	111.8	Y17 R23 A24 E25	Y17-H21 WeakPolarHBondContact O-CB 3.43Å; Y17-H21 PolarHBondContact O-N 2.91Å; H21-R23 VanDerWaalsContact C-N 3.31Å; H21-R23 PolarHBondContact O-N 3.39Å; H21-A24 WeakPolarHBondContact O-CB 3.38Å; H21-A24 PolarHBondContact O-N 3.19Å; H21-A24 VanDerWaalsContact O-N 3.11Å; H21-E25 VanDerWaalsContact CE1-CD 3.47Å; H21-E25 IonicContact CE1-OE1 3.2Å; H21-E25 PolarHBondContact CE1-OE1 3.12Å; H21-E25 IonicContact ND1-OE1 3.72Å; H21-E25 IonicContact ND1-OE2 3.78Å; H21-E25 PolarHBondContact O-N 3.46Å
22	R	85.1	Confident	80.9	Confident	180 Å²	180	112.5 Å²	112.5	68%	0.679	54%	0.538	S	S	*	.	H	α-helix	trans	-62	-37.3	177.9	-168	175.5	-177	-179.5	1.3	112.3	Q18 L26	Q18-R22 WeakPolarHBondContact O-CB 3.49Å; Q18-R22 PolarHBondContact O-N 3.35Å; R22-L26 WeakPolarHBondContact O-CB 3.47Å; R22-L26 VanDerWaalsContact O-CG 3.27Å; R22-L26 WeakPolarHBondContact O-CG 3.26Å; R22-L26 PolarHBondContact O-N 3.06Å; R22-L26 VanDerWaalsContact O-N 3.09Å
23	R	85.7	Confident	82.7	Confident	187 Å²	187	114.3 Å²	114.3	71%	0.706	54%	0.54	S	S	*	.	H	α-helix	trans	-65.2	-42.2	172.8	-77.5	177.1	179.1	-178.4	0.1	111.8	K19 T20 H21 L26 E27	K19-R23 WeakPolarHBondContact O-CB 3.48Å; K19-R23 WeakPolarHBondContact O-CG 3.13Å; K19-R23 PolarHBondContact O-N 3.18Å; T20-R23 PolarHBondContact O-N 3.43Å; H21-R23 VanDerWaalsContact C-N 3.31Å; H21-R23 PolarHBondContact O-N 3.39Å; R23-L26 PolarHBondContact O-N 3.01Å; R23-E27 WeakPolarHBondContact O-CB 3.18Å; R23-E27 PolarHBondContact O-N 3.15Å
24	A	87.7	Confident	84.3	Confident	48 Å²	48	114.6 Å²	114.6	40%	0.397	54%	0.539	S	S	.	.	H	α-helix	trans	-65.3	-39.1	177.9	0	0	0	0	0	112.5	T20 H21 E27 R28	T20-A24 PolarHBondContact O-N 3Å; H21-A24 WeakPolarHBondContact O-CB 3.38Å; H21-A24 PolarHBondContact O-N 3.19Å; H21-A24 VanDerWaalsContact O-N 3.11Å; A24-E27 PolarHBondContact O-N 3.12Å; A24-R28 WeakPolarHBondContact O-CG 3.3Å; A24-R28 PolarHBondContact O-N 3.06Å
25	E	87.9	Confident	85.9	Confident	106 Å²	106	118.1 Å²	118.1	50%	0.495	54%	0.544	S	S	.	.	H	α-helix	trans	-65.4	-44.6	174.2	-76.5	-176.2	149.8	0	0	112.7	H21 E27 R28 L29	H21-E25 VanDerWaalsContact CE1-CD 3.47Å; H21-E25 IonicContact CE1-OE1 3.2Å; H21-E25 PolarHBondContact CE1-OE1 3.12Å; H21-E25 IonicContact ND1-OE1 3.72Å; H21-E25 IonicContact ND1-OE2 3.78Å; H21-E25 PolarHBondContact O-N 3.46Å; E25-E27 VanDerWaalsContact C-N 3.26Å; E25-E27 PolarHBondContact O-N 3.45Å; E25-R28 PolarHBondContact O-N 3.32Å; E25-L29 PolarHBondContact O-N 3.42Å
26	L	87.9	Confident	87	Confident	107 Å²	107	122.4 Å²	122.4	56%	0.56	56%	0.56	S	S	*	*	H	α-helix	trans	-60.3	-38.5	175.4	-73.8	170.7	0	0	0	111.5	R22 R23 L29 R30	R22-L26 WeakPolarHBondContact O-CB 3.47Å; R22-L26 VanDerWaalsContact O-CG 3.27Å; R22-L26 WeakPolarHBondContact O-CG 3.26Å; R22-L26 PolarHBondContact O-N 3.06Å; R22-L26 VanDerWaalsContact O-N 3.09Å; R23-L26 PolarHBondContact O-N 3.01Å; L26-L29 PolarHBondContact O-N 3.5Å; L26-R30 WeakPolarHBondContact O-CB 3.15Å; L26-R30 PolarHBondContact O-N 3.25Å
27	E	88.6	Confident	87.9	Confident	78 Å²	78	126.6 Å²	126.6	36%	0.364	57%	0.569	S	S	.	*	H	α-helix	trans	-68.3	-41.1	177	-171.4	58.2	-160.3	0	0	112.1	R23 A24 E25 L29 R30 I31	R23-E27 WeakPolarHBondContact O-CB 3.18Å; R23-E27 PolarHBondContact O-N 3.15Å; A24-E27 PolarHBondContact O-N 3.12Å; E25-E27 VanDerWaalsContact C-N 3.26Å; E25-E27 PolarHBondContact O-N 3.45Å; E27-L29 VanDerWaalsContact C-N 3.33Å; E27-L29 PolarHBondContact O-N 3.45Å; E27-R30 WeakPolarHBondContact O-CB 3.35Å; E27-R30 PolarHBondContact O-N 3.31Å; E27-R30 IonicContact OE1-CZ 2.97Å; E27-R30 IonicContact OE1-NE 3.06Å; E27-R30 PolarHBondContact OE1-NE 2.79Å; E27-R30 VanDerWaalsContact OE1-NE 3.16Å; E27-R30 IonicContact OE1-NH2 3.89Å; E27-R30 PolarHBondContact OE1-NH2 2.88Å; E27-R30 IonicContact OE2-CZ 3.17Å; E27-R30 IonicContact OE2-NE 3.19Å; E27-R30 PolarHBondContact OE2-NE 2.86Å; E27-R30 IonicContact OE2-NH2 3.13Å; E27-I31 HydrophobicContact CG-CD1 4.24Å; E27-I31 WeakPolarHBondContact O-CG1 3.49Å; E27-I31 PolarHBondContact O-N 2.98Å
28	R	90.1	Very high	88.9	Confident	191 Å²	191	125.3 Å²	125.3	72%	0.721	57%	0.567	S	S	*	*	H	α-helix	trans	-60.1	-42.9	172.5	-73.3	175.9	-179.8	-168	0.7	111.9	A24 E25 R30 I31 A32	A24-R28 WeakPolarHBondContact O-CG 3.3Å; A24-R28 PolarHBondContact O-N 3.06Å; E25-R28 PolarHBondContact O-N 3.32Å; R28-R30 VanDerWaalsContact C-N 3.34Å; R28-I31 PolarHBondContact O-N 3.38Å; R28-A32 WeakPolarHBondContact O-CB 3.43Å; R28-A32 PolarHBondContact O-N 3.29Å
29	L	91	Very high	89.5	Confident	117 Å²	117	121.8 Å²	121.8	61%	0.613	55%	0.553	S	S	*	*	H	α-helix	trans	-65.8	-37.2	177.4	-168.9	68.6	0	0	0	111.8	E25 L26 E27 A32 R33	E25-L29 PolarHBondContact O-N 3.42Å; L26-L29 PolarHBondContact O-N 3.5Å; E27-L29 VanDerWaalsContact C-N 3.33Å; E27-L29 PolarHBondContact O-N 3.45Å; L29-A32 PolarHBondContact O-N 3.09Å; L29-R33 WeakPolarHBondContact O-CB 3.1Å; L29-R33 PolarHBondContact O-N 3.4Å
30	R	92.1	Very high	90.1	Very high	142 Å²	142	120.1 Å²	120.1	54%	0.536	55%	0.546	S	S	.	.	H	α-helix	trans	-61.5	-48.9	174.6	-169.5	179.4	79.9	100.2	3.3	111.3	L26 E27 R28 R33 E34	L26-R30 WeakPolarHBondContact O-CB 3.15Å; L26-R30 PolarHBondContact O-N 3.25Å; E27-R30 WeakPolarHBondContact O-CB 3.35Å; E27-R30 PolarHBondContact O-N 3.31Å; E27-R30 IonicContact OE1-CZ 2.97Å; E27-R30 IonicContact OE1-NE 3.06Å; E27-R30 PolarHBondContact OE1-NE 2.79Å; E27-R30 VanDerWaalsContact OE1-NE 3.16Å; E27-R30 IonicContact OE1-NH2 3.89Å; E27-R30 PolarHBondContact OE1-NH2 2.88Å; E27-R30 IonicContact OE2-CZ 3.17Å; E27-R30 IonicContact OE2-NE 3.19Å; E27-R30 PolarHBondContact OE2-NE 2.86Å; E27-R30 IonicContact OE2-NH2 3.13Å; R28-R30 VanDerWaalsContact C-N 3.34Å; R30-R33 PolarHBondContact O-N 3.39Å; R30-E34 WeakPolarHBondContact O-CB 3.44Å; R30-E34 PolarHBondContact O-N 3.32Å
31	I	92	Very high	90.7	Very high	96 Å²	96	124.2 Å²	124.2	49%	0.492	55%	0.553	S	S	.	*	H	α-helix	trans	-63.5	-42.9	178.1	-65.8	165.6	0	0	0	110.9	E27 R28 E34 H35	E27-I31 HydrophobicContact CG-CD1 4.24Å; E27-I31 WeakPolarHBondContact O-CG1 3.49Å; E27-I31 PolarHBondContact O-N 2.98Å; R28-I31 PolarHBondContact O-N 3.38Å; I31-E34 PolarHBondContact O-N 2.84Å; I31-H35 WeakPolarHBondContact O-CB 3.44Å; I31-H35 PolarHBondContact O-N 3.28Å
32	A	93.8	Very high	91.4	Very high	54 Å²	54	124.6 Å²	124.6	45%	0.446	55%	0.553	S	S	.	*	H	α-helix	trans	-61.8	-44.8	177.5	0	0	0	0	0	112.1	R28 L29 E34 H35 Q36	R28-A32 WeakPolarHBondContact O-CB 3.43Å; R28-A32 PolarHBondContact O-N 3.29Å; L29-A32 PolarHBondContact O-N 3.09Å; A32-E34 VanDerWaalsContact C-N 3.34Å; A32-E34 PolarHBondContact O-N 3.38Å; A32-H35 PolarHBondContact O-N 3.08Å; A32-Q36 WeakPolarHBondContact O-CB 3.29Å; A32-Q36 PolarHBondContact O-N 2.82Å
33	R	93.3	Very high	91.9	Very high	193 Å²	193	122.5 Å²	122.5	73%	0.728	55%	0.551	S	S	*	*	H	α-helix	trans	-63.3	-39.6	175.7	-179.8	-179.1	-91.3	173	-6.7	111.7	L29 R30 Q36 R37	L29-R33 WeakPolarHBondContact O-CB 3.1Å; L29-R33 PolarHBondContact O-N 3.4Å; R30-R33 PolarHBondContact O-N 3.39Å; R33-Q36 PolarHBondContact O-N 3.41Å; R33-R37 WeakPolarHBondContact O-CB 3.33Å; R33-R37 PolarHBondContact O-N 2.87Å
34	E	91.8	Very high	92.3	Very high	101 Å²	101	120.5 Å²	120.5	47%	0.472	54%	0.543	S	S	.	.	H	α-helix	trans	-66.9	-41.6	177.2	-171.5	171.9	-168.8	0	0	112.1	R30 I31 A32 R37 K38	R30-E34 WeakPolarHBondContact O-CB 3.44Å; R30-E34 PolarHBondContact O-N 3.32Å; I31-E34 PolarHBondContact O-N 2.84Å; A32-E34 VanDerWaalsContact C-N 3.34Å; A32-E34 PolarHBondContact O-N 3.38Å; E34-R37 PolarHBondContact O-N 2.87Å; E34-K38 WeakPolarHBondContact O-CB 3.47Å; E34-K38 PolarHBondContact O-N 3.28Å
35	H	93	Very high	92.6	Very high	116 Å²	116	123 Å²	123	54%	0.537	55%	0.547	S	S	.	.	H	α-helix	trans	-61.1	-45.2	173.9	-175.2	-100.9	0	0	0	111.7	I31 A32 R37 K38 L39	I31-H35 WeakPolarHBondContact O-CB 3.44Å; I31-H35 PolarHBondContact O-N 3.28Å; A32-H35 PolarHBondContact O-N 3.08Å; H35-R37 PolarHBondContact O-N 3.49Å; H35-K38 WeakPolarHBondContact O-CB 3.22Å; H35-K38 PolarHBondContact O-N 3.47Å; H35-K38 VanDerWaalsContact O-N 3.16Å; H35-L39 WeakPolarHBondContact O-CG 3.33Å; H35-L39 PolarHBondContact O-N 3.19Å
36	Q	94.9	Very high	93	Very high	133 Å²	133	123.3 Å²	123.3	62%	0.621	55%	0.551	S	S	*	*	H	α-helix	trans	-59.4	-46.2	175.6	-173.7	178	10.6	0	0	111.7	A32 R33 K38 L39 E40	A32-Q36 WeakPolarHBondContact O-CB 3.29Å; A32-Q36 PolarHBondContact O-N 2.82Å; R33-Q36 PolarHBondContact O-N 3.41Å; Q36-K38 VanDerWaalsContact C-N 3.26Å; Q36-K38 PolarHBondContact O-N 2.94Å; Q36-L39 PolarHBondContact O-N 2.79Å; Q36-E40 PolarHBondContact O-N 2.97Å
37	R	93.3	Very high	93.3	Very high	172 Å²	172	122.2 Å²	122.2	65%	0.649	54%	0.543	S	S	*	.	H	α-helix	trans	-62.3	-34.2	176.9	-165.8	178.9	69.5	163.9	0.7	112.2	R33 E34 H35 R41	R33-R37 WeakPolarHBondContact O-CB 3.33Å; R33-R37 PolarHBondContact O-N 2.87Å; E34-R37 PolarHBondContact O-N 2.87Å; H35-R37 PolarHBondContact O-N 3.49Å; R37-R41 WeakPolarHBondContact O-CB 3.42Å; R37-R41 PolarHBondContact O-N 3.42Å
38	K	94.2	Very high	93.6	Very high	139 Å²	139	125.2 Å²	125.2	60%	0.604	56%	0.555	S	S	*	*	H	α-helix	trans	-70.4	-38.9	176.4	-167.2	174.6	-176	176.5	0	111.9	E34 H35 Q36 K42	E34-K38 WeakPolarHBondContact O-CB 3.47Å; E34-K38 PolarHBondContact O-N 3.28Å; H35-K38 WeakPolarHBondContact O-CB 3.22Å; H35-K38 PolarHBondContact O-N 3.47Å; H35-K38 VanDerWaalsContact O-N 3.16Å; Q36-K38 VanDerWaalsContact C-N 3.26Å; Q36-K38 PolarHBondContact O-N 2.94Å; K38-K42 WeakPolarHBondContact O-CG 3.36Å; K38-K42 PolarHBondContact O-N 3.43Å; K38-K42 VanDerWaalsContact O-N 3.09Å
39	L	94.7	Very high	93.8	Very high	82 Å²	82	120.9 Å²	120.9	43%	0.429	54%	0.543	S	S	.	.	H	α-helix	trans	-65.3	-46.3	173.7	-70.8	174.9	0	0	0	111.6	H35 Q36 R41 K42 Q43	H35-L39 WeakPolarHBondContact O-CG 3.33Å; H35-L39 PolarHBondContact O-N 3.19Å; Q36-L39 PolarHBondContact O-N 2.79Å; L39-R41 VanDerWaalsContact C-N 3.3Å; L39-R41 PolarHBondContact O-N 3.48Å; L39-K42 PolarHBondContact O-N 3.35Å; L39-K42 VanDerWaalsContact O-N 3.17Å; L39-Q43 WeakPolarHBondContact O-CG 3.36Å; L39-Q43 PolarHBondContact O-N 3.21Å
40	E	93.8	Very high	94	Very high	82 Å²	82	121 Å²	121	38%	0.383	54%	0.535	S	S	.	.	H	α-helix	trans	-60.5	-40.8	177.4	-169.9	-173.3	169	0	0	111.5	Q36 Q43 R44	Q36-E40 PolarHBondContact O-N 2.97Å; E40-Q43 PolarHBondContact O-N 3.45Å; E40-R44 WeakPolarHBondContact O-CG 3.36Å; E40-R44 PolarHBondContact O-N 3.06Å; E40-R44 IonicContact OE1-CZ 3.19Å; E40-R44 IonicContact OE1-NE 3.85Å; E40-R44 IonicContact OE1-NH1 3.14Å; E40-R44 IonicContact OE1-NH2 3.98Å; E40-R44 PolarHBondContact OE1-NH2 3Å
41	R	93.6	Very high	94.1	Very high	169 Å²	169	118 Å²	118	64%	0.638	53%	0.527	S	S	*	.	H	α-helix	trans	-61.8	-44.9	174.5	-176.1	175.7	173.3	167	1	112.1	R37 L39 Q43 R44 E45	R37-R41 WeakPolarHBondContact O-CB 3.42Å; R37-R41 PolarHBondContact O-N 3.42Å; L39-R41 VanDerWaalsContact C-N 3.3Å; L39-R41 PolarHBondContact O-N 3.48Å; R41-Q43 VanDerWaalsContact C-N 3.35Å; R41-Q43 PolarHBondContact O-N 3.1Å; R41-R44 PolarHBondContact O-N 3.09Å; R41-E45 IonicContact CZ-OE1 2.93Å; R41-E45 IonicContact NE-OE1 3.18Å; R41-E45 PolarHBondContact NE-OE1 2.99Å; R41-E45 IonicContact NH2-OE1 3.16Å; R41-E45 WeakPolarHBondContact O-CG 3.49Å; R41-E45 PolarHBondContact O-N 2.77Å
42	K	95.4	Very high	94.2	Very high	123 Å²	123	119.8 Å²	119.8	54%	0.535	53%	0.534	S	S	.	.	H	α-helix	trans	-61.8	-40.9	176	-78.1	-174.7	172.7	-169.3	0	112.3	K38 L39 E45 L46	K38-K42 WeakPolarHBondContact O-CG 3.36Å; K38-K42 PolarHBondContact O-N 3.43Å; K38-K42 VanDerWaalsContact O-N 3.09Å; L39-K42 PolarHBondContact O-N 3.35Å; L39-K42 VanDerWaalsContact O-N 3.17Å; K42-E45 PolarHBondContact O-N 3.12Å; K42-L46 WeakPolarHBondContact O-CG 3.39Å; K42-L46 PolarHBondContact O-N 2.97Å
43	Q	94.9	Very high	94.2	Very high	136 Å²	136	123 Å²	123	64%	0.636	53%	0.534	S	S	*	.	H	α-helix	trans	-63.7	-43.6	176.9	-73.7	179.4	-10.2	0	0	111.8	L39 E40 R41 E45 L46 E47	L39-Q43 WeakPolarHBondContact O-CG 3.36Å; L39-Q43 PolarHBondContact O-N 3.21Å; E40-Q43 PolarHBondContact O-N 3.45Å; R41-Q43 VanDerWaalsContact C-N 3.35Å; R41-Q43 PolarHBondContact O-N 3.1Å; Q43-E45 VanDerWaalsContact C-N 3.34Å; Q43-E45 PolarHBondContact O-N 3.15Å; Q43-L46 PolarHBondContact O-N 3.46Å; Q43-E47 WeakPolarHBondContact O-CB 3.42Å; Q43-E47 PolarHBondContact O-N 3.42Å
44	R	95	Very high	94.2	Very high	146 Å²	146	119.6 Å²	119.6	55%	0.551	53%	0.526	S	S	*	.	H	α-helix	trans	-64.1	-36.8	175.9	-73.5	179.2	177.1	169.4	5.2	113	E40 R41 K48	E40-R44 WeakPolarHBondContact O-CG 3.36Å; E40-R44 PolarHBondContact O-N 3.06Å; E40-R44 IonicContact OE1-CZ 3.19Å; E40-R44 IonicContact OE1-NE 3.85Å; E40-R44 IonicContact OE1-NH1 3.14Å; E40-R44 IonicContact OE1-NH2 3.98Å; E40-R44 PolarHBondContact OE1-NH2 3Å; R41-R44 PolarHBondContact O-N 3.09Å; R44-K48 VanDerWaalsContact O-CG 3.29Å; R44-K48 WeakPolarHBondContact O-CG 3.2Å; R44-K48 PolarHBondContact O-N 3.41Å; R44-K48 VanDerWaalsContact O-N 3.08Å
45	E	93.8	Very high	94.4	Very high	100 Å²	100	122.2 Å²	122.2	47%	0.467	53%	0.532	S	S	.	.	H	α-helix	trans	-67.4	-45.8	176	-75.8	170	-170.7	0	0	111.1	R41 K42 Q43 E47 K48 E49	R41-E45 IonicContact CZ-OE1 2.93Å; R41-E45 IonicContact NE-OE1 3.18Å; R41-E45 PolarHBondContact NE-OE1 2.99Å; R41-E45 IonicContact NH2-OE1 3.16Å; R41-E45 WeakPolarHBondContact O-CG 3.49Å; R41-E45 PolarHBondContact O-N 2.77Å; K42-E45 PolarHBondContact O-N 3.12Å; Q43-E45 VanDerWaalsContact C-N 3.34Å; Q43-E45 PolarHBondContact O-N 3.15Å; E45-E47 VanDerWaalsContact C-N 3.34Å; E45-E47 PolarHBondContact O-N 3.43Å; E45-K48 PolarHBondContact O-N 2.98Å; E45-E49 PolarHBondContact O-N 3.32Å
46	L	95.1	Very high	94.3	Very high	113 Å²	113	120.7 Å²	120.7	59%	0.592	53%	0.525	S	S	*	.	H	α-helix	trans	-61.2	-39	174.9	-77.1	168.6	0	0	0	113	K42 Q43 E49 R50	K42-L46 WeakPolarHBondContact O-CG 3.39Å; K42-L46 PolarHBondContact O-N 2.97Å; Q43-L46 PolarHBondContact O-N 3.46Å; L46-E49 PolarHBondContact O-N 3.07Å; L46-R50 PolarHBondContact O-N 3.47Å
47	E	94.4	Very high	94.2	Very high	84 Å²	84	119.7 Å²	119.7	39%	0.393	52%	0.521	S	S	.	.	H	α-helix	trans	-66.9	-42.4	176.7	176.8	163.9	-139.1	0	0	112.3	Q43 E45 E49 R50 Q51	Q43-E47 WeakPolarHBondContact O-CB 3.42Å; Q43-E47 PolarHBondContact O-N 3.42Å; E45-E47 VanDerWaalsContact C-N 3.34Å; E45-E47 PolarHBondContact O-N 3.43Å; E47-E49 VanDerWaalsContact C-N 3.31Å; E47-E49 PolarHBondContact O-N 3.42Å; E47-R50 PolarHBondContact O-N 2.99Å; E47-R50 IonicContact OE1-NH2 2.7Å; E47-R50 PolarHBondContact OE1-NH2 3.4Å; E47-Q51 WeakPolarHBondContact O-CG 3.43Å; E47-Q51 PolarHBondContact O-N 3.27Å
48	K	94.6	Very high	94.3	Very high	140 Å²	140	118.9 Å²	118.9	61%	0.609	52%	0.522	S	S	*	.	H	α-helix	trans	-61.7	-40.8	175.1	-76	176.2	179.9	-174.7	0	111.7	R44 E45 Q51 Q52	R44-K48 VanDerWaalsContact O-CG 3.29Å; R44-K48 WeakPolarHBondContact O-CG 3.2Å; R44-K48 PolarHBondContact O-N 3.41Å; R44-K48 VanDerWaalsContact O-N 3.08Å; E45-K48 PolarHBondContact O-N 2.98Å; K48-Q51 PolarHBondContact O-N 2.82Å; K48-Q52 WeakPolarHBondContact O-CG 3.47Å; K48-Q52 PolarHBondContact O-N 2.98Å
49	E	94.6	Very high	94.2	Very high	100 Å²	100	118.2 Å²	118.2	47%	0.467	52%	0.515	S	S	.	.	H	α-helix	trans	-64.4	-43.2	176.5	-161.9	-163.5	136.3	0	0	111.5	E45 L46 E47 Q51 Q52 R53	E45-E49 PolarHBondContact O-N 3.32Å; L46-E49 PolarHBondContact O-N 3.07Å; E47-E49 VanDerWaalsContact C-N 3.31Å; E47-E49 PolarHBondContact O-N 3.42Å; E49-Q51 PolarHBondContact O-N 3.39Å; E49-Q52 PolarHBondContact O-N 3.3Å; E49-R53 PolarHBondContact O-N 3.5Å; E49-R53 IonicContact OE1-CZ 2.68Å; E49-R53 IonicContact OE1-NH2 2.68Å; E49-R53 PolarHBondContact OE1-NH2 3.32Å
50	R	95.8	Very high	94	Very high	120 Å²	120	117 Å²	117	45%	0.453	51%	0.509	S	S	.	.	H	α-helix	trans	-59	-47.7	174.5	-170.6	-175	76.5	-112.7	0.6	111.6	L46 E47 Q52 R53 E54	L46-R50 PolarHBondContact O-N 3.47Å; E47-R50 PolarHBondContact O-N 2.99Å; E47-R50 IonicContact OE1-NH2 2.7Å; E47-R50 PolarHBondContact OE1-NH2 3.4Å; R50-Q52 VanDerWaalsContact C-N 3.31Å; R50-Q52 PolarHBondContact O-N 3.22Å; R50-R53 PolarHBondContact O-N 3.3Å; R50-E54 WeakPolarHBondContact O-CB 3.4Å; R50-E54 PolarHBondContact O-N 3.39Å
51	Q	94.7	Very high	94	Very high	79 Å²	79	115.5 Å²	115.5	37%	0.369	51%	0.511	S	S	.	.	H	α-helix	trans	-63.8	-35.6	178.1	-72.6	-177.3	11.5	0	0	112.4	E47 K48 E49 R55	E47-Q51 WeakPolarHBondContact O-CG 3.43Å; E47-Q51 PolarHBondContact O-N 3.27Å; K48-Q51 PolarHBondContact O-N 2.82Å; E49-Q51 PolarHBondContact O-N 3.39Å; Q51-R55 WeakPolarHBondContact O-CB 3.31Å; Q51-R55 WeakPolarHBondContact O-CG 3.48Å; Q51-R55 PolarHBondContact O-N 3.48Å
52	Q	93.4	Very high	93.9	Very high	134 Å²	134	113.8 Å²	113.8	63%	0.626	51%	0.51	S	S	*	.	H	α-helix	trans	-67.7	-41.4	175.2	-78	-177.5	-7	0	0	111.9	K48 E49 R50 R55 Q56	K48-Q52 WeakPolarHBondContact O-CG 3.47Å; K48-Q52 PolarHBondContact O-N 2.98Å; E49-Q52 PolarHBondContact O-N 3.3Å; R50-Q52 VanDerWaalsContact C-N 3.31Å; R50-Q52 PolarHBondContact O-N 3.22Å; Q52-R55 PolarHBondContact O-N 2.9Å; Q52-Q56 PolarHBondContact O-N 3.07Å
53	R	93.7	Very high	93.7	Very high	120 Å²	120	114.6 Å²	114.6	45%	0.453	52%	0.516	S	S	.	.	H	α-helix	trans	-64.9	-46.5	177.7	-152.5	-176.1	-52.3	120.5	1.6	111.8	E49 R50 R55 Q56 E57	E49-R53 PolarHBondContact O-N 3.5Å; E49-R53 IonicContact OE1-CZ 2.68Å; E49-R53 IonicContact OE1-NH2 2.68Å; E49-R53 PolarHBondContact OE1-NH2 3.32Å; R50-R53 PolarHBondContact O-N 3.3Å; R53-R55 VanDerWaalsContact C-N 3.32Å; R53-R55 PolarHBondContact O-N 3.26Å; R53-Q56 WeakPolarHBondContact O-CB 3.44Å; R53-Q56 PolarHBondContact O-N 3.48Å; R53-Q56 VanDerWaalsContact O-N 3.07Å; R53-E57 WeakPolarHBondContact O-CG 3.14Å; R53-E57 PolarHBondContact O-N 3.33Å
54	E	94.5	Very high	93.6	Very high	122 Å²	122	116.3 Å²	116.3	57%	0.57	52%	0.516	S	S	*	.	H	α-helix	trans	-60.3	-40.8	175.6	-173.5	-177.2	173.4	0	0	111.8	R50 Q56 K58	R50-E54 WeakPolarHBondContact O-CB 3.4Å; R50-E54 PolarHBondContact O-N 3.39Å; E54-Q56 VanDerWaalsContact C-N 3.34Å; E54-Q56 PolarHBondContact O-N 3.44Å; E54-K58 VanDerWaalsContact O-CB 3.31Å; E54-K58 WeakPolarHBondContact O-CB 3.34Å; E54-K58 PolarHBondContact O-N 3.24Å
55	R	94.2	Very high	93.5	Very high	157 Å²	157	115.6 Å²	115.6	59%	0.592	52%	0.517	S	S	*	.	H	α-helix	trans	-65.9	-34.4	174.3	-75.1	174.2	-175.5	-173	3	112.8	Q51 Q52 R53 R59	Q51-R55 WeakPolarHBondContact O-CB 3.31Å; Q51-R55 WeakPolarHBondContact O-CG 3.48Å; Q51-R55 PolarHBondContact O-N 3.48Å; Q52-R55 PolarHBondContact O-N 2.9Å; R53-R55 VanDerWaalsContact C-N 3.32Å; R53-R55 PolarHBondContact O-N 3.26Å; R55-R59 WeakPolarHBondContact O-CG 3.45Å; R55-R59 PolarHBondContact O-N 2.89Å; R55-R59 PolarHBondContact O-NH1 3Å
56	Q	91.8	Very high	93.4	Very high	83 Å²	83	118.6 Å²	118.6	39%	0.388	53%	0.529	S	S	.	.	H	α-helix	trans	-70.8	-49.3	175.7	-176.7	66	39.4	0	0	110.6	Q52 R53 E54 K58 R59 D60	Q52-Q56 PolarHBondContact O-N 3.07Å; R53-Q56 WeakPolarHBondContact O-CB 3.44Å; R53-Q56 PolarHBondContact O-N 3.48Å; R53-Q56 VanDerWaalsContact O-N 3.07Å; E54-Q56 VanDerWaalsContact C-N 3.34Å; E54-Q56 PolarHBondContact O-N 3.44Å; Q56-K58 VanDerWaalsContact C-N 3.26Å; Q56-K58 PolarHBondContact O-N 3.48Å; Q56-R59 WeakPolarHBondContact O-CB 3.44Å; Q56-R59 PolarHBondContact O-N 2.99Å; Q56-D60 PolarHBondContact NE2-OD1 3.23Å; Q56-D60 VanDerWaalsContact O-CG 3.28Å; Q56-D60 PolarHBondContact O-N 2.77Å
57	E	93	Very high	93	Very high	113 Å²	113	116.8 Å²	116.8	53%	0.528	52%	0.517	S	S	.	.	H	α-helix	trans	-58.5	-38.3	177.7	-72.3	169.7	-166.5	0	0	112	R53 D60 A61	R53-E57 WeakPolarHBondContact O-CG 3.14Å; R53-E57 PolarHBondContact O-N 3.33Å; E57-D60 PolarHBondContact O-N 2.97Å; E57-A61 VanDerWaalsContact O-CB 3.24Å; E57-A61 WeakPolarHBondContact O-CB 3.48Å; E57-A61 PolarHBondContact O-N 3.15Å
58	K	95.1	Very high	92.8	Very high	154 Å²	154	119.6 Å²	119.6	67%	0.67	53%	0.53	S	S	*	.	H	α-helix	trans	-63.3	-40.9	174.3	-171.7	176	-179.6	179.4	0	112.5	E54 Q56 E62	E54-K58 VanDerWaalsContact O-CB 3.31Å; E54-K58 WeakPolarHBondContact O-CB 3.34Å; E54-K58 PolarHBondContact O-N 3.24Å; Q56-K58 VanDerWaalsContact C-N 3.26Å; Q56-K58 PolarHBondContact O-N 3.48Å; K58-E62 WeakPolarHBondContact O-CB 3.45Å; K58-E62 PolarHBondContact O-N 2.89Å
59	R	92.3	Very high	92.7	Very high	126 Å²	126	119 Å²	119	48%	0.475	53%	0.528	S	S	.	.	H	α-helix	trans	-65.5	-46.1	175	-74.1	-171.9	-63.3	-91.1	7.7	111.4	R55 Q56 A61 E62 E63	R55-R59 WeakPolarHBondContact O-CG 3.45Å; R55-R59 PolarHBondContact O-N 2.89Å; R55-R59 PolarHBondContact O-NH1 3Å; Q56-R59 WeakPolarHBondContact O-CB 3.44Å; Q56-R59 PolarHBondContact O-N 2.99Å; R59-A61 VanDerWaalsContact C-N 3.28Å; R59-A61 PolarHBondContact O-N 3.05Å; R59-E62 PolarHBondContact O-N 3.49Å; R59-E63 WeakPolarHBondContact O-CB 3.32Å; R59-E63 PolarHBondContact O-N 3.39Å
60	D	90.2	Very high	92.5	Very high	56 Å²	56	120.4 Å²	120.4	30%	0.299	53%	0.529	S	S	.	.	H	α-helix	trans	-67.2	-30.1	-179.5	-58.6	-15	0	0	0	111.9	Q56 E57 R64	Q56-D60 PolarHBondContact NE2-OD1 3.23Å; Q56-D60 VanDerWaalsContact O-CG 3.28Å; Q56-D60 PolarHBondContact O-N 2.77Å; E57-D60 PolarHBondContact O-N 2.97Å; D60-R64 WeakPolarHBondContact O-CB 3.29Å; D60-R64 WeakPolarHBondContact O-CG 3.39Å; D60-R64 PolarHBondContact O-N 2.96Å; D60-R64 VanDerWaalsContact O-N 3.16Å; D60-R64 PolarHBondContact O-NE 3.25Å; D60-R64 VanDerWaalsContact O-NE 3.15Å
61	A	94	Very high	92	Very high	50 Å²	50	119.6 Å²	119.6	41%	0.413	53%	0.532	S	S	.	.	H	α-helix	trans	-73.8	-39.9	173.3	0	0	0	0	0	112.2	E57 R59 R64 K65	E57-A61 VanDerWaalsContact O-CB 3.24Å; E57-A61 WeakPolarHBondContact O-CB 3.48Å; E57-A61 PolarHBondContact O-N 3.15Å; R59-A61 VanDerWaalsContact C-N 3.28Å; R59-A61 PolarHBondContact O-N 3.05Å; A61-R64 PolarHBondContact O-N 2.82Å; A61-K65 WeakPolarHBondContact O-CB 3.46Å; A61-K65 PolarHBondContact O-N 3.17Å
62	E	91.8	Very high	92	Very high	134 Å²	134	123 Å²	123	63%	0.626	55%	0.545	S	S	*	.	H	α-helix	trans	-65	-42.2	175.4	-174.3	174.3	-177.3	0	0	111.7	K58 R59 K65 K66	K58-E62 WeakPolarHBondContact O-CB 3.45Å; K58-E62 PolarHBondContact O-N 2.89Å; R59-E62 PolarHBondContact O-N 3.49Å; E62-K65 PolarHBondContact O-N 2.85Å; E62-K66 WeakPolarHBondContact O-CB 3.3Å; E62-K66 PolarHBondContact O-N 3.22Å
63	E	90.6	Very high	91.8	Very high	139 Å²	139	123.2 Å²	123.2	65%	0.65	54%	0.54	S	S	*	.	H	α-helix	trans	-64.2	-44.3	175.6	-172.3	172.4	-171.6	0	0	111.9	R59 K65 K66 E67	R59-E63 WeakPolarHBondContact O-CB 3.32Å; R59-E63 PolarHBondContact O-N 3.39Å; E63-K65 VanDerWaalsContact C-N 3.35Å; E63-K65 PolarHBondContact O-N 3.19Å; E63-K66 WeakPolarHBondContact O-CB 3.46Å; E63-K66 PolarHBondContact O-N 3.25Å; E63-K66 VanDerWaalsContact O-N 3.16Å; E63-E67 PolarHBondContact O-N 3.34Å
64	R	93.3	Very high	91.5	Very high	173 Å²	173	122.9 Å²	122.9	65%	0.653	54%	0.542	S	S	*	.	H	α-helix	trans	-59.1	-44	173.6	-82.5	-176.5	-82.8	-179.1	-7	112.4	D60 A61 K66 E67 E68	D60-R64 WeakPolarHBondContact O-CB 3.29Å; D60-R64 WeakPolarHBondContact O-CG 3.39Å; D60-R64 PolarHBondContact O-N 2.96Å; D60-R64 VanDerWaalsContact O-N 3.16Å; D60-R64 PolarHBondContact O-NE 3.25Å; D60-R64 VanDerWaalsContact O-NE 3.15Å; A61-R64 PolarHBondContact O-N 2.82Å; R64-K66 VanDerWaalsContact C-N 3.3Å; R64-K66 PolarHBondContact O-N 2.78Å; R64-E67 PolarHBondContact O-N 2.87Å; R64-E68 WeakPolarHBondContact O-CB 3.33Å; R64-E68 PolarHBondContact O-N 3.16Å
65	K	93.6	Very high	91.2	Very high	131 Å²	131	122.9 Å²	122.9	57%	0.57	54%	0.542	S	S	*	.	H	α-helix	trans	-63.6	-36.3	176.3	-171	178.1	-177.8	178.2	0	112	A61 E62 E63 K69	A61-K65 WeakPolarHBondContact O-CB 3.46Å; A61-K65 PolarHBondContact O-N 3.17Å; E62-K65 PolarHBondContact O-N 2.85Å; E63-K65 VanDerWaalsContact C-N 3.35Å; E63-K65 PolarHBondContact O-N 3.19Å; K65-K69 WeakPolarHBondContact O-CB 3.36Å; K65-K69 WeakPolarHBondContact O-CG 3.47Å; K65-K69 PolarHBondContact O-N 3.07Å; K65-K69 VanDerWaalsContact O-N 3.11Å
66	K	90.6	Very high	91	Very high	163 Å²	163	121 Å²	121	71%	0.709	54%	0.54	S	S	*	.	H	α-helix	trans	-69	-41.3	176.3	-169.6	176.4	-178.6	178.1	0	111.7	E62 E63 R64 R70	E62-K66 WeakPolarHBondContact O-CB 3.3Å; E62-K66 PolarHBondContact O-N 3.22Å; E63-K66 WeakPolarHBondContact O-CB 3.46Å; E63-K66 PolarHBondContact O-N 3.25Å; E63-K66 VanDerWaalsContact O-N 3.16Å; R64-K66 VanDerWaalsContact C-N 3.3Å; R64-K66 PolarHBondContact O-N 2.78Å; K66-R70 PolarHBondContact O-N 3.47Å
67	E	87	Confident	90.9	Very high	75 Å²	75	123.4 Å²	123.4	35%	0.35	55%	0.551	S	S	.	*	H	α-helix	trans	-69	-41.1	177.5	-171.3	57.6	-140.2	0	0	112	E63 R64 K69 R70 M71	E63-E67 PolarHBondContact O-N 3.34Å; R64-E67 PolarHBondContact O-N 2.87Å; E67-K69 PolarHBondContact O-N 3.32Å; E67-R70 WeakPolarHBondContact O-CB 3.33Å; E67-R70 PolarHBondContact O-N 3.37Å; E67-R70 VanDerWaalsContact O-N 3.11Å; E67-R70 IonicContact OE1-CZ 3.34Å; E67-R70 IonicContact OE1-NE 3.73Å; E67-R70 PolarHBondContact OE1-NE 2.95Å; E67-R70 IonicContact OE1-NH2 3.72Å; E67-R70 PolarHBondContact OE1-NH2 3.16Å; E67-R70 IonicContact OE2-CZ 3.94Å; E67-R70 IonicContact OE2-NE 2.63Å; E67-R70 PolarHBondContact OE2-NE 3.08Å; E67-R70 IonicContact OE2-NH1 3.89Å; E67-R70 IonicContact OE2-NH2 2.69Å; E67-R70 PolarHBondContact OE2-NH2 3.47Å; E67-M71 WeakPolarHBondContact O-CG 3.48Å; E67-M71 PolarHBondContact O-N 3.24Å
68	E	90.8	Very high	90.8	Very high	143 Å²	143	125 Å²	125	67%	0.668	55%	0.552	S	S	*	*	H	α-helix	trans	-60.6	-44.4	174.6	-172.7	180	179.5	0	0	111.5	R64 R70 M71 K72	R64-E68 WeakPolarHBondContact O-CB 3.33Å; R64-E68 PolarHBondContact O-N 3.16Å; E68-R70 VanDerWaalsContact C-N 3.32Å; E68-R70 PolarHBondContact O-N 3.12Å; E68-M71 PolarHBondContact O-N 2.77Å; E68-K72 WeakPolarHBondContact O-CB 3.34Å; E68-K72 PolarHBondContact O-N 3.29Å
69	K	91.6	Very high	90.7	Very high	128 Å²	128	124.9 Å²	124.9	56%	0.557	55%	0.552	S	S	*	*	H	α-helix	trans	-59.6	-40.9	171.9	-79.6	-174.3	173.2	-163.1	0	112.5	K65 E67 K72 R73	K65-K69 WeakPolarHBondContact O-CB 3.36Å; K65-K69 WeakPolarHBondContact O-CG 3.47Å; K65-K69 PolarHBondContact O-N 3.07Å; K65-K69 VanDerWaalsContact O-N 3.11Å; E67-K69 PolarHBondContact O-N 3.32Å; K69-K72 PolarHBondContact O-N 3.36Å; K69-R73 WeakPolarHBondContact O-CB 3.48Å; K69-R73 WeakPolarHBondContact O-CG 3.22Å; K69-R73 PolarHBondContact O-N 3.43Å
70	R	89.7	Confident	90.6	Very high	128 Å²	128	122.3 Å²	122.3	48%	0.483	54%	0.544	S	S	.	.	H	α-helix	trans	-64.9	-41.1	178.1	-169.7	179.7	77	164.8	1.1	111.8	K66 E67 E68 K74	K66-R70 PolarHBondContact O-N 3.47Å; E67-R70 WeakPolarHBondContact O-CB 3.33Å; E67-R70 PolarHBondContact O-N 3.37Å; E67-R70 VanDerWaalsContact O-N 3.11Å; E67-R70 IonicContact OE1-CZ 3.34Å; E67-R70 IonicContact OE1-NE 3.73Å; E67-R70 PolarHBondContact OE1-NE 2.95Å; E67-R70 IonicContact OE1-NH2 3.72Å; E67-R70 PolarHBondContact OE1-NH2 3.16Å; E67-R70 IonicContact OE2-CZ 3.94Å; E67-R70 IonicContact OE2-NE 2.63Å; E67-R70 PolarHBondContact OE2-NE 3.08Å; E67-R70 IonicContact OE2-NH1 3.89Å; E67-R70 IonicContact OE2-NH2 2.69Å; E67-R70 PolarHBondContact OE2-NH2 3.47Å; E68-R70 VanDerWaalsContact C-N 3.32Å; E68-R70 PolarHBondContact O-N 3.12Å; R70-K74 WeakPolarHBondContact O-CG 3.43Å; R70-K74 PolarHBondContact O-N 3.05Å; R70-K74 VanDerWaalsContact O-N 3.14Å
71	M	87	Confident	90.4	Very high	104 Å²	104	125.1 Å²	125.1	51%	0.512	56%	0.555	S	S	.	*	H	α-helix	trans	-68.5	-42.8	177.1	-71.1	-59.7	-65.7	0	0	111.7	E67 E68 R73 K74 E75	E67-M71 WeakPolarHBondContact O-CG 3.48Å; E67-M71 PolarHBondContact O-N 3.24Å; E68-M71 PolarHBondContact O-N 2.77Å; M71-R73 VanDerWaalsContact C-N 3.35Å; M71-R73 PolarHBondContact O-N 3.17Å; M71-K74 PolarHBondContact O-N 3.49Å; M71-E75 PolarHBondContact O-N 3.11Å
72	K	93.9	Very high	90.1	Very high	149 Å²	149	127.7 Å²	127.7	65%	0.648	56%	0.559	S	S	*	*	H	α-helix	trans	-58.3	-45.2	174.4	-170.9	177.2	-180	-175.8	0	111.8	E68 K69 K74 E75 E76	E68-K72 WeakPolarHBondContact O-CB 3.34Å; E68-K72 PolarHBondContact O-N 3.29Å; K69-K72 PolarHBondContact O-N 3.36Å; K72-K74 PolarHBondContact O-N 3Å; K72-E75 PolarHBondContact O-N 3.39Å; K72-E76 WeakPolarHBondContact O-CB 3.46Å; K72-E76 PolarHBondContact O-N 3.39Å
73	R	90	Very high	90.1	Very high	140 Å²	140	126.2 Å²	126.2	53%	0.528	55%	0.552	S	S	.	*	H	α-helix	trans	-59.5	-42.9	175.5	-78.1	178.7	168.6	178.9	-4.2	112.9	K69 M71 Q77 E317	K69-R73 WeakPolarHBondContact O-CB 3.48Å; K69-R73 WeakPolarHBondContact O-CG 3.22Å; K69-R73 PolarHBondContact O-N 3.43Å; M71-R73 VanDerWaalsContact C-N 3.35Å; M71-R73 PolarHBondContact O-N 3.17Å; R73-Q77 WeakPolarHBondContact O-CB 3.49Å; R73-Q77 PolarHBondContact O-N 3.49Å; R73-E317 IonicContact CZ-OE1 3.82Å; R73-E317 IonicContact NE-OE1 3.95Å; R73-E317 PolarHBondContact NE-OE1 3.19Å; R73-E317 IonicContact NH2-OE1 3.73Å; R73-E317 PolarHBondContact NH2-OE1 3.23Å
74	K	87	Confident	90	Very high	112 Å²	112	124.5 Å²	124.5	49%	0.487	54%	0.54	S	S	.	.	H	α-helix	trans	-66.4	-38.9	178.1	-75.4	-179.8	177.4	-177.3	0	112.6	R70 M71 K72 R78	R70-K74 WeakPolarHBondContact O-CG 3.43Å; R70-K74 PolarHBondContact O-N 3.05Å; R70-K74 VanDerWaalsContact O-N 3.14Å; M71-K74 PolarHBondContact O-N 3.49Å; K72-K74 PolarHBondContact O-N 3Å; K74-R78 PolarHBondContact O-N 3.32Å; K74-R78 VanDerWaalsContact O-N 3.13Å
75	E	88	Confident	89.7	Confident	123 Å²	123	121 Å²	121	58%	0.575	53%	0.53	S	S	*	.	H	α-helix	trans	-68.8	-42.2	178.1	-175.6	166.2	-156.9	0	0	111.8	M71 K72 R78 K79	M71-E75 PolarHBondContact O-N 3.11Å; K72-E75 PolarHBondContact O-N 3.39Å; E75-R78 PolarHBondContact O-N 3.38Å; E75-K79 PolarHBondContact O-N 2.89Å
76	E	89.9	Confident	89.4	Confident	118 Å²	118	119.1 Å²	119.1	55%	0.551	53%	0.527	S	S	*	.	H	α-helix	trans	-63.4	-43.6	175.2	-174.7	174.8	-179	0	0	112.3	K72 R78 K79 K80	K72-E76 WeakPolarHBondContact O-CB 3.46Å; K72-E76 PolarHBondContact O-N 3.39Å; E76-R78 VanDerWaalsContact C-N 3.3Å; E76-R78 PolarHBondContact O-N 3.27Å; E76-K79 PolarHBondContact O-N 3.13Å; E76-K80 WeakPolarHBondContact O-CB 3.47Å; E76-K80 PolarHBondContact O-N 3.25Å
77	Q	89.6	Confident	89.5	Confident	132 Å²	132	115.9 Å²	115.9	62%	0.617	51%	0.514	S	S	*	.	H	α-helix	trans	-61.1	-39.7	175.6	-168.5	175.3	15.7	0	0	111.8	R73 K80 E81	R73-Q77 WeakPolarHBondContact O-CB 3.49Å; R73-Q77 PolarHBondContact O-N 3.49Å; Q77-K80 PolarHBondContact O-N 2.87Å; Q77-E81 WeakPolarHBondContact O-CB 3.46Å; Q77-E81 PolarHBondContact O-N 3.44Å
78	R	91	Very high	89.6	Confident	146 Å²	146	120.4 Å²	120.4	55%	0.551	53%	0.528	S	S	*	.	H	α-helix	trans	-65.4	-44.5	175.6	-166.5	178.7	70.5	-153.1	-5.4	111.5	K74 E75 E76 K80 E81 E82	K74-R78 PolarHBondContact O-N 3.32Å; K74-R78 VanDerWaalsContact O-N 3.13Å; E75-R78 PolarHBondContact O-N 3.38Å; E76-R78 VanDerWaalsContact C-N 3.3Å; E76-R78 PolarHBondContact O-N 3.27Å; R78-K80 VanDerWaalsContact C-N 3.32Å; R78-K80 PolarHBondContact O-N 3Å; R78-E81 PolarHBondContact O-N 3.02Å; R78-E82 WeakPolarHBondContact O-CG 3.35Å; R78-E82 PolarHBondContact O-N 3.05Å
79	K	93.4	Very high	89.6	Confident	152 Å²	152	118.7 Å²	118.7	66%	0.661	52%	0.518	S	S	*	.	H	α-helix	trans	-60.4	-41.6	176	-168.4	-178.2	177.5	-169.9	0	111.5	E75 E76 E82 E83	E75-K79 PolarHBondContact O-N 2.89Å; E76-K79 PolarHBondContact O-N 3.13Å; K79-E82 PolarHBondContact O-N 3.29Å; K79-E83 WeakPolarHBondContact O-CB 3.42Å; K79-E83 PolarHBondContact O-N 3.24Å
80	K	89.5	Confident	89.7	Confident	72 Å²	72	120 Å²	120	31%	0.313	52%	0.524	S	S	.	.	H	α-helix	trans	-68.6	-32.2	177.1	-164.3	-176.2	-172.9	-156.8	0	113.2	E76 Q77 R78 R84 P318	E76-K80 WeakPolarHBondContact O-CB 3.47Å; E76-K80 PolarHBondContact O-N 3.25Å; Q77-K80 PolarHBondContact O-N 2.87Å; R78-K80 VanDerWaalsContact C-N 3.32Å; R78-K80 PolarHBondContact O-N 3Å; K80-R84 WeakPolarHBondContact O-CG 3.26Å; K80-R84 PolarHBondContact O-N 3.41Å; K80-R84 PolarHBondContact O-NE 2.93Å; K80-R84 VanDerWaalsContact O-NE 3.16Å; K80-P318 HydrophobicContact CD-CB 3.7Å; K80-P318 HydrophobicContact CD-CG 3.55Å
81	E	85.7	Confident	89.7	Confident	116 Å²	116	119.8 Å²	119.8	54%	0.542	53%	0.526	S	S	.	.	H	α-helix	trans	-70.3	-45.1	174.2	-171.1	170.1	-164.2	0	0	111.6	Q77 R78 E83 R84 E85	Q77-E81 WeakPolarHBondContact O-CB 3.46Å; Q77-E81 PolarHBondContact O-N 3.44Å; R78-E81 PolarHBondContact O-N 3.02Å; E81-E83 VanDerWaalsContact C-N 3.34Å; E81-E83 PolarHBondContact O-N 2.99Å; E81-R84 PolarHBondContact O-N 3.32Å; E81-E85 WeakPolarHBondContact O-CB 3.5Å; E81-E85 PolarHBondContact O-N 3.21Å
82	E	87.9	Confident	89.5	Confident	104 Å²	104	121.4 Å²	121.4	49%	0.486	53%	0.533	S	S	.	.	H	α-helix	trans	-60.2	-41.2	174.7	-73.1	174.5	-170.6	0	0	112	R78 K79 E85 N86	R78-E82 WeakPolarHBondContact O-CG 3.35Å; R78-E82 PolarHBondContact O-N 3.05Å; K79-E82 PolarHBondContact O-N 3.29Å; E82-E85 PolarHBondContact O-N 2.95Å; E82-N86 WeakPolarHBondContact O-CB 3.02Å; E82-N86 VanDerWaalsContact O-CG 3.29Å; E82-N86 PolarHBondContact O-N 3.44Å; E82-N86 PolarHBondContact O-ND2 2.93Å
83	E	92.3	Very high	89	Confident	102 Å²	102	120.9 Å²	120.9	48%	0.477	53%	0.532	S	S	.	.	H	α-helix	trans	-63.7	-47.6	176.5	-173.1	-179.8	178.3	0	0	112.4	K79 E81 E85 N86 E87	K79-E83 WeakPolarHBondContact O-CB 3.42Å; K79-E83 PolarHBondContact O-N 3.24Å; E81-E83 VanDerWaalsContact C-N 3.34Å; E81-E83 PolarHBondContact O-N 2.99Å; E83-E85 VanDerWaalsContact C-N 3.29Å; E83-E85 PolarHBondContact O-N 3.12Å; E83-N86 PolarHBondContact O-N 3.46Å; E83-E87 PolarHBondContact O-N 3.29Å
84	R	88.3	Confident	89.1	Confident	104 Å²	104	120.4 Å²	120.4	39%	0.392	54%	0.536	S	S	.	.	H	α-helix	trans	-62.9	-35.6	176.7	-78	-179.1	-67.4	134.5	-0.6	112.3	K80 E81 R88	K80-R84 WeakPolarHBondContact O-CG 3.26Å; K80-R84 PolarHBondContact O-N 3.41Å; K80-R84 PolarHBondContact O-NE 2.93Å; K80-R84 VanDerWaalsContact O-NE 3.16Å; E81-R84 PolarHBondContact O-N 3.32Å; R84-R88 WeakPolarHBondContact O-CB 3.24Å; R84-R88 VanDerWaalsContact O-CG 3.23Å; R84-R88 WeakPolarHBondContact O-CG 3.37Å; R84-R88 PolarHBondContact O-N 3.45Å
85	E	86.1	Confident	89.3	Confident	99 Å²	99	121.5 Å²	121.5	46%	0.463	54%	0.541	S	S	.	.	H	α-helix	trans	-67.3	-42.1	175.8	-163	-172	158.2	0	0	111.1	E81 E82 E83 R88 K89	E81-E85 WeakPolarHBondContact O-CB 3.5Å; E81-E85 PolarHBondContact O-N 3.21Å; E82-E85 PolarHBondContact O-N 2.95Å; E83-E85 VanDerWaalsContact C-N 3.29Å; E83-E85 PolarHBondContact O-N 3.12Å; E85-R88 PolarHBondContact O-N 2.84Å; E85-K89 WeakPolarHBondContact O-CG 3.49Å; E85-K89 PolarHBondContact O-N 3.25Å; E85-K89 VanDerWaalsContact OE1-CE 3.23Å; E85-K89 WeakPolarHBondContact OE1-CE 3.45Å; E85-K89 IonicContact OE1-NZ 3.35Å; E85-K89 PolarHBondContact OE1-NZ 3.02Å
86	N	89.2	Confident	89.2	Confident	91 Å²	91	123 Å²	123	49%	0.487	54%	0.542	S	S	.	.	H	α-helix	trans	-66.3	-39.4	176.3	-72.7	-23.3	0	0	0	112.5	E82 E83 K89 K90	E82-N86 WeakPolarHBondContact O-CB 3.02Å; E82-N86 VanDerWaalsContact O-CG 3.29Å; E82-N86 PolarHBondContact O-N 3.44Å; E82-N86 PolarHBondContact O-ND2 2.93Å; E83-N86 PolarHBondContact O-N 3.46Å; N86-K89 PolarHBondContact O-N 2.97Å; N86-K90 WeakPolarHBondContact O-CG 2.99Å; N86-K90 PolarHBondContact O-N 3.04Å
87	E	91.5	Very high	89.4	Confident	95 Å²	95	125 Å²	125	44%	0.444	55%	0.548	S	S	.	.	H	α-helix	trans	-64.4	-42.3	175	-165.6	-164	168.3	0	0	111.6	E83 K90 K91	E83-E87 PolarHBondContact O-N 3.29Å; E87-K90 PolarHBondContact O-N 3.28Å; E87-K91 HydrophobicContact CG-CD 4.41Å; E87-K91 WeakPolarHBondContact O-CB 3.38Å; E87-K91 WeakPolarHBondContact O-CG 3.38Å; E87-K91 PolarHBondContact O-N 3.07Å; E87-K91 WeakPolarHBondContact OE1-CE 3.39Å; E87-K91 IonicContact OE1-NZ 3.84Å; E87-K91 PolarHBondContact OE1-NZ 2.91Å
88	R	90	Very high	89.3	Confident	171 Å²	171	125.8 Å²	125.8	65%	0.645	55%	0.55	S	S	*	.	H	α-helix	trans	-61.1	-44.2	174.5	-76.2	173.9	-179.2	-166.4	0.2	111.7	R84 E85 K91 E92	R84-R88 WeakPolarHBondContact O-CB 3.24Å; R84-R88 VanDerWaalsContact O-CG 3.23Å; R84-R88 WeakPolarHBondContact O-CG 3.37Å; R84-R88 PolarHBondContact O-N 3.45Å; E85-R88 PolarHBondContact O-N 2.84Å; R88-K91 PolarHBondContact O-N 3.24Å; R88-E92 WeakPolarHBondContact O-CB 3.49Å; R88-E92 PolarHBondContact O-N 2.87Å
89	K	90	Very high	88.9	Confident	106 Å²	106	124 Å²	124	46%	0.461	55%	0.547	S	S	.	.	H	α-helix	trans	-61.8	-44.1	176.5	-74.2	172.9	-175.7	164.3	0	111.8	E85 N86 E92 E93	E85-K89 WeakPolarHBondContact O-CG 3.49Å; E85-K89 PolarHBondContact O-N 3.25Å; E85-K89 VanDerWaalsContact OE1-CE 3.23Å; E85-K89 WeakPolarHBondContact OE1-CE 3.45Å; E85-K89 IonicContact OE1-NZ 3.35Å; E85-K89 PolarHBondContact OE1-NZ 3.02Å; N86-K89 PolarHBondContact O-N 2.97Å; K89-E92 PolarHBondContact O-N 3.16Å; K89-E93 WeakPolarHBondContact O-CB 3.16Å; K89-E93 PolarHBondContact O-N 2.97Å
90	K	92.8	Very high	88.4	Confident	156 Å²	156	121.6 Å²	121.6	68%	0.678	54%	0.539	S	S	*	.	H	α-helix	trans	-61.5	-45.5	175.1	-76.3	-176.6	177.3	-176.7	0	112.2	N86 E87 E93 E94	N86-K90 WeakPolarHBondContact O-CG 2.99Å; N86-K90 PolarHBondContact O-N 3.04Å; E87-K90 PolarHBondContact O-N 3.28Å; K90-E93 PolarHBondContact O-N 3.37Å; K90-E94 WeakPolarHBondContact O-CB 3.43Å; K90-E94 PolarHBondContact O-N 3.3Å
91	K	89.8	Confident	88.4	Confident	123 Å²	123	124.2 Å²	124.2	54%	0.535	55%	0.552	S	S	.	*	H	α-helix	trans	-64.5	-39	177.7	-78.1	175.3	171.4	168.2	0	112.7	E87 R88 K95	E87-K91 HydrophobicContact CG-CD 4.41Å; E87-K91 WeakPolarHBondContact O-CB 3.38Å; E87-K91 WeakPolarHBondContact O-CG 3.38Å; E87-K91 PolarHBondContact O-N 3.07Å; E87-K91 WeakPolarHBondContact OE1-CE 3.39Å; E87-K91 IonicContact OE1-NZ 3.84Å; E87-K91 PolarHBondContact OE1-NZ 2.91Å; R88-K91 PolarHBondContact O-N 3.24Å; K91-K95 VanDerWaalsContact O-CB 3.3Å; K91-K95 WeakPolarHBondContact O-CB 3.33Å; K91-K95 PolarHBondContact O-N 3.47Å
92	E	83.4	Confident	88.7	Confident	138 Å²	138	125.9 Å²	125.9	65%	0.645	56%	0.558	S	S	*	*	H	α-helix	trans	-68.1	-39.6	174.8	-80.8	-172.5	162.3	0	0	112.4	R88 K89 K95 R96	R88-E92 WeakPolarHBondContact O-CB 3.49Å; R88-E92 PolarHBondContact O-N 2.87Å; K89-E92 PolarHBondContact O-N 3.16Å; E92-K95 PolarHBondContact O-N 3.31Å; E92-R96 WeakPolarHBondContact O-CB 3.32Å; E92-R96 WeakPolarHBondContact O-CG 3.45Å; E92-R96 PolarHBondContact O-N 3.05Å
93	E	84.3	Confident	88.5	Confident	138 Å²	138	125.6 Å²	125.6	65%	0.645	56%	0.559	S	S	*	*	H	α-helix	trans	-67.4	-42	177.1	-168	173.5	-171.4	0	0	112	K89 K90 R96 K97	K89-E93 WeakPolarHBondContact O-CB 3.16Å; K89-E93 PolarHBondContact O-N 2.97Å; K90-E93 PolarHBondContact O-N 3.37Å; E93-R96 PolarHBondContact O-N 3.17Å; E93-K97 PolarHBondContact O-N 2.75Å
94	E	90.4	Very high	88.2	Confident	131 Å²	131	127.9 Å²	127.9	61%	0.612	57%	0.57	S	S	*	*	H	α-helix	trans	-62.9	-45.2	174.3	-169.4	-167.2	158.7	0	0	111.5	K90 R96 K97 K98	K90-E94 WeakPolarHBondContact O-CB 3.43Å; K90-E94 PolarHBondContact O-N 3.3Å; E94-R96 VanDerWaalsContact C-N 3.33Å; E94-R96 PolarHBondContact O-N 3.43Å; E94-K97 PolarHBondContact O-N 2.96Å; E94-K98 WeakPolarHBondContact O-CB 3.28Å; E94-K98 PolarHBondContact O-N 3.5Å
95	K	91.2	Very high	88.1	Confident	135 Å²	135	129.5 Å²	129.5	59%	0.587	58%	0.58	S	S	*	*	H	α-helix	trans	-62.4	-41.5	177.7	-170.2	-179.2	176.8	-167.4	0	111.4	K91 E92 K98 E99	K91-K95 VanDerWaalsContact O-CB 3.3Å; K91-K95 WeakPolarHBondContact O-CB 3.33Å; K91-K95 PolarHBondContact O-N 3.47Å; E92-K95 PolarHBondContact O-N 3.31Å; K95-K98 PolarHBondContact O-N 3.4Å; K95-E99 VanDerWaalsContact CE-OE1 3.23Å; K95-E99 WeakPolarHBondContact CE-OE1 3.37Å; K95-E99 WeakPolarHBondContact O-CB 3.28Å; K95-E99 WeakPolarHBondContact O-CG 3.11Å; K95-E99 PolarHBondContact O-N 2.97Å
96	R	87.9	Confident	88	Confident	154 Å²	154	130.8 Å²	130.8	58%	0.581	59%	0.585	S	S	*	*	H	α-helix	trans	-61.4	-44.7	173.9	-83.8	-174.5	58.8	-149.4	-12.5	112.1	E92 E93 E94 K98 E99 E100	E92-R96 WeakPolarHBondContact O-CB 3.32Å; E92-R96 WeakPolarHBondContact O-CG 3.45Å; E92-R96 PolarHBondContact O-N 3.05Å; E93-R96 PolarHBondContact O-N 3.17Å; E94-R96 VanDerWaalsContact C-N 3.33Å; E94-R96 PolarHBondContact O-N 3.43Å; R96-K98 VanDerWaalsContact C-N 3.31Å; R96-K98 PolarHBondContact O-N 3.08Å; R96-E99 PolarHBondContact O-N 3.47Å; R96-E100 IonicContact CZ-OE1 2.65Å; R96-E100 IonicContact NE-OE1 2.85Å; R96-E100 IonicContact NH2-OE1 2.83Å; R96-E100 PolarHBondContact NH2-OE1 3.17Å; R96-E100 WeakPolarHBondContact O-CB 3.21Å; R96-E100 WeakPolarHBondContact O-CG 3.28Å; R96-E100 PolarHBondContact O-N 3.23Å
97	K	92.7	Very high	87.7	Confident	159 Å²	159	130.9 Å²	130.9	69%	0.691	58%	0.583	S	S	*	*	H	α-helix	trans	-61.7	-40.4	177.7	-166.1	176.7	-179.2	-177.3	0	111.7	E93 E94 E101	E93-K97 PolarHBondContact O-N 2.75Å; E94-K97 PolarHBondContact O-N 2.96Å; K97-E101 WeakPolarHBondContact O-CB 3.46Å; K97-E101 PolarHBondContact O-N 3.27Å
98	K	88.5	Confident	87.4	Confident	149 Å²	149	127.9 Å²	127.9	65%	0.648	58%	0.577	S	S	*	*	H	α-helix	trans	-69.8	-37.8	177.1	-165.9	171	-172.2	168.1	0	113	E94 K95 R96 K102	E94-K98 WeakPolarHBondContact O-CB 3.28Å; E94-K98 PolarHBondContact O-N 3.5Å; K95-K98 PolarHBondContact O-N 3.4Å; R96-K98 VanDerWaalsContact C-N 3.31Å; R96-K98 PolarHBondContact O-N 3.08Å; K98-K102 WeakPolarHBondContact O-CB 3.49Å; K98-K102 PolarHBondContact O-N 2.92Å
99	E	81.6	Confident	87.3	Confident	108 Å²	108	125.4 Å²	125.4	51%	0.505	57%	0.572	S	S	.	*	H	α-helix	trans	-68.6	-43.7	173.9	-77.5	-179.8	-177.4	0	0	111.5	K95 R96 K102 L103	K95-E99 VanDerWaalsContact CE-OE1 3.23Å; K95-E99 WeakPolarHBondContact CE-OE1 3.37Å; K95-E99 WeakPolarHBondContact O-CB 3.28Å; K95-E99 WeakPolarHBondContact O-CG 3.11Å; K95-E99 PolarHBondContact O-N 2.97Å; R96-E99 PolarHBondContact O-N 3.47Å; E99-K102 PolarHBondContact O-N 3.12Å; E99-L103 WeakPolarHBondContact O-CB 3.35Å; E99-L103 PolarHBondContact O-N 2.95Å
100	E	83.9	Confident	87.2	Confident	103 Å²	103	126.7 Å²	126.7	48%	0.481	58%	0.577	S	S	.	*	H	α-helix	trans	-62.1	-42.4	176	-74.4	175.9	-162.2	0	0	111.6	R96 L103 Q104	R96-E100 IonicContact CZ-OE1 2.65Å; R96-E100 IonicContact NE-OE1 2.85Å; R96-E100 IonicContact NH2-OE1 2.83Å; R96-E100 PolarHBondContact NH2-OE1 3.17Å; R96-E100 WeakPolarHBondContact O-CB 3.21Å; R96-E100 WeakPolarHBondContact O-CG 3.28Å; R96-E100 PolarHBondContact O-N 3.23Å; E100-L103 PolarHBondContact O-N 3.48Å; E100-Q104 WeakPolarHBondContact O-CG 3.33Å; E100-Q104 PolarHBondContact O-N 3.49Å
101	E	89.1	Confident	86.7	Confident	127 Å²	127	126 Å²	126	59%	0.593	57%	0.57	S	S	*	*	H	α-helix	trans	-63.4	-44.7	174.9	-171.2	-169.7	160.3	0	0	112	K97 L103 Q104 K105	K97-E101 WeakPolarHBondContact O-CB 3.46Å; K97-E101 PolarHBondContact O-N 3.27Å; E101-L103 VanDerWaalsContact C-N 3.32Å; E101-L103 PolarHBondContact O-N 3.1Å; E101-Q104 PolarHBondContact O-N 3.28Å; E101-K105 PolarHBondContact O-N 3.37Å
102	K	91.4	Very high	86.4	Confident	150 Å²	150	126.9 Å²	126.9	65%	0.652	58%	0.576	S	S	*	*	H	α-helix	trans	-63	-40.5	178.4	-169.6	179.3	178.3	-172.8	0	111.3	K98 E99 K105 E106	K98-K102 WeakPolarHBondContact O-CB 3.49Å; K98-K102 PolarHBondContact O-N 2.92Å; E99-K102 PolarHBondContact O-N 3.12Å; K102-K105 PolarHBondContact O-N 3.5Å; K102-E106 WeakPolarHBondContact O-CB 3.34Å; K102-E106 PolarHBondContact O-N 2.68Å
103	L	83.5	Confident	86.4	Confident	99 Å²	99	126.2 Å²	126.2	52%	0.518	57%	0.573	S	S	.	*	H	α-helix	trans	-69	-36.1	179.1	-141.9	142.4	0	0	0	111.4	E99 E100 E101 Q107	E99-L103 WeakPolarHBondContact O-CB 3.35Å; E99-L103 PolarHBondContact O-N 2.95Å; E100-L103 PolarHBondContact O-N 3.48Å; E101-L103 VanDerWaalsContact C-N 3.32Å; E101-L103 PolarHBondContact O-N 3.1Å; L103-Q107 HydrophobicContact CD2-CG 4.3Å; L103-Q107 WeakPolarHBondContact O-CB 3.08Å; L103-Q107 WeakPolarHBondContact O-CG 3.45Å; L103-Q107 PolarHBondContact O-N 3.04Å
104	Q	86.1	Confident	86.3	Confident	149 Å²	149	124.5 Å²	124.5	70%	0.696	57%	0.565	S	S	*	*	H	α-helix	trans	-66.6	-41.7	171.9	-74.3	-170.5	12.3	0	0	112.5	E100 E101 Q107 G108	E100-Q104 WeakPolarHBondContact O-CG 3.33Å; E100-Q104 PolarHBondContact O-N 3.49Å; E101-Q104 PolarHBondContact O-N 3.28Å; Q104-Q107 PolarHBondContact O-N 3.01Å; Q104-G108 PolarHBondContact O-N 3.39Å
105	K	86.5	Confident	86	Confident	139 Å²	139	123.3 Å²	123.3	60%	0.604	56%	0.562	S	S	*	*	H	α-helix	trans	-65.6	-39.1	176.5	-167.9	171.8	-173.3	169.4	0	111.9	E101 K102 K109	E101-K105 PolarHBondContact O-N 3.37Å; K102-K105 PolarHBondContact O-N 3.5Å; K105-K109 WeakPolarHBondContact O-CG 3.39Å; K105-K109 PolarHBondContact O-N 3.36Å
106	E	84.6	Confident	85.7	Confident	125 Å²	125	123 Å²	123	58%	0.584	56%	0.561	S	S	*	*	H	α-helix	trans	-68.5	-44.5	175.4	-171.1	177.5	166	0	0	111.7	K102 G108 K109 K110	K102-E106 WeakPolarHBondContact O-CB 3.34Å; K102-E106 PolarHBondContact O-N 2.68Å; E106-G108 VanDerWaalsContact C-N 3.33Å; E106-G108 PolarHBondContact O-N 3.05Å; E106-K109 PolarHBondContact O-N 3.45Å; E106-K110 VanDerWaalsContact O-CB 3.25Å; E106-K110 WeakPolarHBondContact O-CB 3.29Å; E106-K110 PolarHBondContact O-N 3.18Å
107	Q	81.6	Confident	85.3	Confident	93 Å²	93	119.1 Å²	119.1	44%	0.435	56%	0.555	S	S	.	*	H	α-helix	trans	-64.9	-35.8	174.1	-75.7	-148.7	22.6	0	0	112.7	L103 Q104 K110 R111	L103-Q107 HydrophobicContact CD2-CG 4.3Å; L103-Q107 WeakPolarHBondContact O-CB 3.08Å; L103-Q107 WeakPolarHBondContact O-CG 3.45Å; L103-Q107 PolarHBondContact O-N 3.04Å; Q104-Q107 PolarHBondContact O-N 3.01Å; Q107-K110 PolarHBondContact O-N 2.82Å; Q107-R111 WeakPolarHBondContact O-CB 3.4Å; Q107-R111 VanDerWaalsContact O-CG 3.3Å; Q107-R111 WeakPolarHBondContact O-CG 3.27Å; Q107-R111 PolarHBondContact O-N 3.09Å
108	G	86.4	Confident	84.6	Confident	32 Å²	32	115.5 Å²	115.5	33%	0.33	54%	0.54	S	S	.	.	H	α-helix	trans	-61.5	-51.5	173.7	0	0	0	0	0	111.7	Q104 E106 K110 R111 E112	Q104-G108 PolarHBondContact O-N 3.39Å; E106-G108 VanDerWaalsContact C-N 3.33Å; E106-G108 PolarHBondContact O-N 3.05Å; G108-K110 PolarHBondContact O-N 3.22Å; G108-R111 PolarHBondContact O-N 2.99Å; G108-E112 PolarHBondContact O-N 3.26Å
109	K	88.3	Confident	84.1	Confident	120 Å²	120	117.6 Å²	117.6	52%	0.522	54%	0.544	S	S	.	.	H	α-helix	trans	-60.6	-43.5	175.5	-76.5	-174.8	174.5	-166.9	0	112.4	K105 E106 R111 E112 E113	K105-K109 WeakPolarHBondContact O-CG 3.39Å; K105-K109 PolarHBondContact O-N 3.36Å; E106-K109 PolarHBondContact O-N 3.45Å; K109-R111 PolarHBondContact O-N 3.02Å; K109-E112 PolarHBondContact O-N 3.34Å; K109-E113 WeakPolarHBondContact O-CB 3.32Å; K109-E113 WeakPolarHBondContact O-CG 3.38Å; K109-E113 PolarHBondContact O-N 3.45Å
110	K	87.4	Confident	84.1	Confident	133 Å²	133	115.7 Å²	115.7	58%	0.578	54%	0.535	S	S	*	.	H	α-helix	trans	-63.5	-41.6	178.5	-170.2	175.6	-179.4	179.8	0	111.4	E106 Q107 G108 E112 E113 E114	E106-K110 VanDerWaalsContact O-CB 3.25Å; E106-K110 WeakPolarHBondContact O-CB 3.29Å; E106-K110 PolarHBondContact O-N 3.18Å; Q107-K110 PolarHBondContact O-N 2.82Å; G108-K110 PolarHBondContact O-N 3.22Å; K110-E112 VanDerWaalsContact C-N 3.35Å; K110-E113 PolarHBondContact O-N 3.36Å; K110-E114 WeakPolarHBondContact O-CB 3.44Å; K110-E114 PolarHBondContact O-N 3.4Å
111	R	82	Confident	83.5	Confident	142 Å²	142	116.7 Å²	116.7	54%	0.536	54%	0.54	S	S	.	.	H	α-helix	trans	-66	-36.3	174.3	-73.5	-176.1	-145.4	130.2	4.6	112.3	Q107 G108 K109 L115	Q107-R111 WeakPolarHBondContact O-CB 3.4Å; Q107-R111 VanDerWaalsContact O-CG 3.3Å; Q107-R111 WeakPolarHBondContact O-CG 3.27Å; Q107-R111 PolarHBondContact O-N 3.09Å; G108-R111 PolarHBondContact O-N 2.99Å; K109-R111 PolarHBondContact O-N 3.02Å; R111-L115 VanDerWaalsContact O-CB 3.27Å; R111-L115 WeakPolarHBondContact O-CB 2.96Å; R111-L115 WeakPolarHBondContact O-CD1 3.33Å; R111-L115 VanDerWaalsContact O-CG 3.24Å; R111-L115 WeakPolarHBondContact O-CG 3.21Å; R111-L115 PolarHBondContact O-N 3.25Å
112	E	83.7	Confident	82.9	Confident	140 Å²	140	117.3 Å²	117.3	65%	0.654	54%	0.54	S	S	*	.	H	α-helix	trans	-68.4	-45.5	176.1	-172.8	178	-177.4	0	0	111.7	G108 K109 K110 L115 K116	G108-E112 PolarHBondContact O-N 3.26Å; K109-E112 PolarHBondContact O-N 3.34Å; K110-E112 VanDerWaalsContact C-N 3.35Å; E112-L115 PolarHBondContact O-N 2.71Å; E112-K116 WeakPolarHBondContact O-CB 3.47Å; E112-K116 PolarHBondContact O-N 3.21Å
113	E	82.9	Confident	82	Confident	124 Å²	124	117.1 Å²	117.1	58%	0.579	54%	0.542	S	S	*	.	H	α-helix	trans	-63.3	-40.7	173.7	-74.6	177.4	-174.9	0	0	111.4	K109 K110 K116 T117	K109-E113 WeakPolarHBondContact O-CB 3.32Å; K109-E113 WeakPolarHBondContact O-CG 3.38Å; K109-E113 PolarHBondContact O-N 3.45Å; K110-E113 PolarHBondContact O-N 3.36Å; E113-K116 WeakPolarHBondContact O-CB 3.34Å; E113-K116 PolarHBondContact O-N 2.88Å; E113-T117 WeakPolarHBondContact O-CG2 3.36Å; E113-T117 PolarHBondContact O-N 3.33Å; E113-T117 PolarHBondContact O-OG1 3.38Å
114	E	83.2	Confident	81	Confident	102 Å²	102	119.7 Å²	119.7	48%	0.477	55%	0.545	S	S	.	.	H	α-helix	trans	-69.6	-35	177.4	-165.8	169.2	-150.4	0	0	111.9	K110 T117 Q118	K110-E114 WeakPolarHBondContact O-CB 3.44Å; K110-E114 PolarHBondContact O-N 3.4Å; E114-T117 VanDerWaalsContact CA-OG1 3.29Å; E114-T117 WeakPolarHBondContact CA-OG1 3.43Å; E114-T117 PolarHBondContact O-OG1 3.19Å; E114-Q118 WeakPolarHBondContact O-CB 3.49Å; E114-Q118 VanDerWaalsContact O-CG 3.31Å; E114-Q118 WeakPolarHBondContact O-CG 3.3Å; E114-Q118 PolarHBondContact O-N 3.26Å
115	L	82.5	Confident	79.9	Confident	106 Å²	106	115.3 Å²	115.3	56%	0.555	53%	0.534	S	S	*	.	H	α-helix	trans	-68.2	-37	170.3	-81.1	165.8	0	0	0	111.8	R111 E112 R119	R111-L115 VanDerWaalsContact O-CB 3.27Å; R111-L115 WeakPolarHBondContact O-CB 2.96Å; R111-L115 WeakPolarHBondContact O-CD1 3.33Å; R111-L115 VanDerWaalsContact O-CG 3.24Å; R111-L115 WeakPolarHBondContact O-CG 3.21Å; R111-L115 PolarHBondContact O-N 3.25Å; E112-L115 PolarHBondContact O-N 2.71Å; L115-R119 WeakPolarHBondContact O-CB 3.3Å; L115-R119 WeakPolarHBondContact O-CG 3.2Å; L115-R119 PolarHBondContact O-N 2.85Å
116	K	86.9	Confident	78.9	Confident	130 Å²	130	115 Å²	115	57%	0.565	54%	0.543	S	S	*	.	H	α-helix	trans	-69	-48.6	175.9	-176.7	-178.7	172.8	-172.8	0	111	E112 E113 Q118 R119 E120	E112-K116 WeakPolarHBondContact O-CB 3.47Å; E112-K116 PolarHBondContact O-N 3.21Å; E113-K116 WeakPolarHBondContact O-CB 3.34Å; E113-K116 PolarHBondContact O-N 2.88Å; K116-Q118 VanDerWaalsContact C-N 3.35Å; K116-Q118 PolarHBondContact O-N 3.47Å; K116-R119 WeakPolarHBondContact O-CB 3.28Å; K116-R119 PolarHBondContact O-N 3.06Å; K116-R119 VanDerWaalsContact O-N 3.11Å; K116-E120 WeakPolarHBondContact CE-OE1 3.4Å; K116-E120 WeakPolarHBondContact O-CG 3.37Å; K116-E120 PolarHBondContact O-N 3.34Å
117	T	79.5	Confident	78	Confident	72 Å²	72	115.5 Å²	115.5	44%	0.442	55%	0.549	S	S	.	.	H	α-helix	trans	-65.3	-37.3	175.1	52.2	0	0	0	0	111	E113 E114 R119 E120 E121	E113-T117 WeakPolarHBondContact O-CG2 3.36Å; E113-T117 PolarHBondContact O-N 3.33Å; E113-T117 PolarHBondContact O-OG1 3.38Å; E114-T117 VanDerWaalsContact CA-OG1 3.29Å; E114-T117 WeakPolarHBondContact CA-OG1 3.43Å; E114-T117 PolarHBondContact O-OG1 3.19Å; T117-R119 VanDerWaalsContact C-N 3.3Å; T117-R119 PolarHBondContact O-N 3.24Å; T117-E120 CarbonylContact O-C 3.6Å; T117-E120 PolarHBondContact O-N 3.38Å; T117-E121 WeakPolarHBondContact O-CA 3.27Å; T117-E121 WeakPolarHBondContact O-CB 3.16Å; T117-E121 PolarHBondContact O-N 3.31Å
118	Q	77.6	Confident	76.7	Confident	83 Å²	83	116.1 Å²	116.1	39%	0.388	56%	0.555	S	S	.	*	H	α-helix	trans	-64.6	-33.1	171.4	-84.4	-168.1	27.5	0	0	112.7	E114 K116 K122	E114-Q118 WeakPolarHBondContact O-CB 3.49Å; E114-Q118 VanDerWaalsContact O-CG 3.31Å; E114-Q118 WeakPolarHBondContact O-CG 3.3Å; E114-Q118 PolarHBondContact O-N 3.26Å; K116-Q118 VanDerWaalsContact C-N 3.35Å; K116-Q118 PolarHBondContact O-N 3.47Å; Q118-K122 WeakPolarHBondContact O-CB 3.12Å; Q118-K122 WeakPolarHBondContact O-CD 3.47Å; Q118-K122 WeakPolarHBondContact O-CG 3.49Å; Q118-K122 PolarHBondContact O-N 3.46Å
119	R	78.2	Confident	75.1	Confident	192 Å²	192	117.9 Å²	117.9	73%	0.725	57%	0.573	S	S	*	*	H	α-helix	trans	-68	-46.1	172.7	-81.6	177.7	178.3	169.3	1	111	L115 K116 T117 E121 K122 Q123	L115-R119 WeakPolarHBondContact O-CB 3.3Å; L115-R119 WeakPolarHBondContact O-CG 3.2Å; L115-R119 PolarHBondContact O-N 2.85Å; K116-R119 WeakPolarHBondContact O-CB 3.28Å; K116-R119 PolarHBondContact O-N 3.06Å; K116-R119 VanDerWaalsContact O-N 3.11Å; T117-R119 VanDerWaalsContact C-N 3.3Å; T117-R119 PolarHBondContact O-N 3.24Å; R119-E121 VanDerWaalsContact C-N 3.34Å; R119-K122 PolarHBondContact O-N 3.19Å; R119-Q123 WeakPolarHBondContact O-CG 3.33Å; R119-Q123 PolarHBondContact O-N 3.05Å
120	E	79.8	Confident	73.4	Confident	69 Å²	69	120.8 Å²	120.8	32%	0.322	59%	0.586	S	S	.	*	H	α-helix	trans	-67.2	-34.9	177.1	-69.9	177.9	-164.4	0	0	112.1	K116 T117 Q123 R124	K116-E120 WeakPolarHBondContact CE-OE1 3.4Å; K116-E120 WeakPolarHBondContact O-CG 3.37Å; K116-E120 PolarHBondContact O-N 3.34Å; T117-E120 CarbonylContact O-C 3.6Å; T117-E120 PolarHBondContact O-N 3.38Å; E120-Q123 CarbonylContact O-C 3.11Å; E120-Q123 WeakPolarHBondContact O-CB 3.43Å; E120-Q123 PolarHBondContact O-N 3.29Å; E120-R124 WeakPolarHBondContact O-CB 3.48Å; E120-R124 VanDerWaalsContact O-CG 3.23Å; E120-R124 WeakPolarHBondContact O-CG 3.02Å; E120-R124 PolarHBondContact O-N 3.42Å
121	E	73.3	Confident	71.2	Confident	123 Å²	123	121.2 Å²	121.2	58%	0.575	59%	0.594	S	S	*	*	H	α-helix	trans	-78.8	-35.8	178.2	-168.2	178	-156.1	0	0	110.3	T117 R119 Q123 R124 A125	T117-E121 WeakPolarHBondContact O-CA 3.27Å; T117-E121 WeakPolarHBondContact O-CB 3.16Å; T117-E121 PolarHBondContact O-N 3.31Å; R119-E121 VanDerWaalsContact C-N 3.34Å; E121-Q123 PolarHBondContact O-N 3.12Å; E121-R124 CarbonylContact O-C 3.5Å; E121-R124 PolarHBondContact O-N 2.99Å; E121-A125 WeakPolarHBondContact O-CA 3.49Å; E121-A125 WeakPolarHBondContact O-CB 3.44Å; E121-A125 PolarHBondContact O-N 2.86Å
122	K	76.2	Confident	69.1	Low	140 Å²	140	120.2 Å²	120.2	61%	0.609	60%	0.603	S	S	*	*	H	α-helix	trans	-60.1	-34.8	165.5	-76.7	169.8	-174.9	175.9	0	110.8	Q118 R119 V126	Q118-K122 WeakPolarHBondContact O-CB 3.12Å; Q118-K122 WeakPolarHBondContact O-CD 3.47Å; Q118-K122 WeakPolarHBondContact O-CG 3.49Å; Q118-K122 PolarHBondContact O-N 3.46Å; R119-K122 PolarHBondContact O-N 3.19Å; K122-V126 WeakPolarHBondContact O-CG2 3.5Å; K122-V126 PolarHBondContact O-N 2.72Å
123	Q	70.8	Confident	66.9	Low	147 Å²	147	122.5 Å²	122.5	69%	0.687	61%	0.611	S	S	*	*	H	α-helix	trans	-72	-41.5	172	-71.5	178	-4.1	0	0	112.7	R119 E120 E121 L127	R119-Q123 WeakPolarHBondContact O-CG 3.33Å; R119-Q123 PolarHBondContact O-N 3.05Å; E120-Q123 CarbonylContact O-C 3.11Å; E120-Q123 WeakPolarHBondContact O-CB 3.43Å; E120-Q123 PolarHBondContact O-N 3.29Å; E121-Q123 PolarHBondContact O-N 3.12Å; Q123-L127 PolarHBondContact O-N 2.96Å
124	R	63.6	Low	64.6	Low	153 Å²	153	121.6 Å²	121.6	58%	0.577	62%	0.619	S	S	*	*	H	α-helix	trans	-78.5	-33.6	-178.2	-73.2	176	-170	-159.4	7	113.3	E120 E121 V126 L127 L128	E120-R124 WeakPolarHBondContact O-CB 3.48Å; E120-R124 VanDerWaalsContact O-CG 3.23Å; E120-R124 WeakPolarHBondContact O-CG 3.02Å; E120-R124 PolarHBondContact O-N 3.42Å; E121-R124 CarbonylContact O-C 3.5Å; E121-R124 PolarHBondContact O-N 2.99Å; R124-V126 VanDerWaalsContact C-N 3.33Å; R124-L127 CarbonylContact O-C 3.57Å; R124-L127 WeakPolarHBondContact O-CA 3.23Å; R124-L127 WeakPolarHBondContact O-CB 3.36Å; R124-L127 PolarHBondContact O-N 3.31Å; R124-L128 WeakPolarHBondContact O-CA 3.38Å; R124-L128 VanDerWaalsContact O-CB 3.24Å; R124-L128 WeakPolarHBondContact O-CB 3.35Å; R124-L128 PolarHBondContact O-N 3.47Å
125	A	63.2	Low	62.2	Low	57 Å²	57	126.3 Å²	126.3	47%	0.471	64%	0.641	S	S	.	*	H	α-helix	trans	-73.6	-27.9	176.4	0	0	0	0	0	111.1	E121 L127 G129	E121-A125 WeakPolarHBondContact O-CA 3.49Å; E121-A125 WeakPolarHBondContact O-CB 3.44Å; E121-A125 PolarHBondContact O-N 2.86Å; A125-L127 PolarHBondContact O-N 3.3Å; A125-G129 WeakPolarHBondContact O-CA 3.49Å; A125-G129 PolarHBondContact O-N 3.29Å
126	V	66.1	Low	59.8	Low	131 Å²	131	127 Å²	127	79%	0.794	66%	0.655	S	S	*	*	H	α-helix	trans	-62.9	-33.2	162.9	169.8	0	0	0	0	110.8	K122 R124	K122-V126 WeakPolarHBondContact O-CG2 3.5Å; K122-V126 PolarHBondContact O-N 2.72Å; R124-V126 VanDerWaalsContact C-N 3.33Å
127	L	64.4	Low	57.3	Low	136 Å²	136	130.9 Å²	130.9	71%	0.712	67%	0.671	S	S	*	*	H	α-helix	trans	-87.6	-31.2	179.6	-167.1	65	0	0	0	114.6	Q123 R124 A125	Q123-L127 PolarHBondContact O-N 2.96Å; R124-L127 CarbonylContact O-C 3.57Å; R124-L127 WeakPolarHBondContact O-CA 3.23Å; R124-L127 WeakPolarHBondContact O-CB 3.36Å; R124-L127 PolarHBondContact O-N 3.31Å; A125-L127 PolarHBondContact O-N 3.3Å
128	L	53.7	Low	55.1	Low	106 Å²	106	137.5 Å²	137.5	56%	0.555	69%	0.694	S	S	*	*	H	α-helix	trans	-117.5	-3.2	-169.7	-70	171.9	0	0	0	113.4	R124 F130 L131	R124-L128 WeakPolarHBondContact O-CA 3.38Å; R124-L128 VanDerWaalsContact O-CB 3.24Å; R124-L128 WeakPolarHBondContact O-CB 3.35Å; R124-L128 PolarHBondContact O-N 3.47Å; L128-F130 PolarHBondContact O-N 2.87Å; L128-L131 PolarHBondContact O-N 3.49Å
129	G	54.5	Low	53	Low	69 Å²	69	143 Å²	143	71%	0.711	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.8	-3.6	161.1	0	0	0	0	0	113.2	A125	A125-G129 WeakPolarHBondContact O-CA 3.49Å; A125-G129 PolarHBondContact O-N 3.29Å
130	F	52.1	Low	51	Low	182 Å²	182	140.5 Å²	140.5	80%	0.798	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.3	-10.1	169.7	-158.5	-100.3	0	0	0	115.3	L128	L128-F130 PolarHBondContact O-N 2.87Å
131	L	42	Very low	49	Very low	141 Å²	141	145.2 Å²	145.2	74%	0.738	75%	0.754	S	S	*	*			trans	-133.7	81.6	-172.2	-152.1	65.6	0	0	0	114.5	L128	L128-L131 PolarHBondContact O-N 3.49Å
132	V	36.4	Very low	47.5	Very low	121 Å²	121	146.1 Å²	146.1	73%	0.733	77%	0.767	S	S	*	*			trans	-41.3	139	164.7	177.4	0	0	0	0	114.8
133	K	37.5	Very low	45.9	Very low	188 Å²	188	147.4 Å²	147.4	82%	0.817	78%	0.779	S	S	*	*				155.1	139.1	116	-156.2	87	168.4	-172.2	0	112.4
134	S	35.6	Very low	44.7	Very low	106 Å²	106	146 Å²	146	74%	0.741	79%	0.785	S	S	*	*			trans	-78.9	141.2	-173.5	51.2	0	0	0	0	116.1
135	E	32.2	Very low	44	Very low	200 Å²	200	142.5 Å²	142.5	94%	0.935	80%	0.797	S	S	*	*			trans	-118.1	152.8	173.9	-68.1	-169.5	159.4	0	0	113.6
136	S	32.9	Very low	43.3	Very low	122 Å²	122	145 Å²	145	85%	0.853	81%	0.807	S	S	*	*			trans	-119.7	147	-161.6	51.2	0	0	0	0	114.5
137	K	33.4	Very low	43.1	Very low	210 Å²	210	146.6 Å²	146.6	91%	0.913	81%	0.811	S	S	*	*			trans	-85.8	159.4	-170.7	-62.1	171.4	175.8	177	0	114.7
138	K	33.7	Very low	42.9	Very low	212 Å²	212	142.6 Å²	142.6	92%	0.922	79%	0.794	S	S	*	*			trans	-146	153.5	172.4	-77.4	-172.3	177.2	177.4	0	113.8
139	E	33.9	Very low	43.9	Very low	197 Å²	197	140.6 Å²	140.6	92%	0.921	80%	0.799	S	S	*	*			trans	-112.8	172	-159.5	-61.5	168.6	167.7	0	0	114.3
140	T	35.4	Very low	45.1	Very low	140 Å²	140	143.5 Å²	143.5	86%	0.859	81%	0.805	S	S	*	*			trans	-132.4	151.4	-166	44.2	0	0	0	0	115.1
141	N	39.1	Very low	45.9	Very low	169 Å²	169	142.9 Å²	142.9	90%	0.904	80%	0.802	S	S	*	*			trans	-108.1	161.5	-164.7	-74.2	-35.9	0	0	0	117
142	T	40.7	Very low	47.5	Very low	141 Å²	141	144.1 Å²	144.1	87%	0.865	81%	0.808	S	S	*	*			trans	-120.2	153.7	-170.4	-50.8	0	0	0	0	113.2
143	I	42.4	Very low	49.3	Very low	168 Å²	168	143.3 Å²	143.3	86%	0.862	80%	0.796	S	S	*	*			trans	-133.3	149.1	-175.1	-60.2	171.9	0	0	0	113
144	S	45.6	Very low	50.9	Low	116 Å²	116	141.2 Å²	141.2	81%	0.811	79%	0.787	S	S	*	*			trans	-90.4	152.5	-169.5	54.7	0	0	0	0	117.3
145	G	49.2	Very low	52.9	Low	80 Å²	80	144 Å²	144	83%	0.825	79%	0.789	S	S	*	*			trans	-105.1	167.1	-171.1	0	0	0	0	0	118.6
146	T	49.1	Very low	55.2	Low	111 Å²	111	137.9 Å²	137.9	68%	0.681	77%	0.765	S	S	*	*			trans	-132.9	146.3	177.3	-59.8	0	0	0	0	110.4
147	D	60.4	Low	57.5	Low	163 Å²	163	140.4 Å²	140.4	87%	0.872	76%	0.756	S	S	*	*			trans	-87.7	133.6	-166.6	-138.2	-6.6	0	0	0	113.2
148	C	60.5	Low	59.9	Low	53 Å²	53	141.1 Å²	141.1	36%	0.358	76%	0.759	S	S	.	*			trans	-143.3	39.2	-164.5	40.2	0	0	0	0	115.1	F151 Q153	C148-F151 PolarHBondContact SG-O 3.2Å; C148-Q153 HydrophobicContact CB-CB 4.13Å; C148-Q153 WeakPolarHBondContact SG-CB 3.24Å; C148-Q153 PolarHBondContact SG-N 3.16Å
149	G	75.3	Confident	62.3	Low	64 Å²	64	137 Å²	137	66%	0.66	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	61.5	-158.5	173.5	0	0	0	0	0	114	F151	G149-F151 PolarHBondContact O-N 2.86Å
150	P	80	Confident	64.8	Low	129 Å²	129	131.4 Å²	131.4	84%	0.838	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	-7.4	-177.2	-17.6	29.8	0	0	0	114.7
151	F	68.4	Low	66.9	Low	170 Å²	170	136 Å²	136	75%	0.746	72%	0.723	S	S	*	*	S	Bend	trans	-111.1	134.1	-174.8	-62.7	-77.2	0	0	0	109.7	C148 G149 Q153	C148-F151 PolarHBondContact SG-O 3.2Å; G149-F151 PolarHBondContact O-N 2.86Å; F151-Q153 PolarHBondContact O-N 2.9Å
152	I	75.5	Confident	68.8	Low	167 Å²	167	134.6 Å²	134.6	86%	0.856	71%	0.713	S	S	*	*			trans	-59.8	135	173.7	-48.7	169.5	0	0	0	108.1	F154	I152-F154 PolarHBondContact O-N 3.18Å
153	Q	74.4	Confident	70.7	Confident	103 Å²	103	132 Å²	132	48%	0.481	71%	0.706	S	S	.	*			trans	-57	126.4	175	-164	166.2	1.2	0	0	108.5	C148 F151 E155	C148-Q153 HydrophobicContact CB-CB 4.13Å; C148-Q153 WeakPolarHBondContact SG-CB 3.24Å; C148-Q153 PolarHBondContact SG-N 3.16Å; F151-Q153 PolarHBondContact O-N 2.9Å; Q153-E155 PolarHBondContact O-N 3.33Å
154	F	71.2	Confident	72.6	Confident	144 Å²	144	128.9 Å²	128.9	63%	0.632	70%	0.697	S	S	*	*			trans	-67.2	103.9	174.5	-164.9	-95.2	0	0	0	108.5	I152 V156 M160	I152-F154 PolarHBondContact O-N 3.18Å; F154-V156 HydrophobicContact CD1-CG2 4.49Å; F154-V156 PolarHBondContact O-N 3.37Å; F154-V156 VanDerWaalsContact O-N 3.1Å; F154-M160 HydrophobicContact CE1-CE 3.69Å; F154-M160 HydrophobicContact CZ-CE 3.85Å
155	E	78.7	Confident	74.2	Confident	165 Å²	165	131.5 Å²	131.5	77%	0.771	70%	0.701	S	S	*	*			trans	-68.9	107	174.6	-73.4	-175.8	178.9	0	0	109.2	Q153 R157	Q153-E155 PolarHBondContact O-N 3.33Å; E155-R157 PolarHBondContact O-N 3.27Å; E155-R157 VanDerWaalsContact O-N 3.08Å
156	V	78.7	Confident	75.7	Confident	72 Å²	72	132.5 Å²	132.5	44%	0.436	68%	0.684	S	S	.	*			trans	-69.3	106.7	169.5	-174.7	0	0	0	0	107.2	F154 M160 M162	F154-V156 HydrophobicContact CD1-CG2 4.49Å; F154-V156 PolarHBondContact O-N 3.37Å; F154-V156 VanDerWaalsContact O-N 3.1Å; V156-M160 HydrophobicContact CG1-CB 3.9Å; V156-M160 VanDerWaalsContact CG1-O 3.3Å; V156-M160 WeakPolarHBondContact CG1-O 3.43Å; V156-M162 HydrophobicContact CG1-CG 4.37Å; V156-M162 HydrophobicContact CG2-CG 3.87Å; V156-M162 HydrophobicContact CG2-SD 3.71Å
157	R	82.1	Confident	77.2	Confident	174 Å²	174	139.1 Å²	139.1	66%	0.657	70%	0.696	S	S	*	*			trans	-61.9	160	176	-63.8	177.9	171.7	161.4	-1.3	111.1	E155 D159 M160	E155-R157 PolarHBondContact O-N 3.27Å; E155-R157 VanDerWaalsContact O-N 3.08Å; R157-D159 WeakPolarHBondContact CB-OD1 3.46Å; R157-D159 PolarHBondContact O-N 3.09Å; R157-D159 VanDerWaalsContact O-N 3.11Å; R157-M160 HydrophobicContact CB-CB 4.32Å; R157-M160 HydrophobicContact CB-CG 3.93Å; R157-M160 HydrophobicContact CB-SD 3.91Å; R157-M160 HydrophobicContact CG-SD 3.93Å; R157-M160 WeakPolarHBondContact O-CB 3.21Å; R157-M160 PolarHBondContact O-N 2.93Å
158	K	84	Confident	78.1	Confident	226 Å²	226	135 Å²	135	98%	0.983	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.2	-24.7	-179.2	-66.2	-178.2	-179.5	177.6	0	113.8
159	D	84.2	Confident	79.3	Confident	126 Å²	126	136 Å²	136	67%	0.674	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	-6.9	177.1	62.6	-43.3	0	0	0	113.3	R157	R157-D159 WeakPolarHBondContact CB-OD1 3.46Å; R157-D159 PolarHBondContact O-N 3.09Å; R157-D159 VanDerWaalsContact O-N 3.11Å
160	M	85.1	Confident	79.9	Confident	78 Å²	78	138.6 Å²	138.6	38%	0.384	68%	0.675	S	S	.	*			trans	-97.3	138.1	179.8	-66.5	179.5	73.1	0	0	110.6	F154 V156 R157	F154-M160 HydrophobicContact CE1-CE 3.69Å; F154-M160 HydrophobicContact CZ-CE 3.85Å; V156-M160 HydrophobicContact CG1-CB 3.9Å; V156-M160 VanDerWaalsContact CG1-O 3.3Å; V156-M160 WeakPolarHBondContact CG1-O 3.43Å; R157-M160 HydrophobicContact CB-CB 4.32Å; R157-M160 HydrophobicContact CB-CG 3.93Å; R157-M160 HydrophobicContact CB-SD 3.91Å; R157-M160 HydrophobicContact CG-SD 3.93Å; R157-M160 WeakPolarHBondContact O-CB 3.21Å; R157-M160 PolarHBondContact O-N 2.93Å
161	R	80.6	Confident	80.3	Confident	237 Å²	237	136.1 Å²	136.1	89%	0.894	67%	0.665	S	S	*	*			trans	-125.4	126	178	30.4	-178.2	168.9	-171.9	-2.8	108.1
162	M	79.8	Confident	81	Confident	139 Å²	139	131.5 Å²	131.5	69%	0.685	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-66.1	137.4	177.5	-68.2	-64.1	-77.8	0	0	109.7	V156	V156-M162 HydrophobicContact CG1-CG 4.37Å; V156-M162 HydrophobicContact CG2-CG 3.87Å; V156-M162 HydrophobicContact CG2-SD 3.71Å
163	A	80	Confident	81.4	Confident	88 Å²	88	124.4 Å²	124.4	73%	0.727	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-63.6	137.8	173.9	0	0	0	0	0	109.6	L165	A163-L165 PolarHBondContact O-N 3.26Å
164	P	81.4	Confident	82.1	Confident	102 Å²	102	122.2 Å²	122.2	66%	0.662	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-58.4	134.6	175	-23	32.6	0	0	0	111.2	H166	P164-H166 WeakPolarHBondContact CB-O 3.05Å; P164-H166 PolarHBondContact O-N 3.15Å
165	L	80.9	Confident	82.7	Confident	171 Å²	171	118.1 Å²	118.1	90%	0.895	60%	0.597	S	S	*	*	S	Bend	trans	-55.1	-42.5	173.9	-76.1	158.9	0	0	0	111.4	A163	A163-L165 PolarHBondContact O-N 3.26Å
166	H	79.2	Confident	82.8	Confident	100 Å²	100	114.4 Å²	114.4	46%	0.463	58%	0.579	S	S	.	*			trans	-116.9	124.6	176.1	-55.8	110.1	0	0	0	109.2	P164 M168 L173	P164-H166 WeakPolarHBondContact CB-O 3.05Å; P164-H166 PolarHBondContact O-N 3.15Å; H166-M168 PolarHBondContact O-N 3.03Å; H166-L173 HydrophobicContact CB-CD1 3.93Å; H166-L173 WeakPolarHBondContact CD2-CD1 3.28Å
167	R	80.6	Confident	83.1	Confident	250 Å²	250	116.6 Å²	116.6	94%	0.943	58%	0.584	S	S	*	*	S	Bend	trans	-71.9	-5.7	173.3	-63.8	-179.3	-177.7	-119.6	1.3	113
168	M	80.3	Confident	83.3	Confident	78 Å²	78	111.2 Å²	111.2	38%	0.384	57%	0.573	S	S	.	*	S	Bend	trans	-107.4	153	177.9	-62.8	-170	-55.1	0	0	109.6	H166 L172 K176	H166-M168 PolarHBondContact O-N 3.03Å; M168-L172 HydrophobicContact CB-CD2 4.26Å; M168-L172 HydrophobicContact CG-CD2 4.34Å; M168-L172 HydrophobicContact SD-CD2 4.03Å; M168-K176 HydrophobicContact CE-CD 4.08Å; M168-K176 HydrophobicContact SD-CD 4.27Å; M168-K176 PolarHBondContact SD-NZ 3.19Å; M168-K176 VanDerWaalsContact SD-NZ 3.37Å
169	S	85.7	Confident	83.3	Confident	74 Å²	74	102.1 Å²	102.1	52%	0.517	54%	0.535	S	S	.	.			trans	-61	146.9	172.1	64.2	0	0	0	0	110.7	A171 L172 L173	S169-A171 PolarHBondContact O-N 3.33Å; S169-L172 PolarHBondContact O-N 2.91Å; S169-L172 VanDerWaalsContact O-N 3.12Å; S169-L172 WeakPolarHBondContact OG-CB 3.31Å; S169-L172 PolarHBondContact OG-N 3.21Å; S169-L173 PolarHBondContact O-N 3.33Å
170	Q	87.6	Confident	83.1	Confident	117 Å²	117	100.2 Å²	100.2	55%	0.547	52%	0.524	S	S	.	.	H	α-helix	trans	-58.4	-38.9	-179.2	-171.4	61.8	24.8	0	0	111.8	L172 L173 S174	Q170-L172 PolarHBondContact O-N 2.85Å; Q170-L173 WeakPolarHBondContact O-CB 3.29Å; Q170-L173 PolarHBondContact O-N 3.03Å; Q170-S174 PolarHBondContact O-N 3.37Å; Q170-S174 PolarHBondContact O-OG 2.91Å
171	A	88.3	Confident	83	Confident	77 Å²	77	100.2 Å²	100.2	64%	0.636	52%	0.523	S	S	*	.	H	α-helix	trans	-60.5	-43.5	176.3	0	0	0	0	0	112.5	S169 L173 S174 S175	S169-A171 PolarHBondContact O-N 3.33Å; A171-L173 VanDerWaalsContact C-N 3.33Å; A171-S174 PolarHBondContact O-N 3.37Å; A171-S175 WeakPolarHBondContact O-CB 3.36Å; A171-S175 PolarHBondContact O-N 3.43Å
172	L	83.4	Confident	83.1	Confident	74 Å²	74	92.4 Å²	92.4	39%	0.387	50%	0.499	S	S	.	.	H	α-helix	trans	-67.3	-36.7	177.5	-177.4	64	0	0	0	111.5	M168 S169 Q170 K176	M168-L172 HydrophobicContact CB-CD2 4.26Å; M168-L172 HydrophobicContact CG-CD2 4.34Å; M168-L172 HydrophobicContact SD-CD2 4.03Å; S169-L172 PolarHBondContact O-N 2.91Å; S169-L172 VanDerWaalsContact O-N 3.12Å; S169-L172 WeakPolarHBondContact OG-CB 3.31Å; S169-L172 PolarHBondContact OG-N 3.21Å; Q170-L172 PolarHBondContact O-N 2.85Å; L172-K176 WeakPolarHBondContact O-CB 3.41Å; L172-K176 WeakPolarHBondContact O-CG 3.33Å; L172-K176 PolarHBondContact O-N 3.46Å
173	L	84.1	Confident	83	Confident	17 Å²	17	85.9 Å²	85.9	9%	0.089	47%	0.467	C	S	.	.	H	α-helix	trans	-62.8	-51.1	175.6	-170.1	161.6	0	0	0	110.7	H166 S169 Q170 A171 S175 K176 Q177	H166-L173 HydrophobicContact CB-CD1 3.93Å; H166-L173 WeakPolarHBondContact CD2-CD1 3.28Å; S169-L173 PolarHBondContact O-N 3.33Å; Q170-L173 WeakPolarHBondContact O-CB 3.29Å; Q170-L173 PolarHBondContact O-N 3.03Å; A171-L173 VanDerWaalsContact C-N 3.33Å; L173-S175 VanDerWaalsContact C-N 3.34Å; L173-S175 PolarHBondContact O-N 3Å; L173-K176 PolarHBondContact O-N 3.47Å; L173-Q177 HydrophobicContact CD2-CG 3.98Å; L173-Q177 WeakPolarHBondContact O-CG 3.4Å; L173-Q177 PolarHBondContact O-N 2.87Å
174	S	88.2	Confident	82.9	Confident	57 Å²	57	88.2 Å²	88.2	40%	0.399	46%	0.457	S	S	.	.	H	α-helix	trans	-60.7	-41.6	178	-65.9	0	0	0	0	112.3	Q170 A171 Q177 S178	Q170-S174 PolarHBondContact O-N 3.37Å; Q170-S174 PolarHBondContact O-OG 2.91Å; A171-S174 PolarHBondContact O-N 3.37Å; S174-Q177 PolarHBondContact O-N 3.43Å; S174-S178 PolarHBondContact O-N 3.37Å
175	S	85	Confident	83	Confident	58 Å²	58	87.8 Å²	87.8	41%	0.406	45%	0.446	S	S	.	.	H	α-helix	trans	-60.5	-46.4	174.1	172.1	0	0	0	0	111.9	A171 L173 Q177 S178 N179	A171-S175 WeakPolarHBondContact O-CB 3.36Å; A171-S175 PolarHBondContact O-N 3.43Å; L173-S175 VanDerWaalsContact C-N 3.34Å; L173-S175 PolarHBondContact O-N 3Å; S175-Q177 VanDerWaalsContact C-N 3.33Å; S175-Q177 PolarHBondContact O-N 3.37Å; S175-S178 WeakPolarHBondContact O-CB 3.39Å; S175-S178 PolarHBondContact O-N 3.44Å; S175-N179 PolarHBondContact O-N 3.12Å; S175-N179 PolarHBondContact O-OD1 3.39Å; S175-N179 VanDerWaalsContact O-OD1 3.12Å
176	K	80.2	Confident	82.9	Confident	88 Å²	88	80.6 Å²	80.6	38%	0.383	41%	0.411	S	S	.	.	H	α-helix	trans	-63.3	-37.3	177	-77.5	-177.8	176.7	-178	0	113	M168 L172 L173 N179 I180	M168-K176 HydrophobicContact CE-CD 4.08Å; M168-K176 HydrophobicContact SD-CD 4.27Å; M168-K176 PolarHBondContact SD-NZ 3.19Å; M168-K176 VanDerWaalsContact SD-NZ 3.37Å; L172-K176 WeakPolarHBondContact O-CB 3.41Å; L172-K176 WeakPolarHBondContact O-CG 3.33Å; L172-K176 PolarHBondContact O-N 3.46Å; L173-K176 PolarHBondContact O-N 3.47Å; K176-N179 PolarHBondContact O-N 3.08Å; K176-I180 VanDerWaalsContact O-CG1 3.29Å; K176-I180 WeakPolarHBondContact O-CG1 3.47Å; K176-I180 PolarHBondContact O-N 2.67Å; K176-I180 VanDerWaalsContact O-N 3.08Å
177	Q	84.7	Confident	82.7	Confident	118 Å²	118	78.3 Å²	78.3	55%	0.551	40%	0.398	S	S	*	.	H	α-helix	trans	-63.1	-46.7	174.4	-76	177.7	-27.9	0	0	111.3	L173 S174 S175 N179 I180 E181	L173-Q177 HydrophobicContact CD2-CG 3.98Å; L173-Q177 WeakPolarHBondContact O-CG 3.4Å; L173-Q177 PolarHBondContact O-N 2.87Å; S174-Q177 PolarHBondContact O-N 3.43Å; S175-Q177 VanDerWaalsContact C-N 3.33Å; S175-Q177 PolarHBondContact O-N 3.37Å; Q177-N179 VanDerWaalsContact C-N 3.35Å; Q177-N179 PolarHBondContact O-N 3.18Å; Q177-I180 PolarHBondContact O-N 3.24Å; Q177-E181 PolarHBondContact O-N 2.94Å
178	S	86.4	Confident	82.8	Confident	61 Å²	61	71.4 Å²	71.4	43%	0.427	38%	0.384	S	S	.	.	H	α-helix	trans	-56.9	-48.6	175	-167.7	0	0	0	0	111.3	S174 S175 I180 E181 D182	S174-S178 PolarHBondContact O-N 3.37Å; S175-S178 WeakPolarHBondContact O-CB 3.39Å; S175-S178 PolarHBondContact O-N 3.44Å; S178-I180 VanDerWaalsContact C-N 3.25Å; S178-I180 PolarHBondContact O-N 3.31Å; S178-E181 PolarHBondContact O-N 2.94Å; S178-D182 VanDerWaalsContact O-CG 3.32Å; S178-D182 PolarHBondContact O-N 2.96Å
179	N	82.8	Confident	82.8	Confident	34 Å²	34	73 Å²	73	18%	0.182	39%	0.394	C	S	.	.	H	α-helix	trans	-60.3	-35	179.5	-64.8	1	0	0	0	112.2	S175 K176 Q177 L183 L199 L201	S175-N179 PolarHBondContact O-N 3.12Å; S175-N179 PolarHBondContact O-OD1 3.39Å; S175-N179 VanDerWaalsContact O-OD1 3.12Å; K176-N179 PolarHBondContact O-N 3.08Å; Q177-N179 VanDerWaalsContact C-N 3.35Å; Q177-N179 PolarHBondContact O-N 3.18Å; N179-L183 VanDerWaalsContact O-CB 3.3Å; N179-L183 WeakPolarHBondContact O-CB 3.38Å; N179-L183 PolarHBondContact O-N 3.17Å; N179-L199 HydrophobicContact CB-CB 4.19Å; N179-L199 PolarHBondContact ND2-O 3.18Å; N179-L199 WeakPolarHBondContact O-CD1 3.34Å; N179-L201 HydrophobicContact CB-CD1 4.1Å; N179-L201 HydrophobicContact CB-CD2 3.71Å; N179-L201 HydrophobicContact CB-CG 3.89Å
180	I	80.1	Confident	82.1	Confident	86 Å²	86	71.6 Å²	71.6	44%	0.441	39%	0.391	S	S	.	.	H	α-helix	trans	-69.2	-39.7	175.2	-69.7	166.7	0	0	0	110.9	K176 Q177 S178 L183 R184 L201	K176-I180 VanDerWaalsContact O-CG1 3.29Å; K176-I180 WeakPolarHBondContact O-CG1 3.47Å; K176-I180 PolarHBondContact O-N 2.67Å; K176-I180 VanDerWaalsContact O-N 3.08Å; Q177-I180 PolarHBondContact O-N 3.24Å; S178-I180 VanDerWaalsContact C-N 3.25Å; S178-I180 PolarHBondContact O-N 3.31Å; I180-L183 WeakPolarHBondContact O-CB 3.46Å; I180-L183 PolarHBondContact O-N 3.05Å; I180-R184 PolarHBondContact O-N 3.34Å; I180-L201 HydrophobicContact CG1-CD1 4.45Å; I180-L201 HydrophobicContact CG1-CD2 4.27Å
181	E	84.4	Confident	81.2	Confident	79 Å²	79	71.4 Å²	71.4	37%	0.369	39%	0.394	S	S	.	.	H	α-helix	trans	-67.8	-42.7	177.5	-166	56.4	-136.8	0	0	111.6	Q177 S178 L183 R184 H185	Q177-E181 PolarHBondContact O-N 2.94Å; S178-E181 PolarHBondContact O-N 2.94Å; E181-L183 VanDerWaalsContact C-N 3.28Å; E181-L183 PolarHBondContact O-N 3.29Å; E181-R184 WeakPolarHBondContact O-CB 3.5Å; E181-R184 PolarHBondContact O-N 3.41Å; E181-R184 VanDerWaalsContact O-N 3.11Å; E181-R184 IonicContact OE1-CZ 3.15Å; E181-R184 IonicContact OE1-NH1 2.65Å; E181-R184 PolarHBondContact OE1-NH1 3.31Å; E181-H185 PolarHBondContact O-CD2 3.33Å; E181-H185 VanDerWaalsContact O-CD2 3.28Å; E181-H185 PolarHBondContact O-N 3.11Å; E181-H185 IonicContact OE1-CD2 3.68Å; E181-H185 IonicContact OE1-NE2 3.37Å; E181-H185 PolarHBondContact OE1-NE2 3.47Å
182	D	81.7	Confident	80	Confident	72 Å²	72	71.9 Å²	71.9	39%	0.385	39%	0.386	S	S	.	.	H	α-helix	trans	-60.3	-40.2	174	-67.1	-32.7	0	0	0	111.3	S178 R184 H185 A186 L199	S178-D182 VanDerWaalsContact O-CG 3.32Å; S178-D182 PolarHBondContact O-N 2.96Å; D182-R184 VanDerWaalsContact C-N 3.35Å; D182-H185 PolarHBondContact O-N 2.65Å; D182-A186 WeakPolarHBondContact O-CB 3.47Å; D182-A186 PolarHBondContact O-N 3.35Å; D182-L199 HydrophobicContact CB-CD1 3.98Å; D182-L199 HydrophobicContact CB-CD2 3.98Å
183	L	77.2	Confident	78.8	Confident	2 Å²	2	77.2 Å²	77.2	1%	0.01	41%	0.406	C	S	.	.	H	α-helix	trans	-62.6	-42.9	175	-174.7	63.3	0	0	0	111.4	N179 I180 E181 W187 A195 A196 L199 L201	N179-L183 VanDerWaalsContact O-CB 3.3Å; N179-L183 WeakPolarHBondContact O-CB 3.38Å; N179-L183 PolarHBondContact O-N 3.17Å; I180-L183 WeakPolarHBondContact O-CB 3.46Å; I180-L183 PolarHBondContact O-N 3.05Å; E181-L183 VanDerWaalsContact C-N 3.28Å; E181-L183 PolarHBondContact O-N 3.29Å; L183-W187 HydrophobicContact CD1-CD2 4.31Å; L183-W187 VanDerWaalsContact CD1-CE2 3.47Å; L183-W187 HydrophobicContact CD1-CH2 4.24Å; L183-W187 HydrophobicContact CD1-CZ2 3.47Å; L183-W187 VanDerWaalsContact CD1-CZ2 3.47Å; L183-W187 HydrophobicContact CD2-CH2 3.51Å; L183-W187 HydrophobicContact CD2-CZ2 3.57Å; L183-W187 HydrophobicContact CD2-CZ3 4.21Å; L183-W187 HydrophobicContact CG-CD2 4.11Å; L183-W187 HydrophobicContact CG-CE3 4.36Å; L183-W187 HydrophobicContact CG-CH2 3.73Å; L183-W187 HydrophobicContact CG-CZ2 3.47Å; L183-W187 VanDerWaalsContact CG-CZ2 3.47Å; L183-W187 HydrophobicContact CG-CZ3 4.18Å; L183-W187 PolarHBondContact O-N 3.28Å; L183-W187 VanDerWaalsContact O-N 3.13Å; L183-A195 HydrophobicContact CD1-CB 3.76Å; L183-A196 HydrophobicContact CD1-CB 3.77Å; L183-A196 HydrophobicContact CD2-CB 4.12Å; L183-L199 HydrophobicContact CB-CD1 3.81Å; L183-L199 HydrophobicContact CD1-CD1 4.22Å; L183-L201 HydrophobicContact CB-CD1 4.28Å; L183-L201 HydrophobicContact CD2-CD1 3.8Å
184	R	78.9	Confident	77.6	Confident	138 Å²	138	81.1 Å²	81.1	52%	0.521	43%	0.427	S	S	.	.	H	α-helix	trans	-62.2	-47.6	175.6	177	-179.3	169.1	-90.6	-4.7	111.1	I180 E181 D182 W187 V188	I180-R184 PolarHBondContact O-N 3.34Å; E181-R184 WeakPolarHBondContact O-CB 3.5Å; E181-R184 PolarHBondContact O-N 3.41Å; E181-R184 VanDerWaalsContact O-N 3.11Å; E181-R184 IonicContact OE1-CZ 3.15Å; E181-R184 IonicContact OE1-NH1 2.65Å; E181-R184 PolarHBondContact OE1-NH1 3.31Å; D182-R184 VanDerWaalsContact C-N 3.35Å; R184-W187 PolarHBondContact O-N 3.04Å; R184-V188 WeakPolarHBondContact O-CG2 3.34Å; R184-V188 PolarHBondContact O-N 3.25Å
185	H	83.4	Confident	76.3	Confident	92 Å²	92	79.3 Å²	79.3	43%	0.426	42%	0.415	S	S	.	.	H	α-helix	trans	-62	-45.6	177.7	-79.2	-62.8	0	0	0	112.6	E181 D182 W187 V188 N189	E181-H185 PolarHBondContact O-CD2 3.33Å; E181-H185 VanDerWaalsContact O-CD2 3.28Å; E181-H185 PolarHBondContact O-N 3.11Å; E181-H185 IonicContact OE1-CD2 3.68Å; E181-H185 IonicContact OE1-NE2 3.37Å; E181-H185 PolarHBondContact OE1-NE2 3.47Å; D182-H185 PolarHBondContact O-N 2.65Å; H185-W187 PolarHBondContact O-N 3.37Å; H185-V188 PolarHBondContact O-N 2.84Å; H185-N189 WeakPolarHBondContact O-CB 3.49Å; H185-N189 PolarHBondContact O-N 3.38Å; H185-N189 PolarHBondContact O-ND2 3.21Å
186	A	78.2	Confident	75.1	Confident	20 Å²	20	76.6 Å²	76.6	17%	0.165	40%	0.396	C	S	.	.	H	α-helix	trans	-57.3	-38.1	176.1	0	0	0	0	0	112	D182 N189 G190 N191 A195	D182-A186 WeakPolarHBondContact O-CB 3.47Å; D182-A186 PolarHBondContact O-N 3.35Å; A186-N189 PolarHBondContact O-N 2.81Å; A186-G190 PolarHBondContact O-N 3.39Å; A186-N191 PolarHBondContact O-N 2.95Å; A186-A195 HydrophobicContact CB-CB 3.96Å
187	W	76.2	Confident	74.2	Confident	52 Å²	52	74.9 Å²	74.9	20%	0.197	40%	0.396	C	S	.	.	H	α-helix	trans	-74.3	-37.9	179.1	-69.5	-8.7	0	0	0	114.5	L183 R184 H185 N189 G190 L210 R214	L183-W187 HydrophobicContact CD1-CD2 4.31Å; L183-W187 VanDerWaalsContact CD1-CE2 3.47Å; L183-W187 HydrophobicContact CD1-CH2 4.24Å; L183-W187 HydrophobicContact CD1-CZ2 3.47Å; L183-W187 VanDerWaalsContact CD1-CZ2 3.47Å; L183-W187 HydrophobicContact CD2-CH2 3.51Å; L183-W187 HydrophobicContact CD2-CZ2 3.57Å; L183-W187 HydrophobicContact CD2-CZ3 4.21Å; L183-W187 HydrophobicContact CG-CD2 4.11Å; L183-W187 HydrophobicContact CG-CE3 4.36Å; L183-W187 HydrophobicContact CG-CH2 3.73Å; L183-W187 HydrophobicContact CG-CZ2 3.47Å; L183-W187 VanDerWaalsContact CG-CZ2 3.47Å; L183-W187 HydrophobicContact CG-CZ3 4.18Å; L183-W187 PolarHBondContact O-N 3.28Å; L183-W187 VanDerWaalsContact O-N 3.13Å; R184-W187 PolarHBondContact O-N 3.04Å; H185-W187 PolarHBondContact O-N 3.37Å; W187-N189 PolarHBondContact O-N 2.88Å; W187-G190 PolarHBondContact O-N 3.39Å; W187-L210 HydrophobicContact CH2-CB 3.46Å; W187-L210 VanDerWaalsContact CH2-CB 3.46Å; W187-L210 HydrophobicContact CZ3-CB 3.94Å; W187-L210 HydrophobicContact CZ3-CD1 4.42Å; W187-R214 PolarHBondContact O-NH2 3.43Å
188	V	82.4	Confident	73.2	Confident	106 Å²	106	74 Å²	74	64%	0.642	40%	0.402	S	S	*	.	H	α-helix	trans	-61.9	-37.8	172.8	171.8	0	0	0	0	110.2	R184 H185 G190	R184-V188 WeakPolarHBondContact O-CG2 3.34Å; R184-V188 PolarHBondContact O-N 3.25Å; H185-V188 PolarHBondContact O-N 2.84Å; V188-G190 VanDerWaalsContact C-N 3.26Å; V188-G190 PolarHBondContact O-N 3.34Å
189	N	80	Confident	72	Confident	112 Å²	112	72.9 Å²	72.9	60%	0.599	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-0.6	-179.1	-62.8	-14.5	0	0	0	114.1	H185 A186 W187 N191	H185-N189 WeakPolarHBondContact O-CB 3.49Å; H185-N189 PolarHBondContact O-N 3.38Å; H185-N189 PolarHBondContact O-ND2 3.21Å; A186-N189 PolarHBondContact O-N 2.81Å; W187-N189 PolarHBondContact O-N 2.88Å; N189-N191 VanDerWaalsContact C-N 3.3Å; N189-N191 PolarHBondContact O-N 2.7Å
190	G	71.5	Confident	71	Confident	44 Å²	44	74 Å²	74	45%	0.454	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.5	6	179	0	0	0	0	0	115.4	A186 W187 V188 N192	A186-G190 PolarHBondContact O-N 3.39Å; W187-G190 PolarHBondContact O-N 3.39Å; V188-G190 VanDerWaalsContact C-N 3.26Å; V188-G190 PolarHBondContact O-N 3.34Å; G190-N192 PolarHBondContact O-N 3.13Å; G190-N192 VanDerWaalsContact O-N 3.09Å
191	N	68.6	Low	70.2	Confident	113 Å²	113	70.4 Å²	70.4	60%	0.604	39%	0.392	S	S	*	.			trans	-78.9	94.2	176.8	-74.6	-14.1	0	0	0	110	A186 N189	A186-N191 PolarHBondContact O-N 2.95Å; N189-N191 VanDerWaalsContact C-N 3.3Å; N189-N191 PolarHBondContact O-N 2.7Å
192	N	62.3	Low	69	Low	87 Å²	87	70.4 Å²	70.4	47%	0.465	39%	0.394	S	S	.	.			trans	-97.1	-11.7	-168.3	-76.2	-28.8	0	0	0	116	G190 R214	G190-N192 PolarHBondContact O-N 3.13Å; G190-N192 VanDerWaalsContact O-N 3.09Å; N192-R214 PolarHBondContact OD1-NE 3.29Å; N192-R214 VanDerWaalsContact OD1-NE 3.09Å; N192-R214 PolarHBondContact OD1-NH2 3.1Å
193	K	58	Low	67.9	Low	186 Å²	186	73.8 Å²	73.8	81%	0.809	41%	0.405	S	S	*	.	S	Bend	trans	-65.4	-54.9	-158.4	-67.8	-171.6	178.8	-178.9	0	112.8
194	D	59.1	Low	66.8	Low	98 Å²	98	81.7 Å²	81.7	52%	0.524	44%	0.44	S	S	.	.	S	Bend	trans	-152.8	21.9	-172.3	-65.2	-69.4	0	0	0	115.2	A196 S197 S198	D194-A196 VanDerWaalsContact C-N 3.34Å; D194-A196 PolarHBondContact O-N 3.31Å; D194-A196 VanDerWaalsContact O-N 3.15Å; D194-S197 PolarHBondContact O-N 2.93Å; D194-S198 PolarHBondContact O-N 3.49Å; D194-S198 VanDerWaalsContact O-N 3.1Å; D194-S198 PolarHBondContact O-OG 3.35Å
195	A	61	Low	65.8	Low	20 Å²	20	78.1 Å²	78.1	17%	0.165	45%	0.447	C	S	.	.	H	α-helix	trans	-56.1	-40.1	-168.2	0	0	0	0	0	114.4	L183 A186 S198 L199	L183-A195 HydrophobicContact CD1-CB 3.76Å; A186-A195 HydrophobicContact CB-CB 3.96Å; A195-S198 PolarHBondContact O-N 2.98Å; A195-L199 HydrophobicContact CB-CD1 4.47Å; A195-L199 WeakPolarHBondContact O-CB 3.29Å; A195-L199 VanDerWaalsContact O-CD1 3.3Å; A195-L199 WeakPolarHBondContact O-CD1 3.48Å; A195-L199 WeakPolarHBondContact O-CG 3.5Å; A195-L199 PolarHBondContact O-N 2.94Å
196	A	59.6	Low	64.8	Low	0 Å²	0	81 Å²	81	0%	0	45%	0.453	C	S	.	.	H	α-helix	trans	-70.3	-37.8	-177.2	0	0	0	0	0	113.4	L183 D194 L201 H211	L183-A196 HydrophobicContact CD1-CB 3.77Å; L183-A196 HydrophobicContact CD2-CB 4.12Å; D194-A196 VanDerWaalsContact C-N 3.34Å; D194-A196 PolarHBondContact O-N 3.31Å; D194-A196 VanDerWaalsContact O-N 3.15Å; A196-L201 PolarHBondContact O-N 2.93Å; A196-H211 HydrophobicContact CB-CB 3.41Å; A196-H211 VanDerWaalsContact CB-CB 3.41Å
197	S	60.8	Low	64.2	Low	53 Å²	53	81 Å²	81	37%	0.371	45%	0.454	S	S	.	.	H	α-helix	trans	-66.8	-42.2	176.3	-59.7	0	0	0	0	110.3	D194 L199 G200	D194-S197 PolarHBondContact O-N 2.93Å; S197-L199 PolarHBondContact O-N 3.37Å; S197-G200 PolarHBondContact O-N 3.1Å
198	S	64	Low	64	Low	98 Å²	98	80.5 Å²	80.5	69%	0.685	46%	0.455	S	S	*	.	H	α-helix	trans	-67.6	-32.6	178.5	-57.4	0	0	0	0	113.7	D194 A195 G200	D194-S198 PolarHBondContact O-N 3.49Å; D194-S198 VanDerWaalsContact O-N 3.1Å; D194-S198 PolarHBondContact O-OG 3.35Å; A195-S198 PolarHBondContact O-N 2.98Å; S198-G200 PolarHBondContact O-N 3.47Å
199	L	62	Low	63.5	Low	39 Å²	39	81.6 Å²	81.6	20%	0.204	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	11.5	-179	-68.1	166.2	0	0	0	113.4	N179 D182 L183 A195 S197 L201	N179-L199 HydrophobicContact CB-CB 4.19Å; N179-L199 PolarHBondContact ND2-O 3.18Å; N179-L199 WeakPolarHBondContact O-CD1 3.34Å; D182-L199 HydrophobicContact CB-CD1 3.98Å; D182-L199 HydrophobicContact CB-CD2 3.98Å; L183-L199 HydrophobicContact CB-CD1 3.81Å; L183-L199 HydrophobicContact CD1-CD1 4.22Å; A195-L199 HydrophobicContact CB-CD1 4.47Å; A195-L199 WeakPolarHBondContact O-CB 3.29Å; A195-L199 VanDerWaalsContact O-CD1 3.3Å; A195-L199 WeakPolarHBondContact O-CD1 3.48Å; A195-L199 WeakPolarHBondContact O-CG 3.5Å; A195-L199 PolarHBondContact O-N 2.94Å; S197-L199 PolarHBondContact O-N 3.37Å; L199-L201 HydrophobicContact CB-CD1 4.12Å; L199-L201 HydrophobicContact CB-CG 4.11Å; L199-L201 PolarHBondContact O-N 3.47Å
200	G	62	Low	63.2	Low	56 Å²	56	80.3 Å²	80.3	58%	0.577	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.1	20.2	177.7	0	0	0	0	0	113.4	S197 S198 L202	S197-G200 PolarHBondContact O-N 3.1Å; S198-G200 PolarHBondContact O-N 3.47Å; G200-L202 PolarHBondContact O-N 2.95Å
201	L	63.2	Low	63.2	Low	12 Å²	12	78.8 Å²	78.8	6%	0.063	42%	0.423	C	S	.	.			trans	-83.8	45	-179.5	-71.5	176.3	0	0	0	111	N179 I180 L183 A196 L199 N208	N179-L201 HydrophobicContact CB-CD1 4.1Å; N179-L201 HydrophobicContact CB-CD2 3.71Å; N179-L201 HydrophobicContact CB-CG 3.89Å; I180-L201 HydrophobicContact CG1-CD1 4.45Å; I180-L201 HydrophobicContact CG1-CD2 4.27Å; L183-L201 HydrophobicContact CB-CD1 4.28Å; L183-L201 HydrophobicContact CD2-CD1 3.8Å; A196-L201 PolarHBondContact O-N 2.93Å; L199-L201 HydrophobicContact CB-CD1 4.12Å; L199-L201 HydrophobicContact CB-CG 4.11Å; L199-L201 PolarHBondContact O-N 3.47Å; L201-N208 HydrophobicContact CB-CB 4.29Å; L201-N208 VanDerWaalsContact CB-ND2 3.32Å; L201-N208 WeakPolarHBondContact CB-ND2 3.33Å; L201-N208 WeakPolarHBondContact O-CB 3.39Å; L201-N208 PolarHBondContact O-N 2.83Å; L201-N208 VanDerWaalsContact O-N 3.16Å; L201-N208 PolarHBondContact O-OD1 2.96Å; L201-N208 VanDerWaalsContact O-OD1 3.12Å
202	L	59.1	Low	63.6	Low	79 Å²	79	75 Å²	75	41%	0.414	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	129.8	174.5	-73.5	81.5	0	0	0	109.2	G200 R206	G200-L202 PolarHBondContact O-N 2.95Å; L202-R206 CarbonylContact C-O 3.56Å; L202-R206 WeakPolarHBondContact CA-O 3.1Å; L202-R206 WeakPolarHBondContact CB-O 3.15Å
203	K	57.8	Low	64.2	Low	142 Å²	142	73.3 Å²	73.3	62%	0.617	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.8	119.2	168.5	-158.1	-167.8	-179.2	-168.6	0	107.8	G205 R206	K203-G205 VanDerWaalsContact C-N 3.26Å; K203-G205 PolarHBondContact O-N 3.09Å; K203-R206 PolarHBondContact N-O 2.73Å; K203-R206 PolarHBondContact O-N 3.3Å
204	F	54.3	Low	65	Low	168 Å²	168	70.5 Å²	70.5	74%	0.737	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	36.1	-177.3	-47.6	-69.7	0	0	0	113.7	R206	F204-R206 PolarHBondContact O-N 3Å
205	G	57.9	Low	65.7	Low	64 Å²	64	69 Å²	69	66%	0.66	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.4	1.6	-176.7	0	0	0	0	0	114.7	K203	K203-G205 VanDerWaalsContact C-N 3.26Å; K203-G205 PolarHBondContact O-N 3.09Å
206	R	63	Low	66.2	Low	151 Å²	151	70.2 Å²	70.2	57%	0.57	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.5	143.4	171.3	-63.9	-169.8	-179.6	-171.7	-0.2	110.7	L202 K203 F204	L202-R206 CarbonylContact C-O 3.56Å; L202-R206 WeakPolarHBondContact CA-O 3.1Å; L202-R206 WeakPolarHBondContact CB-O 3.15Å; K203-R206 PolarHBondContact N-O 2.73Å; K203-R206 PolarHBondContact O-N 3.3Å; F204-R206 PolarHBondContact O-N 3Å
207	A	65.2	Low	66.9	Low	22 Å²	22	76.4 Å²	76.4	18%	0.182	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	154.1	173.4	0	0	0	0	0	110.8	Y209 H211 E212	A207-Y209 PolarHBondContact O-N 2.97Å; A207-H211 HydrophobicContact CB-CB 4.43Å; A207-E212 HydrophobicContact CB-CG 4.23Å
208	N	71.6	Confident	67.5	Low	41 Å²	41	75 Å²	75	22%	0.219	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-55.8	138.3	171.9	-107	1.1	0	0	0	111.1	L201 L210 H211 E212	L201-N208 HydrophobicContact CB-CB 4.29Å; L201-N208 VanDerWaalsContact CB-ND2 3.32Å; L201-N208 WeakPolarHBondContact CB-ND2 3.33Å; L201-N208 WeakPolarHBondContact O-CB 3.39Å; L201-N208 PolarHBondContact O-N 2.83Å; L201-N208 VanDerWaalsContact O-N 3.16Å; L201-N208 PolarHBondContact O-OD1 2.96Å; L201-N208 VanDerWaalsContact O-OD1 3.12Å; N208-L210 PolarHBondContact O-N 3.14Å; N208-H211 WeakPolarHBondContact O-CA 3.36Å; N208-H211 WeakPolarHBondContact O-CB 3.14Å; N208-H211 PolarHBondContact O-N 2.91Å; N208-E212 PolarHBondContact O-N 3.26Å
209	Y	73	Confident	68.1	Low	128 Å²	128	75.9 Å²	75.9	50%	0.502	40%	0.399	S	S	.	.	H	α-helix	trans	-50.1	-36	179.3	176.4	-113.4	0	0	0	113.5	A207 H211 E212 L213 I218	A207-Y209 PolarHBondContact O-N 2.97Å; Y209-H211 VanDerWaalsContact C-N 3.34Å; Y209-H211 PolarHBondContact O-N 3.44Å; Y209-E212 PolarHBondContact O-N 3.23Å; Y209-L213 HydrophobicContact CD1-CD1 4Å; Y209-L213 HydrophobicContact CD1-CG 4.43Å; Y209-L213 HydrophobicContact CD2-CG 4.48Å; Y209-L213 HydrophobicContact CE1-CD1 3.46Å; Y209-L213 VanDerWaalsContact CE1-CD1 3.46Å; Y209-L213 HydrophobicContact CE1-CG 4.04Å; Y209-L213 HydrophobicContact CE2-CD1 4.4Å; Y209-L213 HydrophobicContact CE2-CD2 4.11Å; Y209-L213 HydrophobicContact CE2-CG 4.09Å; Y209-L213 WeakPolarHBondContact O-CG 3.42Å; Y209-L213 PolarHBondContact O-N 3.32Å; Y209-I218 HydrophobicContact CD2-CD1 4.42Å; Y209-I218 HydrophobicContact CE2-CG2 4.33Å
210	L	73.4	Confident	68.8	Low	86 Å²	86	78.3 Å²	78.3	45%	0.45	42%	0.417	S	S	.	.	H	α-helix	trans	-65.6	-34.3	177.3	-61	173	0	0	0	113	W187 N208 R214	W187-L210 HydrophobicContact CH2-CB 3.46Å; W187-L210 VanDerWaalsContact CH2-CB 3.46Å; W187-L210 HydrophobicContact CZ3-CB 3.94Å; W187-L210 HydrophobicContact CZ3-CD1 4.42Å; N208-L210 PolarHBondContact O-N 3.14Å; L210-R214 PolarHBondContact O-N 2.87Å
211	H	71.8	Confident	69.1	Low	12 Å²	12	82.2 Å²	82.2	6%	0.056	42%	0.423	C	S	.	.	H	α-helix	trans	-71.8	-41.4	174.2	-177.8	73	0	0	0	111.6	A196 A207 N208 Y209 L213 R214 T215	A196-H211 HydrophobicContact CB-CB 3.41Å; A196-H211 VanDerWaalsContact CB-CB 3.41Å; A207-H211 HydrophobicContact CB-CB 4.43Å; N208-H211 WeakPolarHBondContact O-CA 3.36Å; N208-H211 WeakPolarHBondContact O-CB 3.14Å; N208-H211 PolarHBondContact O-N 2.91Å; Y209-H211 VanDerWaalsContact C-N 3.34Å; Y209-H211 PolarHBondContact O-N 3.44Å; H211-L213 VanDerWaalsContact C-N 3.28Å; H211-L213 PolarHBondContact O-N 3.33Å; H211-R214 PolarHBondContact O-N 2.79Å; H211-R214 VanDerWaalsContact O-N 3.16Å; H211-T215 VanDerWaalsContact CE1-CG2 3.44Å; H211-T215 WeakPolarHBondContact CE1-CG2 3.32Å; H211-T215 WeakPolarHBondContact NE2-CG2 3.48Å; H211-T215 WeakPolarHBondContact O-CB 3.05Å; H211-T215 WeakPolarHBondContact O-CG2 3.42Å; H211-T215 PolarHBondContact O-N 3.49Å; H211-T215 PolarHBondContact O-OG1 3.13Å
212	E	77	Confident	69.5	Low	32 Å²	32	84.9 Å²	84.9	15%	0.15	44%	0.443	C	S	.	.	H	α-helix	trans	-60.1	-38.9	175.6	-63.4	176.9	151.9	0	0	111.6	A207 N208 Y209 T215 G216 Q217 I218	A207-E212 HydrophobicContact CB-CG 4.23Å; N208-E212 PolarHBondContact O-N 3.26Å; Y209-E212 PolarHBondContact O-N 3.23Å; E212-T215 WeakPolarHBondContact CA-OG1 3.11Å; E212-T215 PolarHBondContact O-OG1 3.23Å; E212-G216 PolarHBondContact O-N 3.27Å; E212-Q217 HydrophobicContact CB-CB 4.37Å; E212-Q217 PolarHBondContact O-N 3.4Å; E212-I218 HydrophobicContact CB-CB 4.21Å; E212-I218 HydrophobicContact CB-CD1 3.89Å; E212-I218 HydrophobicContact CB-CG1 3.93Å; E212-I218 HydrophobicContact CG-CD1 4.32Å; E212-I218 PolarHBondContact O-N 3.47Å; E212-I218 WeakPolarHBondContact OE2-CD1 3.41Å
213	L	74.8	Confident	69.9	Low	53 Å²	53	87 Å²	87	28%	0.277	45%	0.447	S	S	.	.	H	α-helix	trans	-65	-41.2	173.9	-74	-179.6	0	0	0	112.8	Y209 H211 G216 I218 P220	Y209-L213 HydrophobicContact CD1-CD1 4Å; Y209-L213 HydrophobicContact CD1-CG 4.43Å; Y209-L213 HydrophobicContact CD2-CG 4.48Å; Y209-L213 HydrophobicContact CE1-CD1 3.46Å; Y209-L213 VanDerWaalsContact CE1-CD1 3.46Å; Y209-L213 HydrophobicContact CE1-CG 4.04Å; Y209-L213 HydrophobicContact CE2-CD1 4.4Å; Y209-L213 HydrophobicContact CE2-CD2 4.11Å; Y209-L213 HydrophobicContact CE2-CG 4.09Å; Y209-L213 WeakPolarHBondContact O-CG 3.42Å; Y209-L213 PolarHBondContact O-N 3.32Å; H211-L213 VanDerWaalsContact C-N 3.28Å; H211-L213 PolarHBondContact O-N 3.33Å; L213-G216 PolarHBondContact O-N 3.27Å; L213-I218 HydrophobicContact CD2-CG2 4.33Å; L213-P220 HydrophobicContact CD2-CG 4.14Å
214	R	73.5	Confident	70.3	Confident	127 Å²	127	84.6 Å²	84.6	48%	0.479	45%	0.446	S	S	.	.	H	α-helix	trans	-79.1	-35.7	-176.2	-171.4	160.8	173.8	110.5	-13.4	113.2	W187 N192 L210 H211 G216	W187-R214 PolarHBondContact O-NH2 3.43Å; N192-R214 PolarHBondContact OD1-NE 3.29Å; N192-R214 VanDerWaalsContact OD1-NE 3.09Å; N192-R214 PolarHBondContact OD1-NH2 3.1Å; L210-R214 PolarHBondContact O-N 2.87Å; H211-R214 PolarHBondContact O-N 2.79Å; H211-R214 VanDerWaalsContact O-N 3.16Å; R214-G216 PolarHBondContact O-N 2.9Å
215	T	74.5	Confident	70.6	Confident	65 Å²	65	80.9 Å²	80.9	40%	0.399	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-11.6	172.2	52.6	0	0	0	0	112.6	H211 E212 Q217	H211-T215 VanDerWaalsContact CE1-CG2 3.44Å; H211-T215 WeakPolarHBondContact CE1-CG2 3.32Å; H211-T215 WeakPolarHBondContact NE2-CG2 3.48Å; H211-T215 WeakPolarHBondContact O-CB 3.05Å; H211-T215 WeakPolarHBondContact O-CG2 3.42Å; H211-T215 PolarHBondContact O-N 3.49Å; H211-T215 PolarHBondContact O-OG1 3.13Å; E212-T215 WeakPolarHBondContact CA-OG1 3.11Å; E212-T215 PolarHBondContact O-OG1 3.23Å; T215-Q217 PolarHBondContact O-N 2.67Å; T215-Q217 VanDerWaalsContact OG1-CG 3.31Å; T215-Q217 WeakPolarHBondContact OG1-CG 3.34Å
216	G	71.8	Confident	70.6	Confident	46 Å²	46	83.2 Å²	83.2	47%	0.474	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.8	9.4	-175.8	0	0	0	0	0	113.4	E212 L213 R214 I218	E212-G216 PolarHBondContact O-N 3.27Å; L213-G216 PolarHBondContact O-N 3.27Å; R214-G216 PolarHBondContact O-N 2.9Å; G216-I218 PolarHBondContact O-N 3.08Å
217	Q	74.5	Confident	70.3	Confident	131 Å²	131	85.4 Å²	85.4	61%	0.612	45%	0.45	S	S	*	.	S	Bend	trans	-59.2	-36.2	171.5	-70.9	176	12	0	0	110.9	E212 T215	E212-Q217 HydrophobicContact CB-CB 4.37Å; E212-Q217 PolarHBondContact O-N 3.4Å; T215-Q217 PolarHBondContact O-N 2.67Å; T215-Q217 VanDerWaalsContact OG1-CG 3.31Å; T215-Q217 WeakPolarHBondContact OG1-CG 3.34Å
218	I	72.5	Confident	69.7	Low	23 Å²	23	89 Å²	89	12%	0.118	47%	0.471	C	S	.	.	S	Bend	trans	-119.2	120.3	171.5	-62.3	-178.7	0	0	0	109.2	Y209 E212 L213 G216 Y223	Y209-I218 HydrophobicContact CD2-CD1 4.42Å; Y209-I218 HydrophobicContact CE2-CG2 4.33Å; E212-I218 HydrophobicContact CB-CB 4.21Å; E212-I218 HydrophobicContact CB-CD1 3.89Å; E212-I218 HydrophobicContact CB-CG1 3.93Å; E212-I218 HydrophobicContact CG-CD1 4.32Å; E212-I218 PolarHBondContact O-N 3.47Å; E212-I218 WeakPolarHBondContact OE2-CD1 3.41Å; L213-I218 HydrophobicContact CD2-CG2 4.33Å; G216-I218 PolarHBondContact O-N 3.08Å; I218-Y223 HydrophobicContact CD1-CD2 4.15Å; I218-Y223 HydrophobicContact CD1-CE2 4.02Å; I218-Y223 HydrophobicContact CG2-CD2 4.39Å
219	L	77.7	Confident	68.8	Low	117 Å²	117	91.8 Å²	91.8	61%	0.613	49%	0.485	S	S	*	.			trans	-75.6	134.3	168.7	-74.7	155	0	0	0	109.2	L221 S222	L219-L221 PolarHBondContact O-N 2.98Å; L219-S222 WeakPolarHBondContact CB-OG 3.36Å; L219-S222 PolarHBondContact N-OG 2.88Å; L219-S222 WeakPolarHBondContact O-CB 2.78Å; L219-S222 PolarHBondContact O-N 2.83Å; L219-S222 PolarHBondContact O-OG 2.64Å
220	P	75.6	Confident	67.9	Low	90 Å²	90	92.9 Å²	92.9	58%	0.584	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.1	135.3	169	-21.7	29.7	0	0	0	109.5	L213 S222	L213-P220 HydrophobicContact CD2-CG 4.14Å; P220-S222 PolarHBondContact O-N 2.87Å
221	L	69.6	Low	66.9	Low	137 Å²	137	90.2 Å²	90.2	72%	0.717	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.9	5.8	179.7	-53.8	168	0	0	0	116.8	L219	L219-L221 PolarHBondContact O-N 2.98Å
222	S	71.7	Confident	66	Low	68 Å²	68	93.7 Å²	93.7	48%	0.476	51%	0.506	S	S	.	.			trans	-96.4	-2.9	178.9	72.2	0	0	0	0	114.7	L219 P220	L219-S222 WeakPolarHBondContact CB-OG 3.36Å; L219-S222 PolarHBondContact N-OG 2.88Å; L219-S222 WeakPolarHBondContact O-CB 2.78Å; L219-S222 PolarHBondContact O-N 2.83Å; L219-S222 PolarHBondContact O-OG 2.64Å; P220-S222 PolarHBondContact O-N 2.87Å
223	Y	67.6	Low	64.8	Low	125 Å²	125	99.7 Å²	99.7	49%	0.49	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-67	136.7	-172.2	-153.2	-99.1	0	0	0	111.3	I218 T226	I218-Y223 HydrophobicContact CD1-CD2 4.15Å; I218-Y223 HydrophobicContact CD1-CE2 4.02Å; I218-Y223 HydrophobicContact CG2-CD2 4.39Å; Y223-T226 HydrophobicContact CD1-CG2 3.97Å; Y223-T226 HydrophobicContact CE1-CG2 4Å
224	P	64.6	Low	63.6	Low	91 Å²	91	103 Å²	103	59%	0.591	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-61.1	171.3	171.7	26.7	-35	0	0	0	111.2	T226	P224-T226 PolarHBondContact O-N 3.1Å
225	S	61.7	Low	62.3	Low	89 Å²	89	101.2 Å²	101.2	62%	0.622	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-56.6	130	175	-160.1	0	0	0	0	110	W227	S225-W227 PolarHBondContact O-N 3.26Å
226	T	58.4	Low	61	Low	113 Å²	113	105.4 Å²	105.4	69%	0.693	56%	0.563	S	S	*	*	S	Bend	trans	-72.2	-11.2	-179.2	41.9	0	0	0	0	113.5	Y223 P224	Y223-T226 HydrophobicContact CD1-CG2 3.97Å; Y223-T226 HydrophobicContact CE1-CG2 4Å; P224-T226 PolarHBondContact O-N 3.1Å
227	W	56.9	Low	59.8	Low	198 Å²	198	110.7 Å²	110.7	75%	0.75	58%	0.58	S	S	*	*	S	Bend	trans	-78.2	143.2	-179.2	-64.4	104.2	0	0	0	111.2	S225 I229	S225-W227 PolarHBondContact O-N 3.26Å; W227-I229 PolarHBondContact O-N 2.69Å
228	P	52.2	Low	58.3	Low	96 Å²	96	106.6 Å²	106.6	62%	0.623	57%	0.573	S	S	*	*			trans	-49.9	128.5	174.5	-25.4	33.5	0	0	0	111.1	E230	P228-E230 PolarHBondContact O-N 3.41Å
229	I	52	Low	57.1	Low	101 Å²	101	112.9 Å²	112.9	52%	0.518	61%	0.607	S	S	.	*	S	Bend	trans	-80.5	2.8	172.9	-54.7	157.1	0	0	0	109.7	W227 W263	W227-I229 PolarHBondContact O-N 2.69Å; I229-W263 PolarHBondContact O-NE1 3.32Å
230	E	54.9	Low	55.4	Low	151 Å²	151	114.6 Å²	114.6	71%	0.706	62%	0.617	S	S	*	*	S	Bend	trans	-110.1	142.3	177.1	-70	176.8	-177.1	0	0	110.3	P228	P228-E230 PolarHBondContact O-N 3.41Å
231	P	51.2	Low	53.8	Low	29 Å²	29	117.2 Å²	117.2	19%	0.188	62%	0.624	C	S	.	*			trans	-66.8	145.5	178.6	24.7	-21.5	0	0	0	109.7	E233 I245 W263	P231-E233 PolarHBondContact O-N 2.5Å; P231-I245 HydrophobicContact CB-CG1 4.48Å; P231-W263 HydrophobicContact CB-CD2 4.01Å; P231-W263 HydrophobicContact CB-CE3 3.67Å; P231-W263 HydrophobicContact CB-CH2 3.64Å; P231-W263 HydrophobicContact CB-CZ2 3.99Å; P231-W263 HydrophobicContact CB-CZ3 3.48Å; P231-W263 VanDerWaalsContact CB-CZ3 3.48Å; P231-W263 HydrophobicContact CG-CE3 4.36Å; P231-W263 HydrophobicContact CG-CH2 3.37Å; P231-W263 HydrophobicContact CG-CZ2 3.69Å; P231-W263 HydrophobicContact CG-CZ3 3.76Å
232	P	52.8	Low	52.4	Low	85 Å²	85	120.2 Å²	120.2	55%	0.552	63%	0.628	S	S	*	*			trans	-56.6	122.9	163.6	-18.1	30.1	0	0	0	109.1	V234 Q235	P232-V234 HydrophobicContact CB-CG2 4.47Å; P232-V234 PolarHBondContact O-N 3.04Å; P232-Q235 PolarHBondContact O-N 3.42Å
233	E	52.4	Low	51	Low	158 Å²	158	119.8 Å²	119.8	74%	0.738	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-55.9	-17.8	179.7	-76.1	178.3	157.8	0	0	113.5	P231 Q235 Y236	P231-E233 PolarHBondContact O-N 2.5Å; E233-Q235 PolarHBondContact O-N 3.45Å; E233-Y236 PolarHBondContact O-N 3.23Å
234	V	50.4	Low	49.9	Very low	124 Å²	124	116.3 Å²	116.3	75%	0.752	62%	0.615	S	S	*	*	G	3₁₀ helix	trans	-55.5	-19.4	176.6	-164.8	0	0	0	0	112.5	P232 Y236	P232-V234 HydrophobicContact CB-CG2 4.47Å; P232-V234 PolarHBondContact O-N 3.04Å; V234-Y236 VanDerWaalsContact C-N 3.25Å; V234-Y236 PolarHBondContact O-N 2.89Å
235	Q	46	Very low	48.8	Very low	88 Å²	88	113.5 Å²	113.5	41%	0.411	60%	0.595	S	S	.	*	G	3₁₀ helix	trans	-77.9	-3.2	176.3	-157.8	148.2	51.5	0	0	114.7	P232 E233 V244	P232-Q235 PolarHBondContact O-N 3.42Å; E233-Q235 PolarHBondContact O-N 3.45Å; Q235-V244 VanDerWaalsContact NE2-CB 3.34Å
236	Y	46.5	Very low	47.8	Very low	154 Å²	154	114.2 Å²	114.2	60%	0.604	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-103.5	-0.1	176.9	-66.8	-79.6	0	0	0	114.6	E233 V234 G238 I245	E233-Y236 PolarHBondContact O-N 3.23Å; V234-Y236 VanDerWaalsContact C-N 3.25Å; V234-Y236 PolarHBondContact O-N 2.89Å; Y236-G238 PolarHBondContact O-N 2.75Å; Y236-I245 HydrophobicContact CD1-CD1 4.42Å; Y236-I245 HydrophobicContact CD2-CD1 4.47Å; Y236-I245 HydrophobicContact CE1-CD1 3.66Å; Y236-I245 HydrophobicContact CE2-CD1 3.72Å; Y236-I245 VanDerWaalsContact OH-CD1 3.27Å; Y236-I245 WeakPolarHBondContact OH-CD1 3.27Å
237	L	47.1	Very low	47.1	Very low	156 Å²	156	110.7 Å²	110.7	82%	0.817	57%	0.571	S	S	*	*	S	Bend	trans	-94.9	24.1	-170.3	-156.6	65.4	0	0	0	115.1
238	G	41.9	Very low	46.4	Very low	46 Å²	46	105.8 Å²	105.8	47%	0.474	56%	0.558	S	S	.	*	S	Bend	trans	-141.5	123.7	174	0	0	0	0	0	110.4	Y236 N240	Y236-G238 PolarHBondContact O-N 2.75Å; G238-N240 CarbonylContact O-C 3.54Å; G238-N240 PolarHBondContact O-N 2.76Å
239	D	47.5	Very low	46	Very low	155 Å²	155	103.3 Å²	103.3	83%	0.829	55%	0.546	S	S	*	.	S	Bend	trans	-60.2	-1.1	-179.4	-66.2	-38.4	0	0	0	114.5	I241	D239-I241 PolarHBondContact O-N 3.08Å; D239-I241 VanDerWaalsContact O-N 3.14Å
240	N	43.4	Very low	45.6	Very low	152 Å²	152	99.5 Å²	99.5	81%	0.813	53%	0.527	S	S	*	.	S	Bend	trans	-82.1	85.7	163.5	-87.6	-29.3	0	0	0	110	G238 Y242	G238-N240 CarbonylContact O-C 3.54Å; G238-N240 PolarHBondContact O-N 2.76Å; N240-Y242 PolarHBondContact O-N 2.79Å
241	I	41.3	Very low	44.9	Very low	146 Å²	146	98.8 Å²	98.8	75%	0.749	52%	0.521	S	S	*	.			trans	-63	74.9	175.2	-56.2	163.1	0	0	0	109.6	D239 P243	D239-I241 PolarHBondContact O-N 3.08Å; D239-I241 VanDerWaalsContact O-N 3.14Å; I241-P243 HydrophobicContact CG2-CG 4.31Å; I241-P243 WeakPolarHBondContact O-CD 3.04Å
242	Y	40.1	Very low	44.4	Very low	200 Å²	200	102.8 Å²	102.8	78%	0.784	54%	0.537	S	S	*	.			trans	-96.6	96.4	144.2	-80.5	-79.8	0	0	0	106.1	N240 V244	N240-Y242 PolarHBondContact O-N 2.79Å; Y242-V244 PolarHBondContact O-N 2.96Å
243	P	42.1	Very low	43.8	Very low	58 Å²	58	102.8 Å²	102.8	38%	0.377	53%	0.53	S	S	.	.			trans	-70.4	87.3	172.3	30.2	-28.9	0	0	0	105.5	I241 I245 N246 S247	I241-P243 HydrophobicContact CG2-CG 4.31Å; I241-P243 WeakPolarHBondContact O-CD 3.04Å; P243-I245 PolarHBondContact O-N 3.09Å; P243-I245 VanDerWaalsContact O-N 3.11Å; P243-N246 HydrophobicContact CB-CB 4.23Å; P243-N246 HydrophobicContact CG-CB 4.18Å; P243-N246 CarbonylContact O-C 3.59Å; P243-N246 WeakPolarHBondContact O-CA 3.27Å; P243-N246 PolarHBondContact O-N 3Å; P243-S247 PolarHBondContact O-N 2.98Å
244	V	44.5	Very low	43.3	Very low	52 Å²	52	97 Å²	97	32%	0.315	51%	0.513	S	S	.	.	G	3₁₀ helix	trans	-55.7	-27.6	170.7	174.2	0	0	0	0	109.3	Q235 Y242 N246 S247 L250	Q235-V244 VanDerWaalsContact NE2-CB 3.34Å; Y242-V244 PolarHBondContact O-N 2.96Å; V244-N246 PolarHBondContact O-N 2.82Å; V244-S247 WeakPolarHBondContact O-CB 3.4Å; V244-S247 PolarHBondContact O-N 3.38Å; V244-S247 PolarHBondContact O-OG 3Å; V244-L250 HydrophobicContact CG1-CD1 3.49Å; V244-L250 VanDerWaalsContact CG1-CD1 3.49Å; V244-L250 HydrophobicContact CG1-CD2 4.2Å
245	I	42.8	Very low	43	Very low	33 Å²	33	97.9 Å²	97.9	17%	0.169	51%	0.513	C	S	.	.	G	3₁₀ helix	trans	-52	-37.5	167.8	-66.8	141	0	0	0	113.1	P231 Y236 P243 W263	P231-I245 HydrophobicContact CB-CG1 4.48Å; Y236-I245 HydrophobicContact CD1-CD1 4.42Å; Y236-I245 HydrophobicContact CD2-CD1 4.47Å; Y236-I245 HydrophobicContact CE1-CD1 3.66Å; Y236-I245 HydrophobicContact CE2-CD1 3.72Å; Y236-I245 VanDerWaalsContact OH-CD1 3.27Å; Y236-I245 WeakPolarHBondContact OH-CD1 3.27Å; P243-I245 PolarHBondContact O-N 3.09Å; P243-I245 VanDerWaalsContact O-N 3.11Å; I245-W263 HydrophobicContact CB-CZ3 4.2Å; I245-W263 HydrophobicContact CG1-CH2 4.31Å; I245-W263 HydrophobicContact CG1-CZ3 3.71Å; I245-W263 HydrophobicContact CG2-CH2 4.13Å; I245-W263 HydrophobicContact CG2-CZ3 4.09Å
246	N	40.5	Very low	42.8	Very low	104 Å²	104	104.4 Å²	104.4	56%	0.556	53%	0.534	S	S	*	.	G	3₁₀ helix	trans	-103.8	2.8	176	-83.4	-15.8	0	0	0	113.7	P243 V244 I248	P243-N246 HydrophobicContact CB-CB 4.23Å; P243-N246 HydrophobicContact CG-CB 4.18Å; P243-N246 CarbonylContact O-C 3.59Å; P243-N246 WeakPolarHBondContact O-CA 3.27Å; P243-N246 PolarHBondContact O-N 3Å; V244-N246 PolarHBondContact O-N 2.82Å; N246-I248 PolarHBondContact O-N 3.38Å
247	S	42.1	Very low	42.5	Very low	38 Å²	38	99.5 Å²	99.5	27%	0.266	53%	0.53	S	S	.	.			trans	-57	121	169.3	73.1	0	0	0	0	107.5	P243 V244 A249 L250	P243-S247 PolarHBondContact O-N 2.98Å; V244-S247 WeakPolarHBondContact O-CB 3.4Å; V244-S247 PolarHBondContact O-N 3.38Å; V244-S247 PolarHBondContact O-OG 3Å; S247-A249 PolarHBondContact O-N 3.48Å; S247-L250 PolarHBondContact O-N 3.47Å; S247-L250 WeakPolarHBondContact OG-CD1 3.41Å
248	I	43.9	Very low	42.2	Very low	95 Å²	95	96.7 Å²	96.7	49%	0.487	54%	0.539	S	S	.	.	H	α-helix	trans	-56.3	-27.4	180	-64.6	164.8	0	0	0	109.7	N246 L250 K251 Q252	N246-I248 PolarHBondContact O-N 3.38Å; I248-L250 VanDerWaalsContact C-N 3.26Å; I248-L250 PolarHBondContact O-N 2.94Å; I248-K251 PolarHBondContact O-N 3.04Å; I248-Q252 HydrophobicContact CG2-CG 4.31Å; I248-Q252 PolarHBondContact O-N 2.85Å
249	A	43.7	Very low	42.1	Very low	44 Å²	44	97.3 Å²	97.3	36%	0.364	55%	0.545	S	S	.	.	H	α-helix	trans	-55.4	-32.9	170.4	0	0	0	0	0	114	S247 H253 L264 R284	S247-A249 PolarHBondContact O-N 3.48Å; A249-H253 PolarHBondContact O-CD2 3.13Å; A249-H253 VanDerWaalsContact O-CD2 3.3Å; A249-L264 WeakPolarHBondContact O-CD1 3.42Å; A249-R284 PolarHBondContact O-NH1 2.92Å
250	L	41.9	Very low	42	Very low	21 Å²	21	92.3 Å²	92.3	11%	0.11	53%	0.53	C	S	.	.	H	α-helix	trans	-78.7	-35.8	175.1	-100.6	79.6	0	0	0	113	V244 S247 I248 Q252 W263 L264	V244-L250 HydrophobicContact CG1-CD1 3.49Å; V244-L250 VanDerWaalsContact CG1-CD1 3.49Å; V244-L250 HydrophobicContact CG1-CD2 4.2Å; S247-L250 PolarHBondContact O-N 3.47Å; S247-L250 WeakPolarHBondContact OG-CD1 3.41Å; I248-L250 VanDerWaalsContact C-N 3.26Å; I248-L250 PolarHBondContact O-N 2.94Å; L250-Q252 PolarHBondContact O-N 3.43Å; L250-W263 HydrophobicContact CD2-CE3 4.06Å; L250-L264 HydrophobicContact CB-CD1 4.34Å; L250-L264 HydrophobicContact CD1-CB 3.95Å; L250-L264 HydrophobicContact CD1-CD1 3.71Å; L250-L264 HydrophobicContact CD1-CG 4.15Å; L250-L264 HydrophobicContact CD2-CB 4.42Å; L250-L264 HydrophobicContact CG-CB 3.84Å; L250-L264 HydrophobicContact CG-CD1 3.76Å; L250-L264 HydrophobicContact CG-CG 3.78Å
251	K	40.5	Very low	42.2	Very low	136 Å²	136	88.4 Å²	88.4	59%	0.591	51%	0.512	S	S	*	.	H	α-helix	trans	-75.5	-21.7	-172.9	-111.7	173	-176.6	167.5	0	114.7	I248	I248-K251 PolarHBondContact O-N 3.04Å
252	Q	40.7	Very low	42.6	Very low	113 Å²	113	84.7 Å²	84.7	53%	0.528	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-6.5	-170.2	-65.5	-164.3	10.6	0	0	115.6	I248 L250	I248-Q252 HydrophobicContact CG2-CG 4.31Å; I248-Q252 PolarHBondContact O-N 2.85Å; L250-Q252 PolarHBondContact O-N 3.43Å
253	H	41.4	Very low	43.4	Very low	86 Å²	86	78.3 Å²	78.3	40%	0.398	47%	0.47	S	S	.	.	S	Bend	trans	-119.8	90.9	-168	-64.4	-87.7	0	0	0	113.9	A249 R284	A249-H253 PolarHBondContact O-CD2 3.13Å; A249-H253 VanDerWaalsContact O-CD2 3.3Å; H253-R284 HydrophobicContact CB-CG 4.29Å; H253-R284 PolarHBondContact CD2-NH1 2.98Å; H253-R284 PolarHBondContact NE2-NH1 3.37Å; H253-R284 VanDerWaalsContact NE2-NH1 3.16Å
254	G	41	Very low	44.5	Very low	36 Å²	36	77.2 Å²	77.2	37%	0.371	46%	0.461	S	S	.	.	S	Bend	trans	163.8	127.2	172	0	0	0	0	0	107.7	R256	G254-R256 PolarHBondContact O-N 3.34Å; G254-R256 VanDerWaalsContact O-N 3.13Å
255	N	43.7	Very low	45.5	Very low	142 Å²	142	81.8 Å²	81.8	76%	0.759	48%	0.479	S	S	*	.			trans	-50.7	125.8	172.1	-170.2	17.5	0	0	0	107.7	G257	N255-G257 PolarHBondContact O-N 2.93Å
256	R	41.9	Very low	47.2	Very low	226 Å²	226	81.3 Å²	81.3	85%	0.853	48%	0.48	S	S	*	.			trans	-67	70.1	174.3	-60.4	-162.4	-156.5	-94	4.4	108.6	G254	G254-R256 PolarHBondContact O-N 3.34Å; G254-R256 VanDerWaalsContact O-N 3.13Å
257	G	41.2	Very low	49.2	Very low	51 Å²	51	81.5 Å²	81.5	53%	0.526	48%	0.476	S	S	.	.			trans	-55.2	138.3	149.5	0	0	0	0	0	106.1	N255 G259	N255-G257 PolarHBondContact O-N 2.93Å; G257-G259 PolarHBondContact O-N 3.25Å
258	G	41.1	Very low	51.5	Low	97 Å²	97	84.7 Å²	84.7	100%	1	49%	0.489	S	S	*	.	S	Bend	trans	-61.9	27.7	-158.5	0	0	0	0	0	119.1
259	G	39.5	Very low	53.6	Low	59 Å²	59	84.4 Å²	84.4	61%	0.608	48%	0.484	S	S	*	.	S	Bend	trans	-158.8	117.1	172.9	0	0	0	0	0	112.6	G257	G257-G259 PolarHBondContact O-N 3.25Å
260	G	44.3	Very low	55.9	Low	49 Å²	49	89.1 Å²	89.1	51%	0.505	50%	0.499	S	S	.	.			trans	94.4	145.1	158.2	0	0	0	0	0	117.2	V262	G260-V262 PolarHBondContact O-N 3.5Å
261	T	47.2	Very low	58.3	Low	70 Å²	70	93.4 Å²	93.4	43%	0.429	52%	0.517	S	S	.	.			trans	-61.1	126.4	161.6	42.3	0	0	0	0	108.9	W263	T261-W263 PolarHBondContact O-N 2.92Å
262	V	50.5	Low	60.6	Low	68 Å²	68	94.4 Å²	94.4	41%	0.412	53%	0.534	S	S	.	.			trans	-78.1	109.3	171.4	-178.4	0	0	0	0	107.1	G260 L264	G260-V262 PolarHBondContact O-N 3.5Å; V262-L264 PolarHBondContact O-N 2.75Å
263	W	57.1	Low	62.9	Low	66 Å²	66	97.3 Å²	97.3	25%	0.25	55%	0.548	C	S	.	.			trans	-63.5	127.9	171.9	-57.2	94.1	0	0	0	109.2	I229 P231 I245 L250 T261 H265	I229-W263 PolarHBondContact O-NE1 3.32Å; P231-W263 HydrophobicContact CB-CD2 4.01Å; P231-W263 HydrophobicContact CB-CE3 3.67Å; P231-W263 HydrophobicContact CB-CH2 3.64Å; P231-W263 HydrophobicContact CB-CZ2 3.99Å; P231-W263 HydrophobicContact CB-CZ3 3.48Å; P231-W263 VanDerWaalsContact CB-CZ3 3.48Å; P231-W263 HydrophobicContact CG-CE3 4.36Å; P231-W263 HydrophobicContact CG-CH2 3.37Å; P231-W263 HydrophobicContact CG-CZ2 3.69Å; P231-W263 HydrophobicContact CG-CZ3 3.76Å; I245-W263 HydrophobicContact CB-CZ3 4.2Å; I245-W263 HydrophobicContact CG1-CH2 4.31Å; I245-W263 HydrophobicContact CG1-CZ3 3.71Å; I245-W263 HydrophobicContact CG2-CH2 4.13Å; I245-W263 HydrophobicContact CG2-CZ3 4.09Å; L250-W263 HydrophobicContact CD2-CE3 4.06Å; T261-W263 PolarHBondContact O-N 2.92Å; W263-H265 PolarHBondContact O-N 2.99Å
264	L	64.5	Low	65.2	Low	35 Å²	35	95 Å²	95	18%	0.183	54%	0.538	C	S	.	.			trans	-81.7	110.3	177	-66.1	178.5	0	0	0	108.9	A249 L250 V262 T282 R284	A249-L264 WeakPolarHBondContact O-CD1 3.42Å; L250-L264 HydrophobicContact CB-CD1 4.34Å; L250-L264 HydrophobicContact CD1-CB 3.95Å; L250-L264 HydrophobicContact CD1-CD1 3.71Å; L250-L264 HydrophobicContact CD1-CG 4.15Å; L250-L264 HydrophobicContact CD2-CB 4.42Å; L250-L264 HydrophobicContact CG-CB 3.84Å; L250-L264 HydrophobicContact CG-CD1 3.76Å; L250-L264 HydrophobicContact CG-CG 3.78Å; V262-L264 PolarHBondContact O-N 2.75Å; L264-T282 HydrophobicContact CB-CG2 3.94Å; L264-R284 HydrophobicContact CD2-CG 4.18Å
265	H	65.1	Low	67.3	Low	149 Å²	149	102.9 Å²	102.9	69%	0.69	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-91.8	126	171.3	-161.9	-64.2	0	0	0	109.2	W263 K267	W263-H265 PolarHBondContact O-N 2.99Å; H265-K267 PolarHBondContact O-N 3.04Å
266	A	79.4	Confident	69.4	Low	23 Å²	23	98.6 Å²	98.6	19%	0.19	53%	0.531	C	S	.	.	P	Polyproline II helix	trans	-67	131	170.4	0	0	0	0	0	109.4	Y280 G281	A266-Y280 HydrophobicContact CB-CD1 4.43Å; A266-Y280 HydrophobicContact CB-CD2 4.36Å; A266-Y280 HydrophobicContact CB-CE1 3.86Å; A266-Y280 HydrophobicContact CB-CE2 3.79Å; A266-G281 CarbonylContact C-O 3.53Å
267	K	83.5	Confident	71.7	Confident	108 Å²	108	91.8 Å²	91.8	47%	0.47	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	136.8	176.4	-66.8	174.5	177	-75.6	0	108	H265 F269 Y280 G281	H265-K267 PolarHBondContact O-N 3.04Å; K267-F269 HydrophobicContact CB-CD2 4.33Å; K267-F269 HydrophobicContact CB-CE2 3.78Å; K267-F269 HydrophobicContact CB-CZ 4.04Å; K267-F269 HydrophobicContact CD-CE2 4.02Å; K267-F269 HydrophobicContact CD-CZ 3.8Å; K267-Y280 WeakPolarHBondContact O-CA 3.39Å; K267-G281 PolarHBondContact N-O 3.11Å; K267-G281 PolarHBondContact O-N 2.69Å
268	L	89.2	Confident	74.1	Confident	104 Å²	104	91.5 Å²	91.5	55%	0.545	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	118.4	168.9	-176.8	64.8	0	0	0	108.3	A278 Y279 Y280	L268-A278 HydrophobicContact CD1-CB 3.84Å; L268-Y279 CarbonylContact C-O 3.36Å; L268-Y279 VanDerWaalsContact CA-O 3.3Å; L268-Y279 WeakPolarHBondContact CA-O 3.18Å; L268-Y280 HydrophobicContact CB-CD2 4.15Å; L268-Y280 HydrophobicContact CD1-CD2 4.2Å
269	F	89	Confident	76.4	Confident	89 Å²	89	90.9 Å²	90.9	39%	0.39	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	102.8	169.5	-63.2	-64.5	0	0	0	108.2	K267 F271 Y279	K267-F269 HydrophobicContact CB-CD2 4.33Å; K267-F269 HydrophobicContact CB-CE2 3.78Å; K267-F269 HydrophobicContact CB-CZ 4.04Å; K267-F269 HydrophobicContact CD-CE2 4.02Å; K267-F269 HydrophobicContact CD-CZ 3.8Å; F269-F271 HydrophobicContact CB-CE2 4.1Å; F269-Y279 AromaticContact CD2-CD1 3.72Å; F269-Y279 HydrophobicContact CD2-CD1 3.72Å; F269-Y279 HydrophobicContact CD2-CE1 4.3Å; F269-Y279 HydrophobicContact CE2-CD1 4.44Å; F269-Y279 PolarHBondContact N-O 2.75Å; F269-Y279 PolarHBondContact O-N 3.17Å
270	Q	91.2	Very high	78.8	Confident	143 Å²	143	96.3 Å²	96.3	67%	0.668	48%	0.481	S	S	*	.			trans	-123.8	125.2	177	-176.7	176.6	0.8	0	0	108.1	A278	Q270-A278 HydrophobicContact CB-CB 3.72Å; Q270-A278 HydrophobicContact CG-CB 3.91Å
271	F	91.9	Very high	80.9	Confident	111 Å²	111	94.7 Å²	94.7	49%	0.487	46%	0.463	S	S	.	.			trans	-120.3	138.7	177.5	-58.6	-76.4	0	0	0	107.7	F269 E273 N274	F269-F271 HydrophobicContact CB-CE2 4.1Å; F271-E273 PolarHBondContact O-N 2.8Å; F271-N274 HydrophobicContact CB-CB 4.14Å; F271-N274 WeakPolarHBondContact CB-OD1 3.44Å; F271-N274 PolarHBondContact O-N 3.29Å
272	V	89.8	Confident	82.6	Confident	157 Å²	157	93.4 Å²	93.4	95%	0.952	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-27.7	-177.2	176.6	0	0	0	0	111.5	N274	V272-N274 VanDerWaalsContact C-N 3.34Å
273	E	88.5	Confident	83.8	Confident	174 Å²	174	96.9 Å²	96.9	81%	0.813	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-13.6	-177.8	-62.8	175.6	176.5	0	0	113	F271	F271-E273 PolarHBondContact O-N 2.8Å
274	N	89.2	Confident	84.5	Confident	38 Å²	38	98.1 Å²	98.1	20%	0.203	47%	0.466	C	S	.	.			trans	-90.2	126.8	-173	-79.1	64.8	0	0	0	112	F271 V272 R276 D310	F271-N274 HydrophobicContact CB-CB 4.14Å; F271-N274 WeakPolarHBondContact CB-OD1 3.44Å; F271-N274 PolarHBondContact O-N 3.29Å; V272-N274 VanDerWaalsContact C-N 3.34Å; N274-R276 HydrophobicContact CB-CG 4.3Å; N274-R276 PolarHBondContact ND2-NE 3.41Å; N274-R276 PolarHBondContact ND2-NH2 3.44Å; N274-R276 VanDerWaalsContact ND2-NH2 3.18Å; N274-D310 WeakPolarHBondContact CA-OD1 3.35Å; N274-D310 VanDerWaalsContact CA-OD2 3.25Å; N274-D310 WeakPolarHBondContact CA-OD2 3.26Å; N274-D310 WeakPolarHBondContact CB-OD1 3.38Å; N274-D310 VanDerWaalsContact CG-OD1 3.25Å; N274-D310 WeakPolarHBondContact ND2-CB 3.04Å; N274-D310 PolarHBondContact ND2-OD1 3.1Å
275	Y	84.9	Confident	85.1	Confident	201 Å²	201	102.1 Å²	102.1	79%	0.788	48%	0.479	S	S	*	.			trans	-75.7	-30.4	173.1	-63.9	-83.6	0	0	0	112	D310	Y275-D310 PolarHBondContact N-OD1 3.4Å; Y275-D310 PolarHBondContact N-OD2 3.01Å; Y275-D310 VanDerWaalsContact N-OD2 3.09Å
276	R	88.3	Confident	85.7	Confident	52 Å²	52	103.4 Å²	103.4	20%	0.196	48%	0.478	C	S	.	.	S	Bend	trans	-64.1	146.6	177.8	76.2	-165.6	167	72.1	4.5	111.2	N274 D310 W313	N274-R276 HydrophobicContact CB-CG 4.3Å; N274-R276 PolarHBondContact ND2-NE 3.41Å; N274-R276 PolarHBondContact ND2-NH2 3.44Å; N274-R276 VanDerWaalsContact ND2-NH2 3.18Å; R276-D310 WeakPolarHBondContact CD-OD1 3.5Å; R276-D310 WeakPolarHBondContact CG-OD1 3.44Å; R276-D310 PolarHBondContact N-OD1 3.04Å; R276-D310 IonicContact NE-OD1 3.76Å; R276-D310 PolarHBondContact NE-OD1 2.92Å; R276-W313 HydrophobicContact CB-CB 4.06Å; R276-W313 VanDerWaalsContact CB-CD1 3.4Å; R276-W313 HydrophobicContact CB-CD2 3.38Å; R276-W313 VanDerWaalsContact CB-CE2 3.49Å; R276-W313 HydrophobicContact CB-CE3 4.1Å; R276-W313 HydrophobicContact CB-CG 3.33Å; R276-W313 HydrophobicContact CB-CZ2 4.26Å; R276-W313 HydrophobicContact CG-CG 4.46Å
277	P	89.9	Confident	85.9	Confident	84 Å²	84	104 Å²	104	55%	0.545	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-58.2	149.5	177.2	22.5	-32.1	0	0	0	111.8	Y279 W313	P277-Y279 PolarHBondContact O-N 2.74Å; P277-W313 VanDerWaalsContact CD-CH2 3.45Å; P277-W313 HydrophobicContact CG-CH2 3.64Å; P277-W313 HydrophobicContact CG-CZ2 4.08Å; P277-W313 HydrophobicContact CG-CZ3 4.15Å
278	A	91.6	Very high	85.9	Confident	44 Å²	44	110.1 Å²	110.1	36%	0.364	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-55.5	130.1	177.3	0	0	0	0	0	110.6	L268 Q270 Y280	L268-A278 HydrophobicContact CD1-CB 3.84Å; Q270-A278 HydrophobicContact CB-CB 3.72Å; Q270-A278 HydrophobicContact CG-CB 3.91Å; A278-Y280 PolarHBondContact O-N 3.13Å
279	Y	89.5	Confident	85.8	Confident	85 Å²	85	107.7 Å²	107.7	33%	0.333	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	115.9	175.2	174.6	-91.6	0	0	0	109.1	L268 F269 P277 T282	L268-Y279 CarbonylContact C-O 3.36Å; L268-Y279 VanDerWaalsContact CA-O 3.3Å; L268-Y279 WeakPolarHBondContact CA-O 3.18Å; F269-Y279 AromaticContact CD2-CD1 3.72Å; F269-Y279 HydrophobicContact CD2-CD1 3.72Å; F269-Y279 HydrophobicContact CD2-CE1 4.3Å; F269-Y279 HydrophobicContact CE2-CD1 4.44Å; F269-Y279 PolarHBondContact N-O 2.75Å; F269-Y279 PolarHBondContact O-N 3.17Å; P277-Y279 PolarHBondContact O-N 2.74Å; Y279-T282 PolarHBondContact OH-N 3.34Å; Y279-T282 PolarHBondContact OH-O 3.36Å
280	Y	91.2	Very high	85.9	Confident	173 Å²	173	105 Å²	105	68%	0.678	48%	0.479	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.2	105.3	168.1	-174.2	-106	0	0	0	109.7	A266 K267 L268 A278	A266-Y280 HydrophobicContact CB-CD1 4.43Å; A266-Y280 HydrophobicContact CB-CD2 4.36Å; A266-Y280 HydrophobicContact CB-CE1 3.86Å; A266-Y280 HydrophobicContact CB-CE2 3.79Å; K267-Y280 WeakPolarHBondContact O-CA 3.39Å; L268-Y280 HydrophobicContact CB-CD2 4.15Å; L268-Y280 HydrophobicContact CD1-CD2 4.2Å; A278-Y280 PolarHBondContact O-N 3.13Å
281	G	87.9	Confident	85.5	Confident	14 Å²	14	101.3 Å²	101.3	14%	0.144	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.3	-179.3	-175.7	0	0	0	0	0	114.4	A266 K267	A266-G281 CarbonylContact C-O 3.53Å; K267-G281 PolarHBondContact N-O 3.11Å; K267-G281 PolarHBondContact O-N 2.69Å
282	T	82.7	Confident	84.9	Confident	44 Å²	44	100 Å²	100	27%	0.27	48%	0.484	S	S	.	.			trans	-97.1	124.8	-178.9	69.3	0	0	0	0	110.7	L264 Y279 R284	L264-T282 HydrophobicContact CB-CG2 3.94Å; Y279-T282 PolarHBondContact OH-N 3.34Å; Y279-T282 PolarHBondContact OH-O 3.36Å; T282-R284 PolarHBondContact OG1-NE 3.1Å
283	W	75.4	Confident	84.6	Confident	140 Å²	140	101.6 Å²	101.6	53%	0.53	47%	0.473	S	S	.	.			trans	-98.5	109.3	170.8	-173	-95.5	0	0	0	111	R285 L303	W283-R285 HydrophobicContact CZ2-CB 4.24Å; W283-R285 PolarHBondContact NE1-O 3.19Å; W283-R285 VanDerWaalsContact NE1-O 3.07Å; W283-L303 HydrophobicContact CH2-CD2 4.42Å
284	R	72.2	Confident	84.5	Confident	92 Å²	92	101.1 Å²	101.1	35%	0.347	46%	0.463	S	S	.	.			trans	-102.5	-16.1	-171.7	-60.4	172.3	-174.3	-176.1	6.7	113.9	A249 H253 L264 T282 R286	A249-R284 PolarHBondContact O-NH1 2.92Å; H253-R284 HydrophobicContact CB-CG 4.29Å; H253-R284 PolarHBondContact CD2-NH1 2.98Å; H253-R284 PolarHBondContact NE2-NH1 3.37Å; H253-R284 VanDerWaalsContact NE2-NH1 3.16Å; L264-R284 HydrophobicContact CD2-CG 4.18Å; T282-R284 PolarHBondContact OG1-NE 3.1Å; R284-R286 PolarHBondContact O-N 2.86Å
285	R	76.9	Confident	84.5	Confident	120 Å²	120	103 Å²	103	45%	0.453	48%	0.478	S	S	.	.			trans	-76.5	124.8	-174.7	-165.9	156.8	67.7	135	4.5	109.6	W283 Q302	W283-R285 HydrophobicContact CZ2-CB 4.24Å; W283-R285 PolarHBondContact NE1-O 3.19Å; W283-R285 VanDerWaalsContact NE1-O 3.07Å; R285-Q302 PolarHBondContact NH1-O 2.95Å; R285-Q302 VanDerWaalsContact NH1-O 3.16Å; R285-Q302 PolarHBondContact NH2-O 3.28Å
286	R	77.6	Confident	84.7	Confident	176 Å²	176	103 Å²	103	66%	0.664	48%	0.482	S	S	*	.			trans	-104.3	127.5	177.1	-67	-173.7	176.9	-179.1	-0.3	109.7	R284 Q302	R284-R286 PolarHBondContact O-N 2.86Å; R286-Q302 PolarHBondContact O-NE2 3.02Å
287	S	83	Confident	84.8	Confident	36 Å²	36	101.4 Å²	101.4	25%	0.252	48%	0.48	S	S	.	.			trans	-69.1	141.6	166.8	44.9	0	0	0	0	110.5	I289 V290 D299	S287-I289 VanDerWaalsContact C-N 3.31Å; S287-V290 WeakPolarHBondContact OG-CB 3.44Å; S287-V290 PolarHBondContact OG-O 3.36Å; S287-D299 WeakPolarHBondContact CA-OD2 3.47Å; S287-D299 WeakPolarHBondContact CB-OD2 3.44Å
288	R	83.4	Confident	84.8	Confident	235 Å²	235	105.2 Å²	105.2	89%	0.887	48%	0.484	S	S	*	.	S	Bend	trans	-81.8	-20.2	169	-65.3	-174.5	-176.9	-162.6	2	111.5	D299	R288-D299 PolarHBondContact N-OD2 3.48Å
289	I	88.6	Confident	84.8	Confident	53 Å²	53	103.3 Å²	103.3	27%	0.272	47%	0.467	S	S	.	.	S	Bend	trans	-93.8	-53.7	-175.3	-63.2	165.8	0	0	0	110.6	S287 T291 A297 R298 D299 Y301	S287-I289 VanDerWaalsContact C-N 3.31Å; I289-T291 PolarHBondContact O-N 3.36Å; I289-A297 HydrophobicContact CG2-CB 3.75Å; I289-R298 WeakPolarHBondContact CG2-O 3.43Å; I289-D299 HydrophobicContact CB-CB 4.28Å; I289-D299 HydrophobicContact CD1-CB 4.39Å; I289-Y301 HydrophobicContact CD1-CD2 3.5Å; I289-Y301 HydrophobicContact CD1-CE2 3.72Å
290	V	89.6	Confident	84.7	Confident	34 Å²	34	103.9 Å²	103.9	21%	0.206	48%	0.476	C	S	.	.	S	Bend	trans	-75.5	118.3	174.5	-158.2	0	0	0	0	108.7	S287 R294 P295 A297 D299	S287-V290 WeakPolarHBondContact OG-CB 3.44Å; S287-V290 PolarHBondContact OG-O 3.36Å; V290-R294 WeakPolarHBondContact CG1-O 3.44Å; V290-P295 WeakPolarHBondContact CG1-O 3.08Å; V290-A297 WeakPolarHBondContact CG2-O 2.91Å; V290-D299 HydrophobicContact CG2-CB 4.08Å
291	T	83.5	Confident	84.5	Confident	64 Å²	64	105.5 Å²	105.5	39%	0.393	48%	0.483	S	S	.	.	B	Isolated β-bridge	trans	-136.7	168.1	-179.8	59.7	0	0	0	0	109	I289 R293 R294	I289-T291 PolarHBondContact O-N 3.36Å; T291-R293 PolarHBondContact O-N 2.72Å; T291-R294 PolarHBondContact N-O 3.28Å; T291-R294 CarbonylContact O-C 3.57Å; T291-R294 PolarHBondContact O-N 3.2Å
292	G	79.9	Confident	84.2	Confident	84 Å²	84	107.8 Å²	107.8	87%	0.866	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-21.2	178.9	0	0	0	0	0	114.6
293	R	82	Confident	84.4	Confident	191 Å²	191	108.9 Å²	108.9	72%	0.721	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-13.8	173.9	-72.8	-173.1	170.5	-92.1	5.1	114.2	T291 P295	T291-R293 PolarHBondContact O-N 2.72Å; R293-P295 VanDerWaalsContact C-CD 3.48Å
294	R	86.9	Confident	84.9	Confident	164 Å²	164	106.7 Å²	106.7	62%	0.619	49%	0.492	S	S	*	.	B	Isolated β-bridge	trans	-132.4	64.1	179	-63.4	-178.4	69.9	151.6	0.8	109.5	V290 T291 F296 A297	V290-R294 WeakPolarHBondContact CG1-O 3.44Å; T291-R294 PolarHBondContact N-O 3.28Å; T291-R294 CarbonylContact O-C 3.57Å; T291-R294 PolarHBondContact O-N 3.2Å; R294-F296 VanDerWaalsContact C-N 3.3Å; R294-F296 PolarHBondContact O-N 3.33Å; R294-A297 HydrophobicContact CB-CB 4.06Å; R294-A297 PolarHBondContact O-N 3.4Å
295	P	89	Confident	85.6	Confident	78 Å²	78	107.5 Å²	107.5	51%	0.506	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-28.6	-174.9	27.7	-35.2	0	0	0	113	V290 R293	V290-P295 WeakPolarHBondContact CG1-O 3.08Å; R293-P295 VanDerWaalsContact C-CD 3.48Å
296	F	89.5	Confident	86.2	Confident	199 Å²	199	106.6 Å²	106.6	87%	0.873	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	9.1	-179.3	-53.7	-63.4	0	0	0	113.8	R294	R294-F296 VanDerWaalsContact C-N 3.3Å; R294-F296 PolarHBondContact O-N 3.33Å
297	A	91.3	Very high	86.6	Confident	20 Å²	20	103.2 Å²	103.2	17%	0.165	50%	0.502	C	S	.	.			trans	-71.8	151.4	172.7	0	0	0	0	0	110	I289 V290 R294	I289-A297 HydrophobicContact CG2-CB 3.75Å; V290-A297 WeakPolarHBondContact CG2-O 2.91Å; R294-A297 HydrophobicContact CB-CB 4.06Å; R294-A297 PolarHBondContact O-N 3.4Å
298	R	89.9	Confident	86.7	Confident	163 Å²	163	105.4 Å²	105.4	62%	0.615	51%	0.511	S	S	*	.			trans	-100.9	131.2	175.4	-57.9	-172.6	-54.7	-169.6	3.2	110.1	I289 D300 Y305	I289-R298 WeakPolarHBondContact CG2-O 3.43Å; R298-D300 WeakPolarHBondContact CB-OD1 3.43Å; R298-D300 IonicContact NE-OD1 3Å; R298-D300 IonicContact NH2-OD2 3.38Å; R298-Y305 HydrophobicContact CB-CD2 4.05Å; R298-Y305 HydrophobicContact CB-CE2 3.86Å
299	D	90.1	Very high	86.7	Confident	4 Å²	4	97.2 Å²	97.2	2%	0.021	49%	0.49	C	S	.	.			trans	-98.3	72.8	173.2	-164.7	-21.3	0	0	0	111	S287 R288 I289 V290 Y301 Q302 L303 Y305	S287-D299 WeakPolarHBondContact CA-OD2 3.47Å; S287-D299 WeakPolarHBondContact CB-OD2 3.44Å; R288-D299 PolarHBondContact N-OD2 3.48Å; I289-D299 HydrophobicContact CB-CB 4.28Å; I289-D299 HydrophobicContact CD1-CB 4.39Å; V290-D299 HydrophobicContact CG2-CB 4.08Å; D299-Y301 PolarHBondContact O-N 2.79Å; D299-Y301 PolarHBondContact OD1-N 2.65Å; D299-Q302 PolarHBondContact O-N 3.43Å; D299-Q302 PolarHBondContact OD1-N 3.41Å; D299-L303 PolarHBondContact O-N 2.91Å; D299-L303 VanDerWaalsContact O-N 3.12Å; D299-Y305 VanDerWaalsContact N-CE2 3.28Å; D299-Y305 PolarHBondContact N-OH 2.72Å
300	D	87.9	Confident	86.6	Confident	97 Å²	97	95.2 Å²	95.2	52%	0.519	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-5.7	-177.3	-58.2	-25.5	0	0	0	113.1	R298	R298-D300 WeakPolarHBondContact CB-OD1 3.43Å; R298-D300 IonicContact NE-OD1 3Å; R298-D300 IonicContact NH2-OD2 3.38Å
301	Y	86.4	Confident	86.4	Confident	208 Å²	208	100.4 Å²	100.4	82%	0.816	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-28.1	174.2	-61.4	-77.4	0	0	0	113	I289 D299	I289-Y301 HydrophobicContact CD1-CD2 3.5Å; I289-Y301 HydrophobicContact CD1-CE2 3.72Å; D299-Y301 PolarHBondContact O-N 2.79Å; D299-Y301 PolarHBondContact OD1-N 2.65Å
302	Q	83.6	Confident	86.5	Confident	61 Å²	61	104.9 Å²	104.9	29%	0.285	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107	-30.7	-173.8	-67.1	-168.9	9	0	0	113.3	R285 R286 D299	R285-Q302 PolarHBondContact NH1-O 2.95Å; R285-Q302 VanDerWaalsContact NH1-O 3.16Å; R285-Q302 PolarHBondContact NH2-O 3.28Å; R286-Q302 PolarHBondContact O-NE2 3.02Å; D299-Q302 PolarHBondContact O-N 3.43Å; D299-Q302 PolarHBondContact OD1-N 3.41Å
303	L	85	Confident	86.8	Confident	68 Å²	68	107.6 Å²	107.6	36%	0.356	51%	0.507	S	S	.	.			trans	-135.5	131.8	-175.6	-64.9	173.3	0	0	0	107.8	W283 D299 Y305	W283-L303 HydrophobicContact CH2-CD2 4.42Å; D299-L303 PolarHBondContact O-N 2.91Å; D299-L303 VanDerWaalsContact O-N 3.12Å; L303-Y305 HydrophobicContact CB-CD2 4.47Å; L303-Y305 HydrophobicContact CB-CE2 4.03Å; L303-Y305 WeakPolarHBondContact O-CD2 3.35Å; L303-Y305 PolarHBondContact O-N 3.47Å
304	D	87.7	Confident	86.5	Confident	94 Å²	94	106 Å²	106	50%	0.503	51%	0.507	S	S	.	.			trans	-88.9	103.1	169.8	-169.5	-16.3	0	0	0	108.4	S306 I307	D304-S306 VanDerWaalsContact CG-OG 3.3Å; D304-S306 PolarHBondContact O-N 2.89Å; D304-S306 WeakPolarHBondContact OD1-CB 3.27Å; D304-S306 PolarHBondContact OD1-N 3.22Å; D304-S306 PolarHBondContact OD1-OG 2.82Å; D304-S306 PolarHBondContact OD2-OG 2.77Å; D304-I307 HydrophobicContact CB-CD1 4.11Å; D304-I307 HydrophobicContact CB-CG1 4.32Å; D304-I307 PolarHBondContact O-N 3.3Å
305	Y	86.5	Confident	85.8	Confident	108 Å²	108	106.5 Å²	106.5	42%	0.424	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-6.1	179.9	-66.3	-94.8	0	0	0	113.2	R298 D299 L303	R298-Y305 HydrophobicContact CB-CD2 4.05Å; R298-Y305 HydrophobicContact CB-CE2 3.86Å; D299-Y305 VanDerWaalsContact N-CE2 3.28Å; D299-Y305 PolarHBondContact N-OH 2.72Å; L303-Y305 HydrophobicContact CB-CD2 4.47Å; L303-Y305 HydrophobicContact CB-CE2 4.03Å; L303-Y305 WeakPolarHBondContact O-CD2 3.35Å; L303-Y305 PolarHBondContact O-N 3.47Å
306	S	88.8	Confident	84.9	Confident	102 Å²	102	111.7 Å²	111.7	71%	0.713	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-14.9	175.6	72	0	0	0	0	113.2	D304	D304-S306 VanDerWaalsContact CG-OG 3.3Å; D304-S306 PolarHBondContact O-N 2.89Å; D304-S306 WeakPolarHBondContact OD1-CB 3.27Å; D304-S306 PolarHBondContact OD1-N 3.22Å; D304-S306 PolarHBondContact OD1-OG 2.82Å; D304-S306 PolarHBondContact OD2-OG 2.77Å
307	I	86.4	Confident	83.9	Confident	105 Å²	105	107.7 Å²	107.7	54%	0.538	52%	0.518	S	S	.	.	S	Bend	trans	-102.8	123.6	179.9	-58.7	175.7	0	0	0	108.6	D304	D304-I307 HydrophobicContact CB-CD1 4.11Å; D304-I307 HydrophobicContact CB-CG1 4.32Å; D304-I307 PolarHBondContact O-N 3.3Å
308	D	85.3	Confident	83	Confident	82 Å²	82	110.2 Å²	110.2	44%	0.439	53%	0.533	S	S	.	.			trans	-90	118.3	168.4	-162.5	-17.7	0	0	0	110	D310 D311	D308-D310 PolarHBondContact O-N 2.91Å; D308-D310 WeakPolarHBondContact OD1-CB 3.29Å; D308-D310 PolarHBondContact OD1-N 3.16Å; D308-D311 HydrophobicContact CB-CB 4.41Å; D308-D311 PolarHBondContact O-N 3.28Å
309	S	83.5	Confident	81.7	Confident	62 Å²	62	105.3 Å²	105.3	43%	0.434	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-21.6	174.5	58.1	0	0	0	0	113.2
310	D	86.6	Confident	80.8	Confident	12 Å²	12	114.4 Å²	114.4	6%	0.064	58%	0.576	C	S	.	*	T	Hydrogen-bonded Turn	trans	-74.7	-36.6	178.1	-152.5	69.9	0	0	0	112.8	N274 Y275 R276 D308 E312 W313	N274-D310 WeakPolarHBondContact CA-OD1 3.35Å; N274-D310 VanDerWaalsContact CA-OD2 3.25Å; N274-D310 WeakPolarHBondContact CA-OD2 3.26Å; N274-D310 WeakPolarHBondContact CB-OD1 3.38Å; N274-D310 VanDerWaalsContact CG-OD1 3.25Å; N274-D310 WeakPolarHBondContact ND2-CB 3.04Å; N274-D310 PolarHBondContact ND2-OD1 3.1Å; Y275-D310 PolarHBondContact N-OD1 3.4Å; Y275-D310 PolarHBondContact N-OD2 3.01Å; Y275-D310 VanDerWaalsContact N-OD2 3.09Å; R276-D310 WeakPolarHBondContact CD-OD1 3.5Å; R276-D310 WeakPolarHBondContact CG-OD1 3.44Å; R276-D310 PolarHBondContact N-OD1 3.04Å; R276-D310 IonicContact NE-OD1 3.76Å; R276-D310 PolarHBondContact NE-OD1 2.92Å; D308-D310 PolarHBondContact O-N 2.91Å; D308-D310 WeakPolarHBondContact OD1-CB 3.29Å; D308-D310 PolarHBondContact OD1-N 3.16Å; D310-E312 PolarHBondContact O-N 3.44Å; D310-W313 WeakPolarHBondContact O-CB 3.38Å; D310-W313 PolarHBondContact O-N 3.18Å
311	D	85.2	Confident	79.5	Confident	143 Å²	143	112.7 Å²	112.7	77%	0.765	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	-24.6	178	-74.1	-11.4	0	0	0	112.6	D308	D308-D311 HydrophobicContact CB-CB 4.41Å; D308-D311 PolarHBondContact O-N 3.28Å
312	E	84.8	Confident	78.4	Confident	157 Å²	157	110 Å²	110	73%	0.734	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	-11.8	175.4	-170.3	174.8	-177.8	0	0	112.7	D310 E314	D310-E312 PolarHBondContact O-N 3.44Å; E312-E314 PolarHBondContact O-N 3.13Å; E312-E314 VanDerWaalsContact O-N 3.12Å
313	W	86.1	Confident	77.4	Confident	141 Å²	141	111.9 Å²	111.9	53%	0.534	59%	0.585	S	S	.	*			trans	-71.5	111.2	178.1	-101	80	0	0	0	110.7	R276 P277 D310 E315	R276-W313 HydrophobicContact CB-CB 4.06Å; R276-W313 VanDerWaalsContact CB-CD1 3.4Å; R276-W313 HydrophobicContact CB-CD2 3.38Å; R276-W313 VanDerWaalsContact CB-CE2 3.49Å; R276-W313 HydrophobicContact CB-CE3 4.1Å; R276-W313 HydrophobicContact CB-CG 3.33Å; R276-W313 HydrophobicContact CB-CZ2 4.26Å; R276-W313 HydrophobicContact CG-CG 4.46Å; P277-W313 VanDerWaalsContact CD-CH2 3.45Å; P277-W313 HydrophobicContact CG-CH2 3.64Å; P277-W313 HydrophobicContact CG-CZ2 4.08Å; P277-W313 HydrophobicContact CG-CZ3 4.15Å; D310-W313 WeakPolarHBondContact O-CB 3.38Å; D310-W313 PolarHBondContact O-N 3.18Å; W313-E315 PolarHBondContact O-N 2.73Å
314	E	75.9	Confident	76	Confident	157 Å²	157	114 Å²	114	73%	0.734	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-64.2	124.4	169.8	-62.9	-172.5	161.8	0	0	108.7	E312 E316	E312-E314 PolarHBondContact O-N 3.13Å; E312-E314 VanDerWaalsContact O-N 3.12Å; E314-E316 PolarHBondContact O-N 3.02Å; E314-E316 VanDerWaalsContact O-N 3.13Å
315	E	72.1	Confident	74.4	Confident	176 Å²	176	114.2 Å²	114.2	82%	0.822	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-60.6	117.6	167.8	-168.9	175.1	-168	0	0	107	W313 E317	W313-E315 PolarHBondContact O-N 2.73Å; E315-E317 PolarHBondContact O-N 2.83Å
316	E	70.1	Confident	72.7	Confident	186 Å²	186	116 Å²	116	87%	0.869	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-51.4	116.8	-172.6	-161.1	169.8	-155.5	0	0	109	E314	E314-E316 PolarHBondContact O-N 3.02Å; E314-E316 VanDerWaalsContact O-N 3.13Å
317	E	68.9	Low	70.8	Confident	115 Å²	115	116.9 Å²	116.9	54%	0.537	62%	0.616	S	S	.	*	P	Polyproline II helix	trans	-53.3	135.5	176.8	-71.3	176.8	159.1	0	0	107.2	R73 E315 G319	R73-E317 IonicContact CZ-OE1 3.82Å; R73-E317 IonicContact NE-OE1 3.95Å; R73-E317 PolarHBondContact NE-OE1 3.19Å; R73-E317 IonicContact NH2-OE1 3.73Å; R73-E317 PolarHBondContact NH2-OE1 3.23Å; E315-E317 PolarHBondContact O-N 2.83Å; E317-G319 PolarHBondContact O-N 3.08Å
318	P	71.8	Confident	68.9	Low	73 Å²	73	119.1 Å²	119.1	47%	0.474	62%	0.624	S	S	.	*			trans	-32.9	101.6	166.9	-41	43.8	0	0	0	112.8	K80 E320	K80-P318 HydrophobicContact CD-CB 3.7Å; K80-P318 HydrophobicContact CD-CG 3.55Å; P318-E320 PolarHBondContact O-N 2.79Å
319	G	63.9	Low	67.1	Low	61 Å²	61	122.6 Å²	122.6	63%	0.629	64%	0.643	S	S	*	*			trans	-49	134.8	168.9	0	0	0	0	0	108.3	E317 S321	E317-G319 PolarHBondContact O-N 3.08Å; G319-S321 PolarHBondContact O-N 3.42Å
320	E	70.3	Confident	65.3	Low	195 Å²	195	127.9 Å²	127.9	91%	0.911	66%	0.661	S	S	*	*			trans	-49.5	120.5	171.2	-64.1	178.5	-177	0	0	106.5	P318 I322	P318-E320 PolarHBondContact O-N 2.79Å; E320-I322 PolarHBondContact O-N 2.83Å
321	S	60.9	Low	63.2	Low	61 Å²	61	135.9 Å²	135.9	43%	0.427	70%	0.698	S	S	.	*			trans	-65.1	112.5	-171.7	-63.8	0	0	0	0	107.4	G319 T323 Q324	G319-S321 PolarHBondContact O-N 3.42Å; S321-T323 PolarHBondContact O-N 3.37Å; S321-Q324 WeakPolarHBondContact O-CB 3.45Å; S321-Q324 PolarHBondContact O-N 2.97Å
322	I	63.2	Low	61.2	Low	151 Å²	151	136.3 Å²	136.3	77%	0.774	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-59.8	-7.1	179.9	-154	153.3	0	0	0	113	E320 Q324 S325	E320-I322 PolarHBondContact O-N 2.83Å; I322-Q324 VanDerWaalsContact C-N 3.33Å; I322-S325 PolarHBondContact O-OG 3.39Å
323	T	62.3	Low	59	Low	100 Å²	100	137.6 Å²	137.6	61%	0.613	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-75.9	-18.1	171.2	57.5	0	0	0	0	113.4	S321 S325 N326	S321-T323 PolarHBondContact O-N 3.37Å; T323-S325 VanDerWaalsContact C-N 3.25Å; T323-S325 PolarHBondContact O-N 2.98Å; T323-N326 PolarHBondContact O-N 3.35Å
324	Q	56.2	Low	56.8	Low	112 Å²	112	138.1 Å²	138.1	52%	0.523	72%	0.719	S	S	.	*	G	3₁₀ helix	trans	-73.2	-16.5	179.9	-69.4	-77.3	-36.2	0	0	112.6	S321 I322 N326	S321-Q324 WeakPolarHBondContact O-CB 3.45Å; S321-Q324 PolarHBondContact O-N 2.97Å; I322-Q324 VanDerWaalsContact C-N 3.33Å; Q324-N326 VanDerWaalsContact C-N 3.32Å
325	S	52.9	Low	55.2	Low	99 Å²	99	139.6 Å²	139.6	69%	0.692	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-86	0.2	173.6	66.7	0	0	0	0	113.9	I322 T323	I322-S325 PolarHBondContact O-OG 3.39Å; T323-S325 VanDerWaalsContact C-N 3.25Å; T323-S325 PolarHBondContact O-N 2.98Å
326	N	51.9	Low	53.7	Low	145 Å²	145	140.5 Å²	140.5	78%	0.775	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-110.9	19.9	-174.3	-149.9	59.5	0	0	0	113.6	T323 Q324	T323-N326 PolarHBondContact O-N 3.35Å; Q324-N326 VanDerWaalsContact C-N 3.32Å
327	N	48.7	Very low	52.4	Low	121 Å²	121	140.3 Å²	140.3	65%	0.647	73%	0.727	S	S	*	*	S	Bend	trans	-147.7	20.8	179.9	-155	85.5	0	0	0	114.6
328	E	47	Very low	51.1	Low	153 Å²	153	142.8 Å²	142.8	72%	0.715	74%	0.744	S	S	*	*	S	Bend	trans	-113.9	95.3	166.6	-65.5	-176	-176.6	0	0	104.8
329	D	47.4	Very low	49.7	Very low	154 Å²	154	141.3 Å²	141.3	82%	0.824	74%	0.741	S	S	*	*			trans	157.4	11.1	160.3	-73.1	-11.6	0	0	0	112.6	E331	D329-E331 PolarHBondContact O-N 2.94Å; D329-E331 VanDerWaalsContact O-N 3.09Å
330	E	45	Very low	48.9	Very low	173 Å²	173	145.4 Å²	145.4	81%	0.808	75%	0.749	S	S	*	*	S	Bend	trans	-78.4	42.1	162.8	-73.1	-160.7	-172.3	0	0	112.6
331	E	42.9	Very low	47.8	Very low	181 Å²	181	142.5 Å²	142.5	85%	0.846	74%	0.735	S	S	*	*			trans	-149	49.1	168	-68.8	-167.3	-171.2	0	0	112.1	D329	D329-E331 PolarHBondContact O-N 2.94Å; D329-E331 VanDerWaalsContact O-N 3.09Å
332	D	42.3	Very low	47.4	Very low	151 Å²	151	146.9 Å²	146.9	81%	0.807	75%	0.754	S	S	*	*			trans	-134.3	63.4	155.4	-77	-44.8	0	0	0	108.4	D334	D332-D334 PolarHBondContact O-N 3.11Å
333	E	40	Very low	47.1	Very low	184 Å²	184	145.4 Å²	145.4	86%	0.86	75%	0.748	S	S	*	*			trans	-62.4	93.9	152.5	-71.4	-178.2	177	0	0	106.5
334	D	39	Very low	47.1	Very low	153 Å²	153	145.4 Å²	145.4	82%	0.818	74%	0.744	S	S	*	*			trans	160.6	80.3	150.1	-78.4	-25	0	0	0	109.3	D332	D332-D334 PolarHBondContact O-N 3.11Å
335	E	41.2	Very low	47.4	Very low	187 Å²	187	146.9 Å²	146.9	87%	0.874	76%	0.756	S	S	*	*			trans	-175.2	105.6	139	-101.6	170.2	-148.8	0	0	109.2	K337	E335-K337 VanDerWaalsContact C-N 3.3Å; E335-K337 PolarHBondContact O-N 3.14Å
336	E	42	Very low	47.9	Very low	195 Å²	195	147.8 Å²	147.8	91%	0.911	75%	0.753	S	S	*	*			trans	-51.2	92.5	164.9	-68.6	178.6	164.9	0	0	109.7
337	K	42.6	Very low	48.6	Very low	183 Å²	183	148.6 Å²	148.6	80%	0.796	75%	0.752	S	S	*	*			trans	-118.2	70.3	167.8	-150.7	-175.2	178.5	-162.2	0	108.2	E335 G339	E335-K337 VanDerWaalsContact C-N 3.3Å; E335-K337 PolarHBondContact O-N 3.14Å; K337-G339 PolarHBondContact O-N 2.87Å
338	D	42.2	Very low	49.8	Very low	167 Å²	167	151 Å²	151	89%	0.893	76%	0.757	S	S	*	*			trans	-55.2	101.4	161.4	-73.8	-36.9	0	0	0	108.4
339	G	42.3	Very low	50.9	Low	41 Å²	41	150.5 Å²	150.5	42%	0.423	75%	0.752	S	S	.	*	S	Bend	trans	179.3	74.5	179.3	0	0	0	0	0	112	K337 Q341	K337-G339 PolarHBondContact O-N 2.87Å; G339-Q341 PolarHBondContact O-N 2.93Å
340	D	46.2	Very low	52.3	Low	147 Å²	147	147.8 Å²	147.8	79%	0.786	74%	0.741	S	S	*	*			trans	51.1	48.6	145	-49.4	-33.6	0	0	0	117.2	D342	D340-D342 PolarHBondContact O-N 2.74Å
341	Q	46.4	Very low	53.6	Low	135 Å²	135	144.1 Å²	144.1	63%	0.631	73%	0.732	S	S	*	*	G	3₁₀ helix	trans	-80.9	10.5	176.3	-152.9	87.9	16.6	0	0	113.6	G339 D343 D344	G339-Q341 PolarHBondContact O-N 2.93Å; Q341-D343 PolarHBondContact O-N 2.92Å; Q341-D344 WeakPolarHBondContact CG-OD2 3.5Å; Q341-D344 PolarHBondContact NE2-OD2 3.18Å
342	D	53.5	Low	54.8	Low	152 Å²	152	139.9 Å²	139.9	81%	0.813	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-68.2	-2.2	178.2	-74.5	-21.3	0	0	0	113.3	D340	D340-D342 PolarHBondContact O-N 2.74Å
343	D	56.8	Low	56	Low	121 Å²	121	133.4 Å²	133.4	65%	0.647	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-94.2	-6.6	-174.6	-73.2	-23.8	0	0	0	114.8	Q341	Q341-D343 PolarHBondContact O-N 2.92Å
344	D	62.4	Low	57.6	Low	99 Å²	99	131 Å²	131	53%	0.529	67%	0.665	S	S	.	*	S	Bend	trans	-78.1	-29.2	-173.2	-75.4	-28.4	0	0	0	113.9	Q341 D346 Q347	Q341-D344 WeakPolarHBondContact CG-OD2 3.5Å; Q341-D344 PolarHBondContact NE2-OD2 3.18Å; D344-D346 VanDerWaalsContact C-N 3.31Å; D344-D346 PolarHBondContact O-N 2.84Å; D344-Q347 VanDerWaalsContact O-CB 3.31Å; D344-Q347 WeakPolarHBondContact O-CB 3.38Å; D344-Q347 PolarHBondContact O-N 3.34Å
345	D	62.6	Low	58.9	Low	144 Å²	144	124.5 Å²	124.5	77%	0.77	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-71.1	-28.1	-178.4	-76.7	-21.7	0	0	0	112.6	Q347	D345-Q347 VanDerWaalsContact C-N 3.26Å; D345-Q347 PolarHBondContact O-N 3.06Å
346	D	62.9	Low	60.3	Low	118 Å²	118	118.3 Å²	118.3	63%	0.631	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-77.6	-11	178.6	-75.6	-20.6	0	0	0	112.6	D344 F348 F349	D344-D346 VanDerWaalsContact C-N 3.31Å; D344-D346 PolarHBondContact O-N 2.84Å; D346-F348 PolarHBondContact O-N 3.19Å; D346-F349 PolarHBondContact O-N 3.31Å
347	Q	67.5	Low	61.5	Low	162 Å²	162	115.1 Å²	115.1	76%	0.757	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-64.7	-25.8	-178.7	-175.9	55.6	87	0	0	113.1	D344 D345	D344-Q347 VanDerWaalsContact O-CB 3.31Å; D344-Q347 WeakPolarHBondContact O-CB 3.38Å; D344-Q347 PolarHBondContact O-N 3.34Å; D345-Q347 VanDerWaalsContact C-N 3.26Å; D345-Q347 PolarHBondContact O-N 3.06Å
348	F	73	Confident	62.5	Low	172 Å²	172	113.3 Å²	113.3	75%	0.754	60%	0.596	S	S	*	*	S	Bend	trans	-79.5	-34.4	179.4	-179	-108.1	0	0	0	112.9	D346	D346-F348 PolarHBondContact O-N 3.19Å
349	F	70.8	Confident	63.5	Low	141 Å²	141	110.2 Å²	110.2	62%	0.618	58%	0.576	S	S	*	*	S	Bend	trans	-91	119.6	-174.7	-68.3	-74	0	0	0	110.6	D346 P351	D346-F349 PolarHBondContact O-N 3.31Å; F349-P351 VanDerWaalsContact O-CD 3.31Å; F349-P351 WeakPolarHBondContact O-CD 3.49Å
350	V	77.3	Confident	64	Low	97 Å²	97	110 Å²	110	59%	0.588	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-60	123.5	166.7	178.9	0	0	0	0	108	Y354	V350-Y354 HydrophobicContact CG1-CD1 3.68Å; V350-Y354 HydrophobicContact CG1-CD2 4.39Å; V350-Y354 HydrophobicContact CG1-CG 3.53Å
351	P	71.3	Confident	64.2	Low	96 Å²	96	106.9 Å²	106.9	62%	0.623	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-54.1	143.4	179.9	-28.3	35.4	0	0	0	111.7	F349 G353 Y354	F349-P351 VanDerWaalsContact O-CD 3.31Å; F349-P351 WeakPolarHBondContact O-CD 3.49Å; P351-G353 PolarHBondContact O-N 3.42Å; P351-Y354 WeakPolarHBondContact O-CB 3.43Å; P351-Y354 PolarHBondContact O-N 2.96Å; P351-Y354 VanDerWaalsContact O-N 3.14Å
352	H	68.8	Low	64.3	Low	93 Å²	93	104.1 Å²	104.1	43%	0.431	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-54.7	133.2	176.3	-63.3	-58.3	0	0	0	110	V383 Y386	H352-V383 WeakPolarHBondContact O-CG2 3.11Å; H352-Y386 HydrophobicContact CB-CD1 3.85Å; H352-Y386 HydrophobicContact CB-CD2 4.16Å; H352-Y386 HydrophobicContact CB-CE1 4.48Å; H352-Y386 HydrophobicContact CB-CG 3.7Å; H352-Y386 AromaticContact CD2-CD1 3.29Å; H352-Y386 WeakPolarHBondContact CD2-CD1 3.38Å; H352-Y386 AromaticContact CD2-CE1 3.04Å; H352-Y386 WeakPolarHBondContact CD2-CE1 3.41Å; H352-Y386 AromaticContact CD2-CE2 3.84Å; H352-Y386 AromaticContact CD2-CG 3.84Å; H352-Y386 AromaticContact CD2-CZ 3.33Å; H352-Y386 AromaticContact CE1-CE1 3.96Å; H352-Y386 AromaticContact CE1-CE2 3.42Å; H352-Y386 VanDerWaalsContact CE1-CE2 3.42Å; H352-Y386 WeakPolarHBondContact CE1-CE2 3.19Å; H352-Y386 AromaticContact CE1-CZ 3.37Å; H352-Y386 AromaticContact CG-CD1 3.49Å; H352-Y386 VanDerWaalsContact CG-CD1 3.49Å; H352-Y386 AromaticContact CG-CD2 3.67Å; H352-Y386 AromaticContact CG-CE1 3.65Å; H352-Y386 AromaticContact CG-CE2 3.77Å; H352-Y386 AromaticContact CG-CG 3.53Å; H352-Y386 AromaticContact CG-CZ 3.77Å; H352-Y386 AromaticContact ND1-CD2 3.66Å; H352-Y386 AromaticContact ND1-CE2 3.5Å; H352-Y386 AromaticContact ND1-CZ 3.78Å; H352-Y386 AromaticContact NE2-CD1 3.97Å; H352-Y386 AromaticContact NE2-CE1 3.27Å; H352-Y386 VanDerWaalsContact NE2-CE1 3.27Å; H352-Y386 WeakPolarHBondContact NE2-CE1 3.38Å; H352-Y386 AromaticContact NE2-CE2 3.61Å; H352-Y386 AromaticContact NE2-CZ 3.04Å; H352-Y386 PolarHBondContact NE2-OH 3.01Å; H352-Y386 VanDerWaalsContact NE2-OH 3.12Å
353	G	67.8	Low	64.1	Low	15 Å²	15	103.5 Å²	103.5	16%	0.155	56%	0.561	C	S	.	*	T	Hydrogen-bonded Turn	trans	88.3	0.1	-178.4	0	0	0	0	0	116.4	P351 L355 Q379 S382	P351-G353 PolarHBondContact O-N 3.42Å; G353-L355 PolarHBondContact O-N 3.19Å; G353-Q379 WeakPolarHBondContact O-CA 3.34Å; G353-Q379 WeakPolarHBondContact O-CB 3.28Å; G353-Q379 VanDerWaalsContact O-CG 3.28Å; G353-Q379 WeakPolarHBondContact O-CG 3.34Å; G353-S382 WeakPolarHBondContact CA-OG 3.2Å
354	Y	72.8	Confident	63.6	Low	132 Å²	132	105.5 Å²	105.5	52%	0.518	57%	0.567	S	S	.	*			trans	-60	126.6	169.6	-169.6	-99.7	0	0	0	111.2	V350 P351	V350-Y354 HydrophobicContact CG1-CD1 3.68Å; V350-Y354 HydrophobicContact CG1-CD2 4.39Å; V350-Y354 HydrophobicContact CG1-CG 3.53Å; P351-Y354 WeakPolarHBondContact O-CB 3.43Å; P351-Y354 PolarHBondContact O-N 2.96Å; P351-Y354 VanDerWaalsContact O-N 3.14Å
355	L	65.7	Low	62.9	Low	17 Å²	17	110.3 Å²	110.3	9%	0.089	59%	0.586	C	S	.	*			trans	-114.7	120.2	172.8	-65.4	171.4	0	0	0	107.2	G353 E359 K375 R378 Q379	G353-L355 PolarHBondContact O-N 3.19Å; L355-E359 HydrophobicContact CD2-CG 4.25Å; L355-K375 VanDerWaalsContact O-CE 3.23Å; L355-K375 WeakPolarHBondContact O-CE 3.27Å; L355-K375 PolarHBondContact O-NZ 3.2Å; L355-R378 HydrophobicContact CD1-CB 4.43Å; L355-R378 HydrophobicContact CD1-CG 3.99Å; L355-R378 VanDerWaalsContact CD1-CZ 3.43Å; L355-Q379 HydrophobicContact CB-CG 4.26Å; L355-Q379 HydrophobicContact CD1-CG 4.15Å; L355-Q379 HydrophobicContact CG-CG 4.19Å; L355-Q379 PolarHBondContact O-NE2 3.39Å
356	S	71.4	Confident	62.1	Low	58 Å²	58	106.4 Å²	106.4	41%	0.406	58%	0.58	S	S	.	*			trans	-59.3	157.1	179.3	-62.3	0	0	0	0	110.9	D358 E359	S356-D358 PolarHBondContact O-N 3.1Å; S356-D358 VanDerWaalsContact O-N 3.15Å; S356-E359 WeakPolarHBondContact O-CB 3.03Å; S356-E359 PolarHBondContact O-N 2.89Å
357	D	68	Low	61.3	Low	127 Å²	127	111 Å²	111	68%	0.679	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.3	-29.6	178.4	-72.5	-11.8	0	0	0	113.5	E359 V361 K375	D357-E359 VanDerWaalsContact C-N 3.35Å; D357-V361 WeakPolarHBondContact O-CG2 3.31Å; D357-K375 IonicContact OD1-NZ 2.71Å; D357-K375 PolarHBondContact OD1-NZ 3.43Å
358	D	62.6	Low	60.5	Low	146 Å²	146	105.6 Å²	105.6	78%	0.781	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	-12.4	175.6	-163.7	44.4	0	0	0	113.2	S356 G360	S356-D358 PolarHBondContact O-N 3.1Å; S356-D358 VanDerWaalsContact O-N 3.15Å; D358-G360 PolarHBondContact O-N 3.2Å
359	E	63.9	Low	59.5	Low	102 Å²	102	103.3 Å²	103.3	48%	0.477	59%	0.588	S	S	.	*	S	Bend	trans	-96.8	77.6	-174.5	-165.4	178.4	-175.6	0	0	111.5	L355 S356 D357	L355-E359 HydrophobicContact CD2-CG 4.25Å; S356-E359 WeakPolarHBondContact O-CB 3.03Å; S356-E359 PolarHBondContact O-N 2.89Å; D357-E359 VanDerWaalsContact C-N 3.35Å
360	G	52.4	Low	58.7	Low	36 Å²	36	100.5 Å²	100.5	37%	0.371	58%	0.579	S	S	.	*	S	Bend	trans	141.3	-5.7	177.8	0	0	0	0	0	114.2	D358 A362 I370	D358-G360 PolarHBondContact O-N 3.2Å; G360-A362 PolarHBondContact O-N 3.47Å; G360-I370 WeakPolarHBondContact O-CD1 3.29Å
361	V	50	Low	58.2	Low	82 Å²	82	100 Å²	100	50%	0.497	58%	0.578	S	S	.	*			trans	-70.9	82.9	165.3	-150.9	0	0	0	0	106.8	D357 V363	D357-V361 WeakPolarHBondContact O-CG2 3.31Å; V361-V363 VanDerWaalsContact C-N 3.32Å; V361-V363 WeakPolarHBondContact O-CG2 3.38Å; V361-V363 PolarHBondContact O-N 3.4Å
362	A	49.4	Very low	58	Low	76 Å²	76	101.2 Å²	101.2	63%	0.628	58%	0.579	S	S	*	*			trans	-57.4	106.3	161.7	0	0	0	0	0	105.6	G360 E364	G360-A362 PolarHBondContact O-N 3.47Å; A362-E364 PolarHBondContact O-N 3.16Å
363	V	48.7	Very low	58.4	Low	139 Å²	139	104.2 Å²	104.2	84%	0.842	59%	0.593	S	S	*	*			trans	-67.1	14.2	177	-170.6	0	0	0	0	111.2	V361 E365	V361-V363 VanDerWaalsContact C-N 3.32Å; V361-V363 WeakPolarHBondContact O-CG2 3.38Å; V361-V363 PolarHBondContact O-N 3.4Å; V363-E365 PolarHBondContact O-N 2.89Å
364	E	47	Very low	58.6	Low	164 Å²	164	110.1 Å²	110.1	77%	0.766	62%	0.618	S	S	*	*	S	Bend	trans	-88.8	95.7	174.4	-81.2	-172	152.8	0	0	110.3	A362 G366	A362-E364 PolarHBondContact O-N 3.16Å; E364-G366 PolarHBondContact O-N 3.3Å
365	E	47.1	Very low	58.6	Low	200 Å²	200	106.2 Å²	106.2	94%	0.935	60%	0.604	S	S	*	*	S	Bend	trans	59.8	2.1	139.2	-55.4	-162.9	158.7	0	0	119.8	V363	V363-E365 PolarHBondContact O-N 2.89Å
366	G	45.8	Very low	59.3	Low	62 Å²	62	110.5 Å²	110.5	64%	0.639	62%	0.624	S	S	*	*			trans	-90.8	102.1	170.3	0	0	0	0	0	111.2	E364 G368	E364-G366 PolarHBondContact O-N 3.3Å; G366-G368 PolarHBondContact O-N 3.2Å
367	E	46.5	Very low	59.7	Low	213 Å²	213	112.4 Å²	112.4	100%	0.995	63%	0.629	S	S	*	*			trans	-68.4	36.4	179.9	-155.6	170.2	-163.8	0	0	114.2
368	G	49.5	Very low	60.2	Low	49 Å²	49	112.3 Å²	112.3	51%	0.505	62%	0.619	S	S	.	*	S	Bend	trans	-142.1	138.4	179.7	0	0	0	0	0	111.8	G366 I370	G366-G368 PolarHBondContact O-N 3.2Å; G368-I370 PolarHBondContact O-N 3.18Å
369	P	53	Low	61.2	Low	125 Å²	125	107.4 Å²	107.4	81%	0.812	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-54.9	127.2	170.9	22.9	-30.5	0	0	0	108.7	P371	P369-P371 WeakPolarHBondContact O-CD 3.45Å
370	I	54.5	Low	62.1	Low	81 Å²	81	108.6 Å²	108.6	42%	0.415	60%	0.597	S	S	.	*	P	Polyproline II helix	trans	-51.3	125	168.5	-63.2	164.6	0	0	0	105.9	G360 G368 D372	G360-I370 WeakPolarHBondContact O-CD1 3.29Å; G368-I370 PolarHBondContact O-N 3.18Å; I370-D372 PolarHBondContact O-N 3.49Å; I370-D372 VanDerWaalsContact O-N 3.11Å
371	P	65.7	Low	63.6	Low	87 Å²	87	112.2 Å²	112.2	57%	0.565	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-55.5	125.2	179.4	-24.6	33.3	0	0	0	108.7	P369 E373 M374	P369-P371 WeakPolarHBondContact O-CD 3.45Å; P371-E373 PolarHBondContact O-N 2.99Å; P371-M374 PolarHBondContact O-N 2.75Å
372	D	68.2	Low	65	Low	122 Å²	122	110.8 Å²	110.8	65%	0.652	60%	0.601	S	S	*	*	H	α-helix	trans	-50.2	-28.2	-178.5	-65.5	-39.6	0	0	0	111.8	I370 M374 K375 Q376	I370-D372 PolarHBondContact O-N 3.49Å; I370-D372 VanDerWaalsContact O-N 3.11Å; D372-M374 PolarHBondContact O-N 2.98Å; D372-K375 PolarHBondContact O-N 2.77Å; D372-Q376 VanDerWaalsContact O-CG 3.27Å; D372-Q376 WeakPolarHBondContact O-CG 3.1Å; D372-Q376 PolarHBondContact O-N 2.84Å
373	E	76.6	Confident	66.6	Low	155 Å²	155	109.6 Å²	109.6	72%	0.724	59%	0.585	S	S	*	*	H	α-helix	trans	-55.7	-44.3	173.8	-62.3	-179.1	-174.2	0	0	114.3	P371 Q376 L377	P371-E373 PolarHBondContact O-N 2.99Å; E373-Q376 PolarHBondContact O-N 3.25Å; E373-L377 WeakPolarHBondContact O-CB 3.16Å; E373-L377 PolarHBondContact O-N 2.89Å
374	M	71.5	Confident	68.3	Low	139 Å²	139	105.5 Å²	105.5	69%	0.685	57%	0.566	S	S	*	*	H	α-helix	trans	-71.8	-34.9	-177.4	-169.5	178.7	-173.8	0	0	111.3	P371 D372 R378	P371-M374 PolarHBondContact O-N 2.75Å; D372-M374 PolarHBondContact O-N 2.98Å; M374-R378 PolarHBondContact O-N 3.5Å; M374-R378 VanDerWaalsContact O-N 3.13Å
375	K	73.7	Confident	70	Confident	50 Å²	50	104.8 Å²	104.8	22%	0.217	56%	0.563	C	S	.	*	H	α-helix	trans	-65.3	-48.1	173.5	-173.8	-176.7	177.5	-170.8	0	110.1	L355 D357 D372 L377 R378 Q379	L355-K375 VanDerWaalsContact O-CE 3.23Å; L355-K375 WeakPolarHBondContact O-CE 3.27Å; L355-K375 PolarHBondContact O-NZ 3.2Å; D357-K375 IonicContact OD1-NZ 2.71Å; D357-K375 PolarHBondContact OD1-NZ 3.43Å; D372-K375 PolarHBondContact O-N 2.77Å; K375-L377 VanDerWaalsContact C-N 3.33Å; K375-L377 PolarHBondContact O-N 2.97Å; K375-R378 PolarHBondContact O-N 2.79Å; K375-Q379 WeakPolarHBondContact O-CG 3.49Å; K375-Q379 PolarHBondContact O-N 2.77Å
376	Q	79.8	Confident	71.5	Confident	108 Å²	108	99.6 Å²	99.6	51%	0.505	54%	0.536	S	S	.	.	H	α-helix	trans	-58.2	-42.8	176.8	-72.5	174.3	22.2	0	0	112.1	D372 E373 R378 Q379 Q380	D372-Q376 VanDerWaalsContact O-CG 3.27Å; D372-Q376 WeakPolarHBondContact O-CG 3.1Å; D372-Q376 PolarHBondContact O-N 2.84Å; E373-Q376 PolarHBondContact O-N 3.25Å; Q376-R378 PolarHBondContact O-N 3.48Å; Q376-Q379 PolarHBondContact O-N 3.4Å; Q376-Q380 WeakPolarHBondContact O-CG 3.16Å; Q376-Q380 PolarHBondContact O-N 3.11Å
377	L	80.8	Confident	73.2	Confident	98 Å²	98	100.8 Å²	100.8	51%	0.513	52%	0.524	S	S	.	.	H	α-helix	trans	-62.3	-41.6	176.9	-174.2	66.5	0	0	0	112.3	E373 K375 Q379 Q380 L381	E373-L377 WeakPolarHBondContact O-CB 3.16Å; E373-L377 PolarHBondContact O-N 2.89Å; K375-L377 VanDerWaalsContact C-N 3.33Å; K375-L377 PolarHBondContact O-N 2.97Å; L377-Q379 VanDerWaalsContact C-N 3.34Å; L377-Q380 PolarHBondContact O-N 3.42Å; L377-L381 HydrophobicContact CG-CD1 4.48Å; L377-L381 WeakPolarHBondContact O-CG 3.41Å; L377-L381 PolarHBondContact O-N 3.22Å
378	R	78.3	Confident	74.9	Confident	125 Å²	125	92.7 Å²	92.7	47%	0.472	49%	0.494	S	S	.	.	H	α-helix	trans	-67.3	-36.2	178	-172	173.4	146.4	-136.4	-10.2	111.9	L355 M374 K375 Q376 S382	L355-R378 HydrophobicContact CD1-CB 4.43Å; L355-R378 HydrophobicContact CD1-CG 3.99Å; L355-R378 VanDerWaalsContact CD1-CZ 3.43Å; M374-R378 PolarHBondContact O-N 3.5Å; M374-R378 VanDerWaalsContact O-N 3.13Å; K375-R378 PolarHBondContact O-N 2.79Å; Q376-R378 PolarHBondContact O-N 3.48Å; R378-S382 WeakPolarHBondContact O-CB 3.48Å; R378-S382 PolarHBondContact O-N 2.91Å; R378-S382 VanDerWaalsContact O-N 3.14Å
379	Q	82.4	Confident	76.2	Confident	43 Å²	43	93.2 Å²	93.2	20%	0.201	49%	0.494	C	S	.	.	H	α-helix	trans	-64.1	-48.6	172.2	-66.3	179	-8.7	0	0	110.6	G353 L355 K375 Q376 L377 L381 S382 V383	G353-Q379 WeakPolarHBondContact O-CA 3.34Å; G353-Q379 WeakPolarHBondContact O-CB 3.28Å; G353-Q379 VanDerWaalsContact O-CG 3.28Å; G353-Q379 WeakPolarHBondContact O-CG 3.34Å; L355-Q379 HydrophobicContact CB-CG 4.26Å; L355-Q379 HydrophobicContact CD1-CG 4.15Å; L355-Q379 HydrophobicContact CG-CG 4.19Å; L355-Q379 PolarHBondContact O-NE2 3.39Å; K375-Q379 WeakPolarHBondContact O-CG 3.49Å; K375-Q379 PolarHBondContact O-N 2.77Å; Q376-Q379 PolarHBondContact O-N 3.4Å; L377-Q379 VanDerWaalsContact C-N 3.34Å; Q379-L381 PolarHBondContact O-N 2.78Å; Q379-S382 WeakPolarHBondContact O-CB 3.42Å; Q379-S382 PolarHBondContact O-N 2.64Å; Q379-S382 VanDerWaalsContact O-N 3.11Å; Q379-V383 WeakPolarHBondContact O-CG2 3.28Å; Q379-V383 PolarHBondContact O-N 3.17Å
380	Q	83.8	Confident	77.2	Confident	126 Å²	126	93.8 Å²	93.8	59%	0.589	49%	0.485	S	S	*	.	H	α-helix	trans	-58.8	-41.8	177.7	-74.2	-179.2	-0.1	0	0	113.1	Q376 L377 S382 V383 A384	Q376-Q380 WeakPolarHBondContact O-CG 3.16Å; Q376-Q380 PolarHBondContact O-N 3.11Å; L377-Q380 PolarHBondContact O-N 3.42Å; Q380-S382 VanDerWaalsContact C-N 3.34Å; Q380-V383 PolarHBondContact O-N 3.37Å; Q380-A384 WeakPolarHBondContact O-CB 3.49Å; Q380-A384 PolarHBondContact O-N 2.78Å
381	L	82.6	Confident	78.4	Confident	113 Å²	113	99.4 Å²	99.4	59%	0.592	50%	0.501	S	S	*	.	H	α-helix	trans	-64.3	-39.6	176	-74.2	172.4	0	0	0	112.1	L377 Q379 A384 E385	L377-L381 HydrophobicContact CG-CD1 4.48Å; L377-L381 WeakPolarHBondContact O-CG 3.41Å; L377-L381 PolarHBondContact O-N 3.22Å; Q379-L381 PolarHBondContact O-N 2.78Å; L381-A384 PolarHBondContact O-N 3.33Å; L381-E385 WeakPolarHBondContact O-CB 3.42Å; L381-E385 PolarHBondContact O-N 2.84Å
382	S	80.5	Confident	78.8	Confident	52 Å²	52	104.1 Å²	104.1	36%	0.364	51%	0.508	S	S	.	.	H	α-helix	trans	-65.1	-41.2	176.7	-170.8	0	0	0	0	112	G353 R378 Q379 Q380 E385 Y386	G353-S382 WeakPolarHBondContact CA-OG 3.2Å; R378-S382 WeakPolarHBondContact O-CB 3.48Å; R378-S382 PolarHBondContact O-N 2.91Å; R378-S382 VanDerWaalsContact O-N 3.14Å; Q379-S382 WeakPolarHBondContact O-CB 3.42Å; Q379-S382 PolarHBondContact O-N 2.64Å; Q379-S382 VanDerWaalsContact O-N 3.11Å; Q380-S382 VanDerWaalsContact C-N 3.34Å; S382-E385 PolarHBondContact O-N 2.91Å; S382-Y386 PolarHBondContact O-N 2.98Å; S382-Y386 VanDerWaalsContact O-N 3.1Å
383	V	83.7	Confident	79	Confident	50 Å²	50	101.4 Å²	101.4	30%	0.303	51%	0.509	S	S	.	.	H	α-helix	trans	-59.1	-50.6	172.7	-178.7	0	0	0	0	110.3	H352 Q379 Q380 E385 Y386 E387	H352-V383 WeakPolarHBondContact O-CG2 3.11Å; Q379-V383 WeakPolarHBondContact O-CG2 3.28Å; Q379-V383 PolarHBondContact O-N 3.17Å; Q380-V383 PolarHBondContact O-N 3.37Å; V383-E385 VanDerWaalsContact C-N 3.33Å; V383-E385 PolarHBondContact O-N 3.28Å; V383-Y386 WeakPolarHBondContact O-CB 2.91Å; V383-Y386 PolarHBondContact O-N 3.37Å; V383-E387 PolarHBondContact O-N 3.11Å
384	A	84.3	Confident	78.7	Confident	54 Å²	54	102.4 Å²	102.4	45%	0.446	52%	0.518	S	S	.	.	H	α-helix	trans	-63.3	-37.7	-177.1	0	0	0	0	0	112.6	Q380 L381 A388	Q380-A384 WeakPolarHBondContact O-CB 3.49Å; Q380-A384 PolarHBondContact O-N 2.78Å; L381-A384 PolarHBondContact O-N 3.33Å; A384-A388 WeakPolarHBondContact O-CB 3.3Å; A384-A388 PolarHBondContact O-N 2.87Å
385	E	80.8	Confident	78.8	Confident	148 Å²	148	104.3 Å²	104.3	69%	0.692	53%	0.525	S	S	*	.	H	α-helix	trans	-64.5	-43.9	175	-174.1	175.5	-172.7	0	0	111.4	L381 S382 V383 A388 A389	L381-E385 WeakPolarHBondContact O-CB 3.42Å; L381-E385 PolarHBondContact O-N 2.84Å; S382-E385 PolarHBondContact O-N 2.91Å; V383-E385 VanDerWaalsContact C-N 3.33Å; V383-E385 PolarHBondContact O-N 3.28Å; E385-A388 PolarHBondContact O-N 3.31Å; E385-A389 PolarHBondContact O-N 3.38Å
386	Y	79.7	Confident	78.7	Confident	92 Å²	92	113.4 Å²	113.4	36%	0.361	56%	0.558	S	S	.	*	H	α-helix	trans	-59.3	-49.8	175.4	176.9	-86.5	0	0	0	111.6	H352 S382 V383 A388 A389 H390	H352-Y386 HydrophobicContact CB-CD1 3.85Å; H352-Y386 HydrophobicContact CB-CD2 4.16Å; H352-Y386 HydrophobicContact CB-CE1 4.48Å; H352-Y386 HydrophobicContact CB-CG 3.7Å; H352-Y386 AromaticContact CD2-CD1 3.29Å; H352-Y386 WeakPolarHBondContact CD2-CD1 3.38Å; H352-Y386 AromaticContact CD2-CE1 3.04Å; H352-Y386 WeakPolarHBondContact CD2-CE1 3.41Å; H352-Y386 AromaticContact CD2-CE2 3.84Å; H352-Y386 AromaticContact CD2-CG 3.84Å; H352-Y386 AromaticContact CD2-CZ 3.33Å; H352-Y386 AromaticContact CE1-CE1 3.96Å; H352-Y386 AromaticContact CE1-CE2 3.42Å; H352-Y386 VanDerWaalsContact CE1-CE2 3.42Å; H352-Y386 WeakPolarHBondContact CE1-CE2 3.19Å; H352-Y386 AromaticContact CE1-CZ 3.37Å; H352-Y386 AromaticContact CG-CD1 3.49Å; H352-Y386 VanDerWaalsContact CG-CD1 3.49Å; H352-Y386 AromaticContact CG-CD2 3.67Å; H352-Y386 AromaticContact CG-CE1 3.65Å; H352-Y386 AromaticContact CG-CE2 3.77Å; H352-Y386 AromaticContact CG-CG 3.53Å; H352-Y386 AromaticContact CG-CZ 3.77Å; H352-Y386 AromaticContact ND1-CD2 3.66Å; H352-Y386 AromaticContact ND1-CE2 3.5Å; H352-Y386 AromaticContact ND1-CZ 3.78Å; H352-Y386 AromaticContact NE2-CD1 3.97Å; H352-Y386 AromaticContact NE2-CE1 3.27Å; H352-Y386 VanDerWaalsContact NE2-CE1 3.27Å; H352-Y386 WeakPolarHBondContact NE2-CE1 3.38Å; H352-Y386 AromaticContact NE2-CE2 3.61Å; H352-Y386 AromaticContact NE2-CZ 3.04Å; H352-Y386 PolarHBondContact NE2-OH 3.01Å; H352-Y386 VanDerWaalsContact NE2-OH 3.12Å; S382-Y386 PolarHBondContact O-N 2.98Å; S382-Y386 VanDerWaalsContact O-N 3.1Å; V383-Y386 WeakPolarHBondContact O-CB 2.91Å; V383-Y386 PolarHBondContact O-N 3.37Å; Y386-A388 VanDerWaalsContact C-N 3.31Å; Y386-A388 PolarHBondContact O-N 3.3Å; Y386-A389 WeakPolarHBondContact O-CB 3.34Å; Y386-A389 PolarHBondContact O-N 2.95Å; Y386-A389 VanDerWaalsContact O-N 3.13Å; Y386-H390 HydrophobicContact CE1-CB 4.31Å; Y386-H390 AromaticContact CZ-ND1 3.98Å; Y386-H390 PolarHBondContact O-N 3.06Å; Y386-H390 PolarHBondContact OH-ND1 3.31Å
387	E	82.2	Confident	78.3	Confident	86 Å²	86	115 Å²	115	40%	0.402	57%	0.57	S	S	.	*	H	α-helix	trans	-60	-41.4	178.2	-74.3	-173.4	-153.4	0	0	112.2	V383 A389 H390 R391	V383-E387 PolarHBondContact O-N 3.11Å; E387-A389 VanDerWaalsContact C-N 3.29Å; E387-A389 PolarHBondContact O-N 3.14Å; E387-H390 PolarHBondContact O-N 2.97Å; E387-R391 WeakPolarHBondContact O-CB 3.25Å; E387-R391 VanDerWaalsContact O-CG 3.29Å; E387-R391 WeakPolarHBondContact O-CG 3.47Å; E387-R391 PolarHBondContact O-N 3.29Å; E387-R391 IonicContact OE2-CZ 2.68Å; E387-R391 IonicContact OE2-NH2 3.75Å; E387-R391 PolarHBondContact OE2-NH2 3.21Å
388	A	82.1	Confident	77.6	Confident	44 Å²	44	119.6 Å²	119.6	36%	0.364	59%	0.585	S	S	.	*	H	α-helix	trans	-66.3	-31.5	177.9	0	0	0	0	0	112.7	A384 E385 Y386 R392	A384-A388 WeakPolarHBondContact O-CB 3.3Å; A384-A388 PolarHBondContact O-N 2.87Å; E385-A388 PolarHBondContact O-N 3.31Å; Y386-A388 VanDerWaalsContact C-N 3.31Å; Y386-A388 PolarHBondContact O-N 3.3Å; A388-R392 PolarHBondContact O-NH1 3.24Å
389	A	76.5	Confident	76.8	Confident	60 Å²	60	119.9 Å²	119.9	50%	0.496	60%	0.603	S	S	.	*	H	α-helix	trans	-72	-41.4	172.4	0	0	0	0	0	111.3	E385 Y386 E387 R391 R392	E385-A389 PolarHBondContact O-N 3.38Å; Y386-A389 WeakPolarHBondContact O-CB 3.34Å; Y386-A389 PolarHBondContact O-N 2.95Å; Y386-A389 VanDerWaalsContact O-N 3.13Å; E387-A389 VanDerWaalsContact C-N 3.29Å; E387-A389 PolarHBondContact O-N 3.14Å; A389-R391 PolarHBondContact O-N 3.12Å; A389-R392 WeakPolarHBondContact O-CB 3.27Å; A389-R392 PolarHBondContact O-N 3.48Å
390	H	73.9	Confident	75.8	Confident	137 Å²	137	121.7 Å²	121.7	63%	0.634	62%	0.621	S	S	*	*	H	α-helix	trans	-70	-32.5	-179	-152.8	93.2	0	0	0	112.9	Y386 E387 R392	Y386-H390 HydrophobicContact CE1-CB 4.31Å; Y386-H390 AromaticContact CZ-ND1 3.98Å; Y386-H390 PolarHBondContact O-N 3.06Å; Y386-H390 PolarHBondContact OH-ND1 3.31Å; E387-H390 PolarHBondContact O-N 2.97Å; H390-R392 VanDerWaalsContact C-N 3.28Å; H390-R392 PolarHBondContact O-N 3.07Å
391	R	78.8	Confident	74	Confident	199 Å²	199	124 Å²	124	75%	0.751	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	-20.2	174	-69.9	177.7	-161	-170.3	9.4	113.4	E387 A389 G393	E387-R391 WeakPolarHBondContact O-CB 3.25Å; E387-R391 VanDerWaalsContact O-CG 3.29Å; E387-R391 WeakPolarHBondContact O-CG 3.47Å; E387-R391 PolarHBondContact O-N 3.29Å; E387-R391 IonicContact OE2-CZ 2.68Å; E387-R391 IonicContact OE2-NH2 3.75Å; E387-R391 PolarHBondContact OE2-NH2 3.21Å; A389-R391 PolarHBondContact O-N 3.12Å; R391-G393 VanDerWaalsContact C-N 3.33Å; R391-G393 PolarHBondContact O-N 3.41Å
392	R	74.9	Confident	73	Confident	186 Å²	186	124.3 Å²	124.3	70%	0.702	64%	0.638	S	S	*	*	S	Bend	trans	-72.8	93	170.8	-75.2	-179	172.4	91.4	-6.1	107.8	A388 A389 H390 L394	A388-R392 PolarHBondContact O-NH1 3.24Å; A389-R392 WeakPolarHBondContact O-CB 3.27Å; A389-R392 PolarHBondContact O-N 3.48Å; H390-R392 VanDerWaalsContact C-N 3.28Å; H390-R392 PolarHBondContact O-N 3.07Å; R392-L394 PolarHBondContact O-N 3.24Å
393	G	72.1	Confident	71.5	Confident	65 Å²	65	124 Å²	124	67%	0.67	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-48.1	132.4	175.8	0	0	0	0	0	111.6	R391 Q395	R391-G393 VanDerWaalsContact C-N 3.33Å; R391-G393 PolarHBondContact O-N 3.41Å; G393-Q395 PolarHBondContact O-N 3.5Å
394	L	70.9	Confident	70.6	Confident	176 Å²	176	126.9 Å²	126.9	92%	0.921	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-70.4	120.4	179.5	-64.5	171.4	0	0	0	109.7	R392	R392-L394 PolarHBondContact O-N 3.24Å
395	Q	72	Confident	68.9	Low	178 Å²	178	130.5 Å²	130.5	83%	0.832	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-83.4	130.1	173.3	-70.3	-111.9	0	0	0	109.9	G393 L397	G393-Q395 PolarHBondContact O-N 3.5Å; Q395-L397 PolarHBondContact O-N 3.03Å; Q395-L397 VanDerWaalsContact O-N 3.13Å
396	R	72.2	Confident	67.4	Low	242 Å²	242	134.2 Å²	134.2	91%	0.913	68%	0.681	S	S	*	*			trans	-75.2	104.2	179	-157.6	174.2	172.6	176.1	-1.3	109.2	K398	R396-K398 PolarHBondContact O-N 2.71Å
397	L	71.1	Confident	65.8	Low	142 Å²	142	135.5 Å²	135.5	74%	0.743	69%	0.694	S	S	*	*			trans	-62.8	125.5	177.2	-60.6	178.9	0	0	0	110.2	Q395 P399	Q395-L397 PolarHBondContact O-N 3.03Å; Q395-L397 VanDerWaalsContact O-N 3.13Å; L397-P399 WeakPolarHBondContact O-CD 3.24Å
398	K	67.5	Low	64.1	Low	194 Å²	194	137.4 Å²	137.4	84%	0.843	71%	0.713	S	S	*	*			trans	-87.5	115	170.9	-73.2	-178.8	-179.3	171.8	0	108.7	R396 S400	R396-K398 PolarHBondContact O-N 2.71Å; K398-S400 PolarHBondContact O-N 3.34Å
399	P	60.5	Low	62.3	Low	130 Å²	130	143 Å²	143	84%	0.844	73%	0.732	S	S	*	*			trans	-64.7	127	177	26.1	-32.7	0	0	0	109.9	L397	L397-P399 WeakPolarHBondContact O-CD 3.24Å
400	S	60.6	Low	60.4	Low	82 Å²	82	143.4 Å²	143.4	57%	0.573	74%	0.736	S	S	*	*			trans	-109.6	112.4	174.3	-65.4	0	0	0	0	109.3	K398 L402	K398-S400 PolarHBondContact O-N 3.34Å; S400-L402 PolarHBondContact O-N 2.84Å
401	L	47.7	Very low	58.6	Low	174 Å²	174	143 Å²	143	91%	0.911	74%	0.743	S	S	*	*			trans	-90.5	101	176.7	-164.7	96.2	0	0	0	109.2
402	L	61.6	Low	56.6	Low	120 Å²	120	141.8 Å²	141.8	63%	0.628	75%	0.746	S	S	*	*			trans	-86	115.1	165.5	-88.4	93	0	0	0	109.3	S400 L405 L462	S400-L402 PolarHBondContact O-N 2.84Å; L402-L405 HydrophobicContact CD2-CD1 4.33Å; L402-L462 HydrophobicContact CD2-CD2 4.17Å
403	G	48	Very low	54.5	Low	45 Å²	45	139.3 Å²	139.3	46%	0.464	76%	0.755	S	S	.	*			trans	-75	175	171.3	0	0	0	0	0	112.7	L405	G403-L405 PolarHBondContact O-N 3.42Å
404	P	64.7	Low	52.5	Low	111 Å²	111	141.7 Å²	141.7	72%	0.721	76%	0.76	S	S	*	*			trans	-61.8	118.5	173.5	25	-32.1	0	0	0	110.5
405	L	49.5	Very low	50.5	Low	130 Å²	130	141.8 Å²	141.8	68%	0.681	76%	0.758	S	S	*	*			trans	-85.1	117.2	174.8	-77.4	156.5	0	0	0	109.5	L402 G403	L402-L405 HydrophobicContact CD2-CD1 4.33Å; G403-L405 PolarHBondContact O-N 3.42Å
406	W	48.7	Very low	48.6	Very low	226 Å²	226	139 Å²	139	86%	0.856	76%	0.755	S	S	*	*			trans	-97.4	104.6	174.6	-60.5	84.7	0	0	0	108.5
407	L	46.1	Very low	46.6	Very low	119 Å²	119	132.5 Å²	132.5	62%	0.623	75%	0.747	S	S	*	*			trans	-76.2	126.3	175.3	-72.1	162.4	0	0	0	109.1	E409 F455	L407-E409 PolarHBondContact O-N 3.4Å; L407-F455 HydrophobicContact CD2-CZ 4.42Å
408	P	46.1	Very low	44.5	Very low	125 Å²	125	131.2 Å²	131.2	81%	0.812	75%	0.748	S	S	*	*	S	Bend	trans	-66.1	-28	-174.5	-24.8	35	0	0	0	115.5
409	E	43.9	Very low	42.6	Very low	162 Å²	162	128.7 Å²	128.7	76%	0.757	74%	0.744	S	S	*	*			trans	-140.8	97.6	-173.5	-89.8	147.6	-169.8	0	0	110.7	L407 V411	L407-E409 PolarHBondContact O-N 3.4Å; E409-V411 VanDerWaalsContact C-N 3.32Å
410	A	38	Very low	40.9	Very low	69 Å²	69	127.3 Å²	127.3	57%	0.57	74%	0.744	S	S	*	*	S	Bend	trans	-83.1	-5.4	178	0	0	0	0	0	113.7
411	V	35.1	Very low	39.6	Very low	129 Å²	129	129.2 Å²	129.2	78%	0.782	75%	0.752	S	S	*	*	S	Bend	trans	-107.8	-17.3	-155.9	-170.3	0	0	0	0	115.4	E409	E409-V411 VanDerWaalsContact C-N 3.32Å
412	E	36.8	Very low	38.5	Very low	173 Å²	173	128.8 Å²	128.8	81%	0.808	75%	0.751	S	S	*	*	S	Bend	trans	-103.7	-4.6	-166.5	-69.1	-169.6	171.9	0	0	117.8
413	C	31.5	Very low	37	Very low	133 Å²	133	128 Å²	128	90%	0.899	76%	0.762	S	S	*	*	S	Bend	trans	-98.4	4.4	-175.5	-81.2	0	0	0	0	116.6
414	C	30.8	Very low	35.8	Very low	116 Å²	116	131.7 Å²	131.7	78%	0.784	78%	0.775	S	S	*	*			trans	-104.3	68.3	-178.9	-76.5	0	0	0	0	112.7
415	M	28	Very low	34	Very low	178 Å²	178	131.8 Å²	131.8	88%	0.877	77%	0.774	S	S	*	*			trans	-125.1	96.9	155.8	-71	-64.2	-105.5	0	0	108.8	S417	M415-S417 PolarHBondContact O-N 3.43Å
416	P	32	Very low	33.1	Very low	118 Å²	118	132 Å²	132	77%	0.766	78%	0.776	S	S	*	*			trans	-77.3	100	176.6	28.8	-29.1	0	0	0	109.6	C418	P416-C418 PolarHBondContact O-N 3.47Å
417	S	30.9	Very low	32	Very low	106 Å²	106	129.7 Å²	129.7	74%	0.741	78%	0.781	S	S	*	*			trans	-78	97.8	163.1	-171.8	0	0	0	0	108.4	M415 N419	M415-S417 PolarHBondContact O-N 3.43Å; S417-N419 PolarHBondContact O-N 3.5Å; S417-N419 VanDerWaalsContact O-N 3.16Å
418	C	26.4	Very low	31.3	Very low	115 Å²	115	131.2 Å²	131.2	78%	0.777	78%	0.784	S	S	*	*			trans	-77.4	85.3	176.5	42.3	0	0	0	0	111	P416	P416-C418 PolarHBondContact O-N 3.47Å
419	N	28.5	Very low	30.5	Very low	141 Å²	141	133 Å²	133	75%	0.754	78%	0.781	S	S	*	*			trans	-106.3	89.7	161.6	-76.7	-8.8	0	0	0	109.1	S417 T421	S417-N419 PolarHBondContact O-N 3.5Å; S417-N419 VanDerWaalsContact O-N 3.16Å; N419-T421 PolarHBondContact O-N 2.81Å
420	A	25	Very low	29.7	Very low	102 Å²	102	134.1 Å²	134.1	84%	0.843	78%	0.784	S	S	*	*			trans	-77.6	97.9	170.7	0	0	0	0	0	109.3
421	T	31.8	Very low	29.3	Very low	122 Å²	122	138.6 Å²	138.6	75%	0.748	79%	0.793	S	S	*	*			trans	-132.7	103.6	165.1	56.9	0	0	0	0	109.7	N419	N419-T421 PolarHBondContact O-N 2.81Å
422	N	26	Very low	29	Very low	165 Å²	165	141.2 Å²	141.2	88%	0.882	80%	0.797	S	S	*	*			trans	25.1	107.8	146.7	-56.4	-14.5	0	0	0	118.2
423	A	28.7	Very low	28.6	Very low	103 Å²	103	139.8 Å²	139.8	85%	0.851	80%	0.795	S	S	*	*			trans	-144.6	101	149.9	0	0	0	0	0	109.6
424	T	23.4	Very low	28.6	Very low	122 Å²	122	143.2 Å²	143.2	75%	0.748	79%	0.794	S	S	*	*			trans	-63.2	159.2	164.5	-55	0	0	0	0	110.1
425	T	26.2	Very low	28.5	Very low	113 Å²	113	146.2 Å²	146.2	69%	0.693	80%	0.797	S	S	*	*			trans	74.6	102.5	160.8	19.3	0	0	0	0	117.5
426	N	31	Very low	28.5	Very low	136 Å²	136	145.1 Å²	145.1	73%	0.727	80%	0.795	S	S	*	*				176.9	115.6	99.6	-86.6	-22.7	0	0	0	111	H428	N426-H428 PolarHBondContact O-N 3.48Å; N426-H428 VanDerWaalsContact O-N 3.1Å
427	N	26.2	Very low	28.6	Very low	177 Å²	177	146.7 Å²	146.7	95%	0.947	80%	0.795	S	S	*	*			trans	-60.4	104.1	159.2	-85.5	-21.5	0	0	0	108
428	H	31.5	Very low	28.4	Very low	151 Å²	151	150 Å²	150	70%	0.699	80%	0.799	S	S	*	*			trans	-112.9	100.9	163.5	-121.5	-55.3	0	0	0	109	N426 F430	N426-H428 PolarHBondContact O-N 3.48Å; N426-H428 VanDerWaalsContact O-N 3.1Å; H428-F430 HydrophobicContact CB-CD2 4.38Å; H428-F430 HydrophobicContact CB-CE2 4.36Å; H428-F430 PolarHBondContact O-N 2.8Å
429	H	28.3	Very low	28.3	Very low	163 Å²	163	152.7 Å²	152.7	76%	0.755	81%	0.805	S	S	*	*			trans	-53.4	113	164.2	-167.6	-63.3	0	0	0	108.6
430	F	28.3	Very low	28.2	Very low	184 Å²	184	151.9 Å²	151.9	81%	0.807	81%	0.807	S	S	*	*			trans	-113.3	112.6	171.5	-99.1	-84.6	0	0	0	108.6	H428	H428-F430 HydrophobicContact CB-CD2 4.38Å; H428-F430 HydrophobicContact CB-CE2 4.36Å; H428-F430 PolarHBondContact O-N 2.8Å
431	E	29.8	Very low	28.3	Very low	163 Å²	163	154.9 Å²	154.9	76%	0.762	80%	0.803	S	S	*	*			trans	-62.5	128.6	177.4	-70.4	171.6	143.7	0	0	111.4	N433	E431-N433 PolarHBondContact O-N 3.2Å
432	E	28.4	Very low	28	Very low	185 Å²	185	160.2 Å²	160.2	86%	0.864	81%	0.81	S	S	*	*			trans	-70.6	96.2	165.9	-68.5	174.7	149.5	0	0	108.9
433	N	27.6	Very low	27.9	Very low	143 Å²	143	161.1 Å²	161.1	77%	0.765	81%	0.806	S	S	*	*			trans	-166.5	89.4	164.2	-85.1	-40.1	0	0	0	110.3	E431	E431-N433 PolarHBondContact O-N 3.2Å
434	K	32.8	Very low	27.8	Very low	205 Å²	205	164.1 Å²	164.1	89%	0.891	81%	0.806	S	S	*	*			trans	-163.9	83.4	155.7	-110.4	144.3	-175.3	170.9	0	111.3
435	E	28.3	Very low	27.9	Very low	179 Å²	179	164.3 Å²	164.3	84%	0.836	80%	0.802	S	S	*	*			trans	-67.5	150.2	152.1	-54.6	177.8	-176.7	0	0	108.2
436	N	28.1	Very low	27.8	Very low	155 Å²	155	163.3 Å²	163.3	83%	0.829	80%	0.8	S	S	*	*			trans	89	81.4	-172.9	-55.7	-27.9	0	0	0	115.7
437	I	33.2	Very low	27.7	Very low	151 Å²	151	166 Å²	166	77%	0.774	81%	0.805	S	S	*	*			trans	-111.3	103.9	150.7	-59.9	174.9	0	0	0	106.3
438	E	27.3	Very low	28	Very low	176 Å²	176	166 Å²	166	82%	0.822	80%	0.799	S	S	*	*			trans	-59.1	130.4	174.2	-65.9	176	160.1	0	0	109.9	P440	E438-P440 WeakPolarHBondContact O-CD 3.05Å
439	L	23.7	Very low	28.3	Very low	171 Å²	171	164.8 Å²	164.8	90%	0.895	80%	0.803	S	S	*	*			trans	-71.9	112.9	178.5	-78.5	158.9	0	0	0	110.2
440	P	27.3	Very low	28.8	Very low	124 Å²	124	163.4 Å²	163.4	81%	0.805	80%	0.801	S	S	*	*			trans	-79.4	128.7	174.9	-10.4	29.4	0	0	0	110.1	E438	E438-P440 WeakPolarHBondContact O-CD 3.05Å
441	E	25.8	Very low	29.6	Very low	164 Å²	164	156.9 Å²	156.9	77%	0.766	79%	0.786	S	S	*	*			trans	-57	133.5	176.3	-67.3	179.2	128.5	0	0	112.7
442	R	25.4	Very low	30.2	Very low	234 Å²	234	157.7 Å²	157.7	88%	0.883	79%	0.787	S	S	*	*			trans	34.4	93.7	143.7	-61.8	178.6	177.3	152.6	0.3	116.3
443	F	24.9	Very low	31.2	Very low	184 Å²	184	152 Å²	152	81%	0.807	77%	0.771	S	S	*	*			trans	-119.4	112.2	157.2	-104.8	-87.6	0	0	0	111.9	L445	F443-L445 HydrophobicContact CB-CD1 4.19Å; F443-L445 HydrophobicContact CD1-CD1 3.56Å; F443-L445 HydrophobicContact CD1-CG 4.26Å; F443-L445 HydrophobicContact CE1-CD1 4.39Å; F443-L445 HydrophobicContact CG-CD1 4.22Å; F443-L445 PolarHBondContact O-N 2.99Å
444	I	25.9	Very low	32.2	Very low	166 Å²	166	151.9 Å²	151.9	85%	0.851	77%	0.766	S	S	*	*			trans	-74.9	104.5	165.7	-61.2	168.6	0	0	0	106.6
445	L	26.5	Very low	32.9	Very low	126 Å²	126	147.7 Å²	147.7	66%	0.66	75%	0.748	S	S	*	*			trans	-143.2	109.2	172.8	-87.8	150.2	0	0	0	106.8	F443	F443-L445 HydrophobicContact CB-CD1 4.19Å; F443-L445 HydrophobicContact CD1-CD1 3.56Å; F443-L445 HydrophobicContact CD1-CG 4.26Å; F443-L445 HydrophobicContact CE1-CD1 4.39Å; F443-L445 HydrophobicContact CG-CD1 4.22Å; F443-L445 PolarHBondContact O-N 2.99Å
446	S	23.2	Very low	34.3	Very low	93 Å²	93	145.4 Å²	145.4	65%	0.65	74%	0.737	S	S	*	*				39.6	101.5	69.9	82.6	0	0	0	0	113.2
447	K	30.2	Very low	35.8	Very low	192 Å²	192	142.8 Å²	142.8	84%	0.835	72%	0.723	S	S	*	*	S	Bend	trans	51.4	110.5	155	-66.6	-176.7	177.2	-178.8	0	118.7
448	Q	32.5	Very low	36.7	Very low	176 Å²	176	141.2 Å²	141.2	82%	0.822	71%	0.714	S	S	*	*	S	Bend	trans	71.5	137.5	143.9	-64.6	-176	5.4	0	0	117.1
449	T	35.9	Very low	37.8	Very low	126 Å²	126	139.2 Å²	139.2	77%	0.773	70%	0.702	S	S	*	*	S	Bend	trans	65.6	72.9	168.1	73.1	0	0	0	0	116.8
450	N	39.9	Very low	39.4	Very low	135 Å²	135	134 Å²	134	72%	0.722	68%	0.68	S	S	*	*			trans	-157	7.2	147	-94.6	-19.8	0	0	0	114.7	K452 A453	N450-K452 PolarHBondContact O-N 3.39Å; N450-A453 PolarHBondContact O-N 3.45Å
451	G	44.6	Very low	40.5	Very low	47 Å²	47	132 Å²	132	49%	0.485	67%	0.665	S	S	.	*	H	α-helix	trans	-57.7	-25.6	-174.5	0	0	0	0	0	114.9	F455	G451-F455 WeakPolarHBondContact O-CB 3.5Å; G451-F455 PolarHBondContact O-N 3.37Å
452	K	43.6	Very low	41.5	Very low	180 Å²	180	126.6 Å²	126.6	78%	0.783	64%	0.642	S	S	*	*	H	α-helix	trans	-63.4	-41.4	176	-91.4	-179.7	176.9	175.8	0	112.6	N450 F455 Q456	N450-K452 PolarHBondContact O-N 3.39Å; K452-F455 PolarHBondContact O-N 3.3Å; K452-Q456 WeakPolarHBondContact O-CB 3.08Å; K452-Q456 PolarHBondContact O-N 2.96Å
453	A	49.3	Very low	42.8	Very low	66 Å²	66	120.1 Å²	120.1	55%	0.545	63%	0.632	S	S	.	*	H	α-helix	trans	-70.5	-43.5	-177.5	0	0	0	0	0	111.6	N450 F455 Q456 L457	N450-A453 PolarHBondContact O-N 3.45Å; A453-F455 VanDerWaalsContact C-N 3.34Å; A453-F455 PolarHBondContact O-N 2.85Å; A453-Q456 WeakPolarHBondContact O-CB 3.31Å; A453-Q456 PolarHBondContact O-N 2.9Å; A453-L457 WeakPolarHBondContact O-CB 3.23Å; A453-L457 PolarHBondContact O-N 2.65Å
454	E	47.4	Very low	43.9	Very low	140 Å²	140	116.9 Å²	116.9	65%	0.654	63%	0.627	S	S	*	*	H	α-helix	trans	-62	-41.1	173.6	-79.2	-175.4	146.9	0	0	111.9	Q456 L457 M458	E454-Q456 VanDerWaalsContact C-N 3.33Å; E454-Q456 PolarHBondContact O-N 3.06Å; E454-L457 PolarHBondContact O-N 3.46Å; E454-M458 PolarHBondContact O-N 3.49Å
455	F	49.1	Very low	44.6	Very low	116 Å²	116	115.5 Å²	115.5	51%	0.509	61%	0.612	S	S	.	*	H	α-helix	trans	-65.1	-37.3	175.7	-126.4	-87.9	0	0	0	112.2	L407 G451 K452 A453 K459	L407-F455 HydrophobicContact CD2-CZ 4.42Å; G451-F455 WeakPolarHBondContact O-CB 3.5Å; G451-F455 PolarHBondContact O-N 3.37Å; K452-F455 PolarHBondContact O-N 3.3Å; A453-F455 VanDerWaalsContact C-N 3.34Å; A453-F455 PolarHBondContact O-N 2.85Å; F455-K459 WeakPolarHBondContact O-CB 3.35Å; F455-K459 WeakPolarHBondContact O-CG 3.37Å; F455-K459 PolarHBondContact O-N 2.87Å
456	Q	56.6	Low	45.3	Very low	131 Å²	131	120 Å²	120	61%	0.612	62%	0.62	S	S	*	*	H	α-helix	trans	-65.5	-44.6	175.7	-137.3	93.6	4	0	0	110.7	K452 A453 E454 K459 S460	K452-Q456 WeakPolarHBondContact O-CB 3.08Å; K452-Q456 PolarHBondContact O-N 2.96Å; A453-Q456 WeakPolarHBondContact O-CB 3.31Å; A453-Q456 PolarHBondContact O-N 2.9Å; E454-Q456 VanDerWaalsContact C-N 3.33Å; E454-Q456 PolarHBondContact O-N 3.06Å; Q456-K459 WeakPolarHBondContact O-CB 3.35Å; Q456-K459 PolarHBondContact O-N 3.34Å; Q456-S460 PolarHBondContact O-N 3.26Å; Q456-S460 PolarHBondContact O-OG 3.17Å
457	L	60.3	Low	46.1	Very low	101 Å²	101	118.8 Å²	118.8	53%	0.529	61%	0.609	S	S	.	*	H	α-helix	trans	-63.3	-43.9	177.3	-176.7	67.7	0	0	0	111.4	A453 E454 K459 S460 V461	A453-L457 WeakPolarHBondContact O-CB 3.23Å; A453-L457 PolarHBondContact O-N 2.65Å; E454-L457 PolarHBondContact O-N 3.46Å; L457-K459 VanDerWaalsContact C-N 3.33Å; L457-K459 PolarHBondContact O-N 3.15Å; L457-S460 WeakPolarHBondContact CA-OG 3.39Å; L457-S460 PolarHBondContact O-N 2.78Å; L457-S460 PolarHBondContact O-OG 3.47Å; L457-V461 HydrophobicContact CD1-CG2 4.45Å; L457-V461 HydrophobicContact CG-CG2 4.49Å; L457-V461 WeakPolarHBondContact O-CB 3.3Å; L457-V461 VanDerWaalsContact O-CG2 3.26Å; L457-V461 WeakPolarHBondContact O-CG2 3.43Å; L457-V461 PolarHBondContact O-N 3.3Å
458	M	51.9	Low	46.5	Very low	117 Å²	117	116.4 Å²	116.4	58%	0.576	60%	0.6	S	S	*	*	H	α-helix	trans	-63.1	-40.4	174.1	-89.5	-178.6	-173.6	0	0	111.5	E454 S460 V461 L462	E454-M458 PolarHBondContact O-N 3.49Å; M458-S460 PolarHBondContact O-N 2.87Å; M458-V461 PolarHBondContact O-N 2.98Å; M458-L462 WeakPolarHBondContact O-CB 3.37Å; M458-L462 WeakPolarHBondContact O-CD1 3.21Å; M458-L462 WeakPolarHBondContact O-CG 3.15Å; M458-L462 PolarHBondContact O-N 3.26Å
459	K	50.8	Low	46.8	Very low	135 Å²	135	114 Å²	114	59%	0.587	59%	0.593	S	S	*	*	H	α-helix	trans	-62.1	-41.2	174.6	-80	179.5	175.4	-178.4	0	112.3	F455 Q456 L457 S463	F455-K459 WeakPolarHBondContact O-CB 3.35Å; F455-K459 WeakPolarHBondContact O-CG 3.37Å; F455-K459 PolarHBondContact O-N 2.87Å; Q456-K459 WeakPolarHBondContact O-CB 3.35Å; Q456-K459 PolarHBondContact O-N 3.34Å; L457-K459 VanDerWaalsContact C-N 3.33Å; L457-K459 PolarHBondContact O-N 3.15Å; K459-S463 WeakPolarHBondContact O-CB 3.31Å; K459-S463 PolarHBondContact O-N 3.34Å
460	S	56.6	Low	46.9	Very low	62 Å²	62	118 Å²	118	43%	0.434	59%	0.594	S	S	.	*	H	α-helix	trans	-71.2	-35.6	177.5	57.6	0	0	0	0	113	Q456 L457 M458 S463	Q456-S460 PolarHBondContact O-N 3.26Å; Q456-S460 PolarHBondContact O-OG 3.17Å; L457-S460 WeakPolarHBondContact CA-OG 3.39Å; L457-S460 PolarHBondContact O-N 2.78Å; L457-S460 PolarHBondContact O-OG 3.47Å; M458-S460 PolarHBondContact O-N 2.87Å; S460-S463 PolarHBondContact O-OG 2.95Å
461	V	51.2	Low	47.2	Very low	80 Å²	80	117.8 Å²	117.8	49%	0.485	60%	0.597	S	S	.	*	H	α-helix	trans	-70.2	-40.7	174.7	173	0	0	0	0	110.3	L457 M458 Y465	L457-V461 HydrophobicContact CD1-CG2 4.45Å; L457-V461 HydrophobicContact CG-CG2 4.49Å; L457-V461 WeakPolarHBondContact O-CB 3.3Å; L457-V461 VanDerWaalsContact O-CG2 3.26Å; L457-V461 WeakPolarHBondContact O-CG2 3.43Å; L457-V461 PolarHBondContact O-N 3.3Å; M458-V461 PolarHBondContact O-N 2.98Å; V461-Y465 WeakPolarHBondContact O-CD2 3.45Å
462	L	45.4	Very low	46.9	Very low	52 Å²	52	120.2 Å²	120.2	27%	0.272	60%	0.603	S	S	.	*	H	α-helix	trans	-76.5	-19.3	179.4	-67.1	169.9	0	0	0	112.9	L402 M458 V464 Y465 V467	L402-L462 HydrophobicContact CD2-CD2 4.17Å; M458-L462 WeakPolarHBondContact O-CB 3.37Å; M458-L462 WeakPolarHBondContact O-CD1 3.21Å; M458-L462 WeakPolarHBondContact O-CG 3.15Å; M458-L462 PolarHBondContact O-N 3.26Å; L462-V464 PolarHBondContact O-N 3.33Å; L462-Y465 CarbonylContact O-C 3.47Å; L462-Y465 PolarHBondContact O-N 3.36Å; L462-V467 HydrophobicContact CB-CG2 3.89Å; L462-V467 HydrophobicContact CD2-CG2 3.7Å; L462-V467 HydrophobicContact CG-CG2 4.24Å
463	S	52.9	Low	47.1	Very low	97 Å²	97	117 Å²	117	68%	0.678	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-20.9	176.2	60	0	0	0	0	113.2	K459 S460 Y465	K459-S463 WeakPolarHBondContact O-CB 3.31Å; K459-S463 PolarHBondContact O-N 3.34Å; S460-S463 PolarHBondContact O-OG 2.95Å; S463-Y465 VanDerWaalsContact C-N 3.28Å
464	V	47.6	Very low	46.6	Very low	116 Å²	116	122.3 Å²	122.3	70%	0.703	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-27.2	171.3	-174.4	0	0	0	0	111.1	L462	L462-V464 PolarHBondContact O-N 3.33Å
465	Y	40.7	Very low	46.1	Very low	137 Å²	137	120.5 Å²	120.5	54%	0.537	61%	0.606	S	S	.	*	S	Bend	trans	-105.3	140.2	-177.4	-61.8	-80.2	0	0	0	111.2	V461 L462 S463 V467	V461-Y465 WeakPolarHBondContact O-CD2 3.45Å; L462-Y465 CarbonylContact O-C 3.47Å; L462-Y465 PolarHBondContact O-N 3.36Å; S463-Y465 VanDerWaalsContact C-N 3.28Å; Y465-V467 VanDerWaalsContact C-N 3.27Å; Y465-V467 PolarHBondContact O-N 3.43Å
466	R	41.5	Very low	45.6	Very low	220 Å²	220	121.4 Å²	121.4	83%	0.83	61%	0.614	S	S	*	*			trans	-75.5	81.8	172.7	-161	179.9	-171	176.8	5.4	109.9	H468	R466-H468 PolarHBondContact O-N 2.92Å; R466-H468 PolarHBondContact O-ND1 2.88Å
467	V	40.2	Very low	44.4	Very low	69 Å²	69	120 Å²	120	42%	0.418	62%	0.62	S	S	.	*			trans	-76.5	116.7	178.8	-172.9	0	0	0	0	109.9	L462 Y465 L469	L462-V467 HydrophobicContact CB-CG2 3.89Å; L462-V467 HydrophobicContact CD2-CG2 3.7Å; L462-V467 HydrophobicContact CG-CG2 4.24Å; Y465-V467 VanDerWaalsContact C-N 3.27Å; Y465-V467 PolarHBondContact O-N 3.43Å; V467-L469 HydrophobicContact CB-CD1 4.4Å; V467-L469 HydrophobicContact CG1-CD1 3.75Å; V467-L469 PolarHBondContact O-N 3.4Å
468	H	38.4	Very low	43.2	Very low	141 Å²	141	121.1 Å²	121.1	65%	0.653	63%	0.63	S	S	*	*			trans	-88.5	95.5	171.8	-66.6	78.1	0	0	0	108.6	R466	R466-H468 PolarHBondContact O-N 2.92Å; R466-H468 PolarHBondContact O-ND1 2.88Å
469	L	39.5	Very low	42.3	Very low	127 Å²	127	122.7 Å²	122.7	67%	0.665	64%	0.636	S	S	*	*			trans	-74.3	130.9	165.7	-81.7	94.2	0	0	0	108.8	V467 T471	V467-L469 HydrophobicContact CB-CD1 4.4Å; V467-L469 HydrophobicContact CG1-CD1 3.75Å; V467-L469 PolarHBondContact O-N 3.4Å; L469-T471 PolarHBondContact O-N 3.31Å; L469-T471 VanDerWaalsContact O-N 3.08Å
470	W	36.7	Very low	41.4	Very low	209 Å²	209	121.3 Å²	121.3	79%	0.792	64%	0.641	S	S	*	*			trans	-67.2	107.5	169.1	-68.5	54.4	0	0	0	107.1	T472	W470-T472 PolarHBondContact O-N 3.06Å
471	T	46.5	Very low	40.3	Very low	130 Å²	130	124.6 Å²	124.6	80%	0.798	65%	0.653	S	S	*	*			trans	-77.8	-9.5	-175.6	54.6	0	0	0	0	113.1	L469	L469-T471 PolarHBondContact O-N 3.31Å; L469-T471 VanDerWaalsContact O-N 3.08Å
472	T	39.8	Very low	39.4	Very low	98 Å²	98	128.2 Å²	128.2	60%	0.601	67%	0.668	S	S	*	*			trans	-100	97.7	177.3	58.3	0	0	0	0	109.4	W470 F474	W470-T472 PolarHBondContact O-N 3.06Å; T472-F474 PolarHBondContact O-N 3.3Å
473	N	46.7	Very low	38.9	Very low	112 Å²	112	130.3 Å²	130.3	60%	0.599	68%	0.683	S	S	*	*	S	Bend	trans	-50	128.9	152.2	-63.7	-32.7	0	0	0	106.6
474	F	38	Very low	37.7	Very low	179 Å²	179	130.7 Å²	130.7	79%	0.785	69%	0.692	S	S	*	*	S	Bend	trans	99.6	120.8	-176.6	-58.4	-75.6	0	0	0	116.1	T472 I476	T472-F474 PolarHBondContact O-N 3.3Å; F474-I476 PolarHBondContact O-N 2.83Å
475	P	38.4	Very low	37	Very low	101 Å²	101	132 Å²	132	66%	0.656	69%	0.694	S	S	*	*			trans	-72.5	111.5	173.5	30.3	-29.7	0	0	0	108.2	S477	P475-S477 VanDerWaalsContact C-N 3.28Å; P475-S477 PolarHBondContact O-N 3.44Å
476	I	37.4	Very low	36.5	Very low	135 Å²	135	131.5 Å²	131.5	69%	0.692	71%	0.705	S	S	*	*			trans	17.4	69.4	156.3	-51.4	165.2	0	0	0	112.3	F474 V478	F474-I476 PolarHBondContact O-N 2.83Å; I476-V478 HydrophobicContact CG2-CG2 3.81Å; I476-V478 PolarHBondContact O-N 3.36Å
477	S	32.5	Very low	36	Very low	103 Å²	103	127.2 Å²	127.2	72%	0.72	70%	0.704	S	S	*	*			trans	-82.1	99.5	160.6	-170.3	0	0	0	0	103.6	P475 E479	P475-S477 VanDerWaalsContact C-N 3.28Å; P475-S477 PolarHBondContact O-N 3.44Å; S477-E479 PolarHBondContact O-N 2.87Å
478	V	34.4	Very low	35.9	Very low	123 Å²	123	129.6 Å²	129.6	75%	0.745	72%	0.72	S	S	*	*			trans	-71.3	82.4	165.8	-175.4	0	0	0	0	104.9	I476	I476-V478 HydrophobicContact CG2-CG2 3.81Å; I476-V478 PolarHBondContact O-N 3.36Å
479	E	32.3	Very low	35.7	Very low	151 Å²	151	129.3 Å²	129.3	71%	0.706	73%	0.734	S	S	*	*			trans	-67.2	126	168.6	-156.7	178.6	-157.9	0	0	106.7	S477 D481	S477-E479 PolarHBondContact O-N 2.87Å; E479-D481 VanDerWaalsContact C-N 3.27Å; E479-D481 PolarHBondContact O-N 3.19Å
480	P	32.3	Very low	35.4	Very low	105 Å²	105	131.5 Å²	131.5	68%	0.682	73%	0.734	S	S	*	*			trans	-72.7	88	179.7	29.9	-32.4	0	0	0	108	I482	P480-I482 PolarHBondContact O-N 3.46Å
481	D	34.7	Very low	35.2	Very low	131 Å²	131	132.5 Å²	132.5	70%	0.701	74%	0.737	S	S	*	*			trans	-74.3	91.6	-177	-147.9	0.4	0	0	0	109.7	E479 V483	E479-D481 VanDerWaalsContact C-N 3.27Å; E479-D481 PolarHBondContact O-N 3.19Å; D481-V483 PolarHBondContact O-N 2.95Å
482	I	31.9	Very low	35	Very low	157 Å²	157	132 Å²	132	81%	0.805	74%	0.736	S	S	*	*			trans	-85.6	65.7	165	-51.5	174.5	0	0	0	107.1	P480	P480-I482 PolarHBondContact O-N 3.46Å
483	V	35.1	Very low	35.4	Very low	95 Å²	95	134.6 Å²	134.6	58%	0.576	74%	0.739	S	S	*	*			trans	-142.9	113.1	158.8	-169.1	0	0	0	0	108.6	D481 I485	D481-V483 PolarHBondContact O-N 2.95Å; V483-I485 HydrophobicContact CG1-CD1 4.33Å; V483-I485 HydrophobicContact CG1-CG1 4.15Å; V483-I485 PolarHBondContact O-N 2.95Å
484	A	27.3	Very low	36.3	Very low	105 Å²	105	138.1 Å²	138.1	87%	0.868	75%	0.749	S	S	*	*			trans	-66.7	93.5	176.3	0	0	0	0	0	110.3
485	I	32.4	Very low	38.2	Very low	144 Å²	144	134 Å²	134	74%	0.738	74%	0.742	S	S	*	*			trans	-124.7	119.9	162.9	-55.3	179.8	0	0	0	108.9	V483 T487	V483-I485 HydrophobicContact CG1-CD1 4.33Å; V483-I485 HydrophobicContact CG1-CG1 4.15Å; V483-I485 PolarHBondContact O-N 2.95Å; I485-T487 PolarHBondContact O-N 3.31Å
486	T	29.8	Very low	40.4	Very low	126 Å²	126	129.5 Å²	129.5	77%	0.773	71%	0.712	S	S	*	*			trans	-82.3	97	-167.6	48.7	0	0	0	0	111.8
487	T	32.4	Very low	42.7	Very low	131 Å²	131	125.6 Å²	125.6	80%	0.804	70%	0.696	S	S	*	*			trans	-154.8	95.8	152.3	49.7	0	0	0	0	111.3	I485	I485-T487 PolarHBondContact O-N 3.31Å
488	P	36.9	Very low	45.3	Very low	118 Å²	118	126.1 Å²	126.1	77%	0.766	69%	0.687	S	S	*	*			trans	-98.4	97	-179.1	34.6	-26.7	0	0	0	111.2	R490	P488-R490 PolarHBondContact O-N 3.29Å
489	S	34.3	Very low	47.7	Very low	135 Å²	135	127.1 Å²	127.1	94%	0.944	68%	0.684	S	S	*	*			trans	-86	49.1	160.3	-175.9	0	0	0	0	110.4
490	R	33.6	Very low	50.5	Low	174 Å²	174	120 Å²	120	66%	0.657	65%	0.65	S	S	*	*	S	Bend	trans	-101.9	123.7	167.9	-164.9	178.3	-170.4	-167.9	6.7	105.7	P488 K493	P488-R490 PolarHBondContact O-N 3.29Å; R490-K493 VanDerWaalsContact NH1-CE 3.25Å
491	R	31.6	Very low	53.3	Low	230 Å²	230	115 Å²	115	87%	0.868	62%	0.618	S	S	*	*			trans	-40	119.2	172.8	-70.2	-175.9	-179	178.1	0.4	107.8	K493	R491-K493 PolarHBondContact O-N 3.41Å
492	P	43.9	Very low	55.9	Low	118 Å²	118	109 Å²	109	77%	0.766	59%	0.586	S	S	*	*			trans	-57.2	120.1	-167.3	20.2	-31.4	0	0	0	107.4	K494	P492-K494 PolarHBondContact O-N 3.3Å
493	K	48.1	Very low	58.8	Low	154 Å²	154	104.2 Å²	104.2	67%	0.67	56%	0.558	S	S	*	*			trans	-55.2	117.5	167.1	-74.6	179.6	173.7	177.8	0	104.7	R490 R491 S495	R490-K493 VanDerWaalsContact NH1-CE 3.25Å; R491-K493 PolarHBondContact O-N 3.41Å; K493-S495 VanDerWaalsContact C-N 3.26Å; K493-S495 PolarHBondContact O-N 3.23Å
494	K	64.4	Low	61.7	Low	186 Å²	186	99.7 Å²	99.7	81%	0.809	53%	0.531	S	S	*	.			trans	-60.1	94.7	177.1	-66.6	168.1	179.2	-179.5	0	106.6	P492 L577	P492-K494 PolarHBondContact O-N 3.3Å; K494-L577 WeakPolarHBondContact O-CD1 3.42Å; K494-L577 VanDerWaalsContact O-CD2 3.26Å; K494-L577 WeakPolarHBondContact O-CD2 3.43Å
495	S	79.1	Confident	64.8	Low	91 Å²	91	94.7 Å²	94.7	64%	0.636	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-87.3	160.3	172.4	54.2	0	0	0	0	108.6	K493	K493-S495 VanDerWaalsContact C-N 3.26Å; K493-S495 PolarHBondContact O-N 3.23Å
496	I	84.4	Confident	67.6	Low	7 Å²	7	89.1 Å²	89.1	4%	0.036	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-61.2	134	169.8	-59.1	-171.6	0	0	0	107.8	E498 A500 M501 F504 F522 L573 L577 V578 K581	I496-E498 PolarHBondContact O-N 3.07Å; I496-A500 HydrophobicContact CG2-CB 3.7Å; I496-M501 HydrophobicContact CB-CE 4.13Å; I496-M501 HydrophobicContact CD1-CE 4.27Å; I496-M501 HydrophobicContact CG2-CE 3.8Å; I496-F504 HydrophobicContact CD1-CE1 4.46Å; I496-F522 HydrophobicContact CD1-CE1 4.27Å; I496-F522 HydrophobicContact CG2-CE1 4.1Å; I496-F522 HydrophobicContact CG2-CZ 4.43Å; I496-L573 HydrophobicContact CG2-CD1 4.37Å; I496-L577 HydrophobicContact CG1-CD1 4.4Å; I496-L577 HydrophobicContact CG1-CD2 4.13Å; I496-L577 HydrophobicContact CG1-CG 3.85Å; I496-V578 HydrophobicContact CD1-CG2 4.17Å; I496-K581 HydrophobicContact CD1-CB 3.48Å; I496-K581 VanDerWaalsContact CD1-CB 3.48Å; I496-K581 HydrophobicContact CD1-CG 3.67Å; I496-K581 HydrophobicContact CG1-CB 4.17Å; I496-K581 HydrophobicContact CG1-CG 4.24Å
497	P	86.1	Confident	70.6	Confident	53 Å²	53	83.3 Å²	83.3	34%	0.344	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-51.4	137.6	175.9	-27.4	35.1	0	0	0	111.2	E499 A500 W526	P497-E499 PolarHBondContact O-N 3.16Å; P497-A500 HydrophobicContact CB-CB 4.45Å; P497-A500 VanDerWaalsContact O-CB 3.22Å; P497-A500 WeakPolarHBondContact O-CB 3.08Å; P497-A500 PolarHBondContact O-N 3.43Å; P497-W526 HydrophobicContact CB-CZ2 3.93Å; P497-W526 HydrophobicContact CG-CZ2 4.09Å
498	E	85.3	Confident	73.5	Confident	115 Å²	115	77 Å²	77	54%	0.537	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-32.1	-174.9	-89.5	-160.1	-162.4	0	0	114.1	I496 A500 M501 R606	I496-E498 PolarHBondContact O-N 3.07Å; E498-A500 VanDerWaalsContact C-N 3.27Å; E498-A500 PolarHBondContact O-N 3.48Å; E498-M501 WeakPolarHBondContact O-CB 3.17Å; E498-M501 PolarHBondContact O-N 3.43Å; E498-R606 PolarHBondContact O-NH1 3.49Å; E498-R606 VanDerWaalsContact O-NH1 3.15Å; E498-R606 IonicContact OE2-CZ 3.58Å; E498-R606 IonicContact OE2-NH1 3.12Å; E498-R606 PolarHBondContact OE2-NH1 3.42Å; E498-R606 VanDerWaalsContact OE2-NH1 3.12Å; E498-R606 IonicContact OE2-NH2 3.01Å; E498-R606 PolarHBondContact OE2-NH2 2.95Å
499	E	86	Confident	76	Confident	144 Å²	144	72 Å²	72	67%	0.673	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-30.2	176.1	-65.5	170	-168.9	0	0	111.9	P497 M501 W526	P497-E499 PolarHBondContact O-N 3.16Å; E499-M501 PolarHBondContact O-N 3.06Å; E499-W526 HydrophobicContact CB-CH2 4.22Å
500	A	90.3	Very high	78.5	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-72	-16.4	179	0	0	0	0	0	112.9	I496 P497 E498 A502 Y503 F504 F522 W526	I496-A500 HydrophobicContact CG2-CB 3.7Å; P497-A500 HydrophobicContact CB-CB 4.45Å; P497-A500 VanDerWaalsContact O-CB 3.22Å; P497-A500 WeakPolarHBondContact O-CB 3.08Å; P497-A500 PolarHBondContact O-N 3.43Å; E498-A500 VanDerWaalsContact C-N 3.27Å; E498-A500 PolarHBondContact O-N 3.48Å; A500-A502 PolarHBondContact O-N 3.12Å; A500-Y503 PolarHBondContact O-N 3.38Å; A500-F504 PolarHBondContact O-N 3.18Å; A500-F522 HydrophobicContact CB-CZ 3.79Å; A500-F522 WeakPolarHBondContact O-CZ 3.2Å; A500-W526 VanDerWaalsContact CA-CH2 3.44Å; A500-W526 HydrophobicContact CB-CD2 3.7Å; A500-W526 HydrophobicContact CB-CE3 3.46Å; A500-W526 VanDerWaalsContact CB-CE3 3.46Å; A500-W526 HydrophobicContact CB-CH2 3.32Å; A500-W526 HydrophobicContact CB-CZ2 3.54Å; A500-W526 HydrophobicContact CB-CZ3 3.29Å
501	M	91.9	Very high	81.2	Confident	2 Å²	2	61.2 Å²	61.2	1%	0.01	29%	0.292	C	S	.	.	H	α-helix	trans	-68.6	-35.1	-172.1	-68.1	-79.8	72.8	0	0	113.6	I496 E498 E499 Y503 F504 I505 K581 Y603	I496-M501 HydrophobicContact CB-CE 4.13Å; I496-M501 HydrophobicContact CD1-CE 4.27Å; I496-M501 HydrophobicContact CG2-CE 3.8Å; E498-M501 WeakPolarHBondContact O-CB 3.17Å; E498-M501 PolarHBondContact O-N 3.43Å; E499-M501 PolarHBondContact O-N 3.06Å; M501-Y503 PolarHBondContact O-N 3.35Å; M501-F504 HydrophobicContact CE-CB 3.74Å; M501-F504 HydrophobicContact CE-CD1 3.48Å; M501-F504 VanDerWaalsContact CE-CD1 3.48Å; M501-F504 HydrophobicContact CE-CE1 4.44Å; M501-F504 HydrophobicContact CE-CG 4Å; M501-F504 PolarHBondContact O-N 3.02Å; M501-I505 WeakPolarHBondContact O-CB 3.41Å; M501-I505 WeakPolarHBondContact O-CD1 3.25Å; M501-I505 VanDerWaalsContact O-CG1 3.22Å; M501-I505 WeakPolarHBondContact O-CG1 3.43Å; M501-I505 PolarHBondContact O-N 3.41Å; M501-K581 HydrophobicContact CE-CG 4.07Å; M501-K581 VanDerWaalsContact SD-CE 3.51Å; M501-K581 HydrophobicContact SD-CG 4.31Å; M501-Y603 HydrophobicContact CB-CD1 3.97Å; M501-Y603 HydrophobicContact CB-CD2 4.35Å; M501-Y603 HydrophobicContact CB-CE1 3.74Å; M501-Y603 HydrophobicContact CB-CE2 4.13Å; M501-Y603 HydrophobicContact CB-CG 4.27Å; M501-Y603 HydrophobicContact CG-CE1 3.98Å; M501-Y603 HydrophobicContact CG-CE2 4.25Å
502	A	89.9	Confident	84	Confident	4 Å²	4	54.1 Å²	54.1	3%	0.033	28%	0.276	C	S	.	.	H	α-helix	trans	-62.6	-45.3	177	0	0	0	0	0	111.3	A500 I505 H506 R606 V607 L610	A500-A502 PolarHBondContact O-N 3.12Å; A502-I505 PolarHBondContact O-N 3.35Å; A502-H506 PolarHBondContact O-N 3Å; A502-H506 VanDerWaalsContact O-N 3.08Å; A502-R606 HydrophobicContact CB-CB 4.07Å; A502-V607 HydrophobicContact CB-CG2 4.21Å; A502-L610 HydrophobicContact CB-CB 4.44Å; A502-L610 HydrophobicContact CB-CD2 4.19Å
503	Y	92.6	Very high	86.2	Confident	56 Å²	56	49.4 Å²	49.4	22%	0.22	24%	0.244	C	C	.	.	H	α-helix	trans	-63.7	-41.8	175.2	-64.2	-75.6	0	0	0	112.4	A500 M501 I505 H506 L507 F525 W526 H529 L610 W640	A500-Y503 PolarHBondContact O-N 3.38Å; M501-Y503 PolarHBondContact O-N 3.35Å; Y503-I505 VanDerWaalsContact C-N 3.34Å; Y503-I505 PolarHBondContact O-N 2.88Å; Y503-H506 PolarHBondContact O-N 2.78Å; Y503-L507 PolarHBondContact O-N 3.44Å; Y503-F525 AromaticContact CD1-CE1 3.63Å; Y503-F525 HydrophobicContact CD1-CE1 3.63Å; Y503-F525 HydrophobicContact CD1-CE2 4.24Å; Y503-F525 AromaticContact CD1-CZ 3.22Å; Y503-F525 HydrophobicContact CD1-CZ 3.22Å; Y503-F525 HydrophobicContact CD2-CE1 4.15Å; Y503-F525 HydrophobicContact CD2-CZ 4.37Å; Y503-F525 HydrophobicContact CE1-CE1 4.33Å; Y503-F525 AromaticContact CE1-CZ 3.62Å; Y503-F525 HydrophobicContact CE1-CZ 3.62Å; Y503-F525 AromaticContact CG-CE1 3.5Å; Y503-F525 HydrophobicContact CG-CE1 3.5Å; Y503-F525 AromaticContact CG-CZ 3.63Å; Y503-F525 HydrophobicContact CG-CZ 3.63Å; Y503-W526 HydrophobicContact CD2-CZ3 4.12Å; Y503-H529 AromaticContact CE2-CE1 3.86Å; Y503-H529 AromaticContact CE2-NE2 3.56Å; Y503-H529 AromaticContact CZ-CD2 3.84Å; Y503-H529 AromaticContact CZ-NE2 3.27Å; Y503-H529 VanDerWaalsContact CZ-NE2 3.27Å; Y503-H529 PolarHBondContact OH-NE2 3.41Å; Y503-L610 HydrophobicContact CD1-CD1 3.81Å; Y503-L610 HydrophobicContact CD1-CD2 3.63Å; Y503-L610 HydrophobicContact CD1-CG 4.31Å; Y503-L610 HydrophobicContact CE1-CD1 3.15Å; Y503-L610 HydrophobicContact CE1-CD2 3.89Å; Y503-L610 HydrophobicContact CE1-CG 4.05Å; Y503-L610 HydrophobicContact CE2-CD1 3.93Å; Y503-L610 HydrophobicContact CG-CD1 4.45Å; Y503-L610 HydrophobicContact CG-CD2 4.13Å; Y503-L610 WeakPolarHBondContact OH-CD1 3.48Å; Y503-W640 HydrophobicContact CD1-CH2 4.49Å; Y503-W640 WeakPolarHBondContact O-CH2 3.36Å; Y503-W640 WeakPolarHBondContact O-CZ3 3.45Å
504	F	94.9	Very high	88.3	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-65.1	-40.4	179.4	-164.3	-138	0	0	0	112.2	I496 A500 M501 L507 V508 F522 V578 K581 L582 I585	I496-F504 HydrophobicContact CD1-CE1 4.46Å; A500-F504 PolarHBondContact O-N 3.18Å; M501-F504 HydrophobicContact CE-CB 3.74Å; M501-F504 HydrophobicContact CE-CD1 3.48Å; M501-F504 VanDerWaalsContact CE-CD1 3.48Å; M501-F504 HydrophobicContact CE-CE1 4.44Å; M501-F504 HydrophobicContact CE-CG 4Å; M501-F504 PolarHBondContact O-N 3.02Å; F504-L507 PolarHBondContact O-N 3.09Å; F504-V508 HydrophobicContact CD2-CG2 3.93Å; F504-V508 HydrophobicContact CE1-CG2 4.47Å; F504-V508 HydrophobicContact CE2-CG2 3.76Å; F504-V508 HydrophobicContact CG-CG2 4.38Å; F504-V508 HydrophobicContact CZ-CG2 4.06Å; F504-V508 WeakPolarHBondContact O-CB 3.23Å; F504-V508 WeakPolarHBondContact O-CG2 3.44Å; F504-V508 PolarHBondContact O-N 2.95Å; F504-F522 HydrophobicContact CB-CD2 4.08Å; F504-F522 HydrophobicContact CB-CE1 4.22Å; F504-F522 HydrophobicContact CB-CE2 3.49Å; F504-F522 VanDerWaalsContact CB-CE2 3.49Å; F504-F522 HydrophobicContact CB-CZ 3.56Å; F504-F522 HydrophobicContact CD2-CB 4Å; F504-F522 AromaticContact CD2-CD1 3.63Å; F504-F522 HydrophobicContact CD2-CD1 3.63Å; F504-F522 AromaticContact CD2-CD2 3.46Å; F504-F522 HydrophobicContact CD2-CD2 3.46Å; F504-F522 VanDerWaalsContact CD2-CD2 3.46Å; F504-F522 AromaticContact CD2-CE1 3.9Å; F504-F522 HydrophobicContact CD2-CE1 3.9Å; F504-F522 AromaticContact CD2-CE2 3.76Å; F504-F522 HydrophobicContact CD2-CE2 3.76Å; F504-F522 AromaticContact CD2-CG 3.39Å; F504-F522 HydrophobicContact CD2-CG 3.39Å; F504-F522 AromaticContact CD2-CZ 3.95Å; F504-F522 HydrophobicContact CD2-CZ 3.95Å; F504-F522 HydrophobicContact CE2-CB 4.02Å; F504-F522 AromaticContact CE2-CD1 3.91Å; F504-F522 HydrophobicContact CE2-CD1 3.91Å; F504-F522 HydrophobicContact CE2-CD2 4.32Å; F504-F522 HydrophobicContact CE2-CE1 4.47Å; F504-F522 AromaticContact CE2-CG 3.81Å; F504-F522 HydrophobicContact CE2-CG 3.81Å; F504-F522 HydrophobicContact CG-CD1 4.3Å; F504-F522 HydrophobicContact CG-CD2 4.18Å; F504-F522 HydrophobicContact CG-CE1 4.11Å; F504-F522 AromaticContact CG-CE2 3.99Å; F504-F522 HydrophobicContact CG-CE2 3.99Å; F504-F522 HydrophobicContact CG-CG 4.32Å; F504-F522 AromaticContact CG-CZ 3.94Å; F504-F522 HydrophobicContact CG-CZ 3.94Å; F504-V578 HydrophobicContact CE2-CG1 3.73Å; F504-V578 HydrophobicContact CZ-CG1 3.74Å; F504-K581 HydrophobicContact CD1-CG 4.44Å; F504-K581 HydrophobicContact CE1-CB 4.16Å; F504-K581 HydrophobicContact CE1-CG 4.08Å; F504-L582 HydrophobicContact CE1-CB 4.33Å; F504-L582 HydrophobicContact CZ-CB 3.82Å; F504-L582 HydrophobicContact CZ-CD1 4.27Å; F504-L582 HydrophobicContact CZ-CG 4.28Å; F504-I585 HydrophobicContact CD1-CD1 3.37Å; F504-I585 HydrophobicContact CE1-CD1 3.55Å; F504-I585 HydrophobicContact CE1-CG1 4.35Å; F504-I585 HydrophobicContact CG-CD1 4.41Å
505	I	92.3	Very high	89.6	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-61.5	-46.4	175.2	-71.5	167.2	0	0	0	110.4	M501 A502 Y503 L507 V508 H509 V595 I599 L600 Y603 V607 F637	M501-I505 WeakPolarHBondContact O-CB 3.41Å; M501-I505 WeakPolarHBondContact O-CD1 3.25Å; M501-I505 VanDerWaalsContact O-CG1 3.22Å; M501-I505 WeakPolarHBondContact O-CG1 3.43Å; M501-I505 PolarHBondContact O-N 3.41Å; A502-I505 PolarHBondContact O-N 3.35Å; Y503-I505 VanDerWaalsContact C-N 3.34Å; Y503-I505 PolarHBondContact O-N 2.88Å; I505-L507 PolarHBondContact O-N 2.84Å; I505-V508 PolarHBondContact O-N 3.3Å; I505-H509 VanDerWaalsContact O-CB 3.28Å; I505-H509 WeakPolarHBondContact O-CB 3.44Å; I505-H509 PolarHBondContact O-N 2.97Å; I505-V595 HydrophobicContact CG1-CG1 4.37Å; I505-V595 HydrophobicContact CG2-CG2 4.41Å; I505-I599 HydrophobicContact CD1-CG2 4.16Å; I505-L600 HydrophobicContact CG2-CD2 3.55Å; I505-Y603 HydrophobicContact CD1-CD2 3.84Å; I505-Y603 HydrophobicContact CD1-CG 4.1Å; I505-V607 HydrophobicContact CB-CG2 4.46Å; I505-V607 HydrophobicContact CD1-CG2 4.11Å; I505-V607 HydrophobicContact CG2-CG2 4.25Å; I505-F637 HydrophobicContact CG2-CE2 4.4Å; I505-F637 HydrophobicContact CG2-CZ 4.21Å
506	H	91.6	Very high	90.2	Very high	27 Å²	27	39.8 Å²	39.8	13%	0.125	20%	0.203	C	C	.	.	H	α-helix	trans	-59.9	-44.2	178	177.7	-171.9	0	0	0	111.7	A502 Y503 L610 P638 W640	A502-H506 PolarHBondContact O-N 3Å; A502-H506 VanDerWaalsContact O-N 3.08Å; Y503-H506 PolarHBondContact O-N 2.78Å; H506-L610 HydrophobicContact CB-CD2 4.41Å; H506-P638 PolarHBondContact NE2-O 2.98Å; H506-W640 HydrophobicContact CB-CE3 4.07Å; H506-W640 HydrophobicContact CB-CZ3 3.88Å; H506-W640 AromaticContact CD2-CE3 3.83Å; H506-W640 AromaticContact CE1-CE3 3.92Å; H506-W640 AromaticContact CG-CE3 3.6Å; H506-W640 AromaticContact CG-CZ3 3.78Å; H506-W640 AromaticContact ND1-CE3 3.68Å; H506-W640 AromaticContact ND1-CZ3 3.74Å
507	L	93.5	Very high	90.7	Very high	3 Å²	3	42 Å²	42	2%	0.016	21%	0.213	C	C	.	.	H	α-helix	trans	-66.9	-38.6	176.5	173.7	58.8	0	0	0	113.4	Y503 F504 I505 S511 L518 E521 F522 W640 Y642	Y503-L507 PolarHBondContact O-N 3.44Å; F504-L507 PolarHBondContact O-N 3.09Å; I505-L507 PolarHBondContact O-N 2.84Å; L507-S511 VanDerWaalsContact O-CB 3.3Å; L507-S511 WeakPolarHBondContact O-CB 3.3Å; L507-L518 HydrophobicContact CD1-CD2 3.96Å; L507-L518 HydrophobicContact CG-CD2 3.9Å; L507-E521 HydrophobicContact CD1-CG 3.85Å; L507-E521 HydrophobicContact CD2-CB 4.15Å; L507-E521 HydrophobicContact CD2-CG 3.89Å; L507-F522 HydrophobicContact CD2-CB 3.7Å; L507-F522 HydrophobicContact CD2-CD2 4.13Å; L507-F522 HydrophobicContact CD2-CG 4.39Å; L507-W640 HydrophobicContact CB-CD2 3.79Å; L507-W640 HydrophobicContact CB-CE3 3.74Å; L507-W640 HydrophobicContact CB-CH2 3.9Å; L507-W640 HydrophobicContact CB-CZ2 3.95Å; L507-W640 HydrophobicContact CB-CZ3 3.81Å; L507-W640 HydrophobicContact CD1-CD2 3.86Å; L507-W640 HydrophobicContact CD1-CG 3.79Å; L507-W640 HydrophobicContact CD1-CZ2 4.48Å; L507-W640 HydrophobicContact CD2-CZ2 4.18Å; L507-W640 HydrophobicContact CG-CD2 4.34Å; L507-W640 HydrophobicContact CG-CZ2 4.42Å; L507-Y642 HydrophobicContact CD1-CE1 4Å
508	V	92.9	Very high	91.1	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-82.4	-42.5	-173.2	172.3	0	0	0	0	111.8	F504 I505 R510 S511 L582 A586 W593 V595	F504-V508 HydrophobicContact CD2-CG2 3.93Å; F504-V508 HydrophobicContact CE1-CG2 4.47Å; F504-V508 HydrophobicContact CE2-CG2 3.76Å; F504-V508 HydrophobicContact CG-CG2 4.38Å; F504-V508 HydrophobicContact CZ-CG2 4.06Å; F504-V508 WeakPolarHBondContact O-CB 3.23Å; F504-V508 WeakPolarHBondContact O-CG2 3.44Å; F504-V508 PolarHBondContact O-N 2.95Å; I505-V508 PolarHBondContact O-N 3.3Å; V508-R510 PolarHBondContact O-N 3.18Å; V508-S511 VanDerWaalsContact O-CB 3.28Å; V508-S511 WeakPolarHBondContact O-CB 3.41Å; V508-S511 PolarHBondContact O-N 3.18Å; V508-S511 VanDerWaalsContact O-N 3.09Å; V508-L582 HydrophobicContact CG2-CD1 4.36Å; V508-A586 HydrophobicContact CG1-CB 3.62Å; V508-W593 HydrophobicContact CG1-CB 3.79Å; V508-W593 HydrophobicContact CG1-CG 4.26Å; V508-W593 WeakPolarHBondContact O-CB 3.43Å; V508-V595 HydrophobicContact CB-CG2 4.43Å; V508-V595 HydrophobicContact CG1-CG2 4.1Å
509	H	89.9	Confident	91.5	Very high	11 Å²	11	34 Å²	34	5%	0.051	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	127.6	-172.6	-170.8	-98.9	0	0	0	112.2	I505 S511 V595 L635 F637	I505-H509 VanDerWaalsContact O-CB 3.28Å; I505-H509 WeakPolarHBondContact O-CB 3.44Å; I505-H509 PolarHBondContact O-N 2.97Å; H509-S511 PolarHBondContact O-N 3.44Å; H509-S511 VanDerWaalsContact O-N 3.1Å; H509-V595 HydrophobicContact CB-CG2 4Å; H509-L635 PolarHBondContact CE1-O 2.93Å; H509-L635 PolarHBondContact ND1-O 3.34Å; H509-F637 HydrophobicContact CB-CD2 3.7Å; H509-F637 HydrophobicContact CB-CE2 3.61Å; H509-F637 AromaticContact CG-CD2 3.82Å; H509-F637 AromaticContact CG-CE2 3.55Å; H509-F637 AromaticContact ND1-CD2 3.49Å; H509-F637 WeakPolarHBondContact ND1-CD2 3.5Å; H509-F637 AromaticContact ND1-CE2 3.46Å; H509-F637 WeakPolarHBondContact ND1-CE2 3.32Å
510	R	85.6	Confident	91.9	Very high	78 Å²	78	27.3 Å²	27.3	29%	0.294	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	59	11.1	-175.8	-72.3	178	159.2	168	-16.6	115.7	V508 R592 W593 N633 N634 L635 I636	V508-R510 PolarHBondContact O-N 3.18Å; R510-R592 PolarHBondContact O-NH1 3.32Å; R510-W593 WeakPolarHBondContact CA-O 3.44Å; R510-W593 PolarHBondContact N-O 3.46Å; R510-N633 PolarHBondContact NE-O 3.16Å; R510-N633 PolarHBondContact NH2-O 2.95Å; R510-N634 PolarHBondContact NH1-O 3.34Å; R510-N634 PolarHBondContact NH2-OD1 3.43Å; R510-N634 VanDerWaalsContact NH2-OD1 3.15Å; R510-L635 VanDerWaalsContact NH1-C 3.35Å; R510-L635 PolarHBondContact NH1-O 3.47Å; R510-I636 VanDerWaalsContact NH1-CG1 3.35Å
511	S	90.1	Very high	92	Very high	6 Å²	6	27.3 Å²	27.3	4%	0.042	14%	0.139	C	C	.	.			trans	-71	134.4	177.7	-171.3	0	0	0	0	111.4	L507 V508 H509 L513 L518 R592 W593	L507-S511 VanDerWaalsContact O-CB 3.3Å; L507-S511 WeakPolarHBondContact O-CB 3.3Å; V508-S511 VanDerWaalsContact O-CB 3.28Å; V508-S511 WeakPolarHBondContact O-CB 3.41Å; V508-S511 PolarHBondContact O-N 3.18Å; V508-S511 VanDerWaalsContact O-N 3.09Å; H509-S511 PolarHBondContact O-N 3.44Å; H509-S511 VanDerWaalsContact O-N 3.1Å; S511-L513 VanDerWaalsContact C-N 3.29Å; S511-L513 PolarHBondContact OG-N 3.26Å; S511-L518 WeakPolarHBondContact OG-CD2 3.33Å; S511-R592 WeakPolarHBondContact O-CA 3.42Å; S511-W593 PolarHBondContact O-N 3.02Å
512	P	90.7	Very high	92.2	Very high	81 Å²	81	27.2 Å²	27.2	53%	0.526	14%	0.139	S	C	.	.			trans	-86.7	1.9	173.6	35.6	-35.3	0	0	0	112.8
513	L	90.9	Very high	92.3	Very high	18 Å²	18	27.5 Å²	27.5	9%	0.094	14%	0.139	C	C	.	.	S	Bend	trans	-76.2	149.4	-173	-64.3	175.2	0	0	0	112.4	S511 K517 L518 W593 Y642 V646	S511-L513 VanDerWaalsContact C-N 3.29Å; S511-L513 PolarHBondContact OG-N 3.26Å; L513-K517 HydrophobicContact CB-CB 4.25Å; L513-K517 HydrophobicContact CD2-CD 4.29Å; L513-L518 HydrophobicContact CB-CD1 4.48Å; L513-L518 HydrophobicContact CB-CD2 3.94Å; L513-L518 HydrophobicContact CB-CG 3.82Å; L513-L518 HydrophobicContact CD1-CD2 4.06Å; L513-W593 PolarHBondContact O-NE1 3.2Å; L513-Y642 HydrophobicContact CD1-CD1 4.39Å; L513-Y642 HydrophobicContact CD1-CE1 3.33Å; L513-Y642 WeakPolarHBondContact CD1-OH 3.34Å; L513-V646 HydrophobicContact CD1-CG1 3.53Å; L513-V646 HydrophobicContact CD2-CG1 3.81Å; L513-V646 HydrophobicContact CG-CG1 4.21Å
514	G	91.4	Very high	92.2	Very high	40 Å²	40	24.9 Å²	24.9	41%	0.412	13%	0.129	S	C	.	.			trans	-66.5	152.3	173	0	0	0	0	0	112.2	H516 K517 L518	G514-H516 PolarHBondContact O-N 3.22Å; G514-H516 VanDerWaalsContact O-N 3.09Å; G514-K517 WeakPolarHBondContact O-CA 3.46Å; G514-K517 VanDerWaalsContact O-CB 3.28Å; G514-K517 WeakPolarHBondContact O-CB 3.47Å; G514-K517 PolarHBondContact O-N 2.97Å; G514-L518 PolarHBondContact O-N 2.71Å
515	K	92.4	Very high	92.1	Very high	112 Å²	112	26.3 Å²	26.3	49%	0.487	14%	0.135	S	C	.	.	H	α-helix	trans	-50.3	-38.6	-178.7	63.7	-174.3	-178.4	-178.7	0	115.1	A519 L579 L582 W593	K515-A519 WeakPolarHBondContact O-CB 3.32Å; K515-A519 PolarHBondContact O-N 3.16Å; K515-L579 HydrophobicContact CB-CD2 3.92Å; K515-L579 HydrophobicContact CD-CD2 4.43Å; K515-L579 HydrophobicContact CG-CD2 4.02Å; K515-L579 WeakPolarHBondContact O-CD2 3.42Å; K515-L582 HydrophobicContact CB-CD1 4.46Å; K515-L582 HydrophobicContact CB-CD2 4.19Å; K515-W593 HydrophobicContact CB-CH2 4.38Å; K515-W593 HydrophobicContact CB-CZ2 3.9Å
516	H	92.4	Very high	92.1	Very high	77 Å²	77	26.9 Å²	26.9	36%	0.356	14%	0.137	S	C	.	.	H	α-helix	trans	-73	-35.4	179.7	-63.8	104.4	0	0	0	112.8	G514 A519 F520 Y540	G514-H516 PolarHBondContact O-N 3.22Å; G514-H516 VanDerWaalsContact O-N 3.09Å; H516-A519 PolarHBondContact O-N 3.27Å; H516-F520 WeakPolarHBondContact O-CB 3.46Å; H516-F520 PolarHBondContact O-N 2.87Å; H516-Y540 HydrophobicContact CB-CE2 4.49Å; H516-Y540 WeakPolarHBondContact CB-OH 3.42Å
517	K	94.1	Very high	91.9	Very high	55 Å²	55	26.9 Å²	26.9	24%	0.239	14%	0.137	C	C	.	.	H	α-helix	trans	-65.1	-47.4	175.1	-88.5	-175.7	162.2	-147.1	0	110.4	L513 G514 F520 E521 Y540 V646	L513-K517 HydrophobicContact CB-CB 4.25Å; L513-K517 HydrophobicContact CD2-CD 4.29Å; G514-K517 WeakPolarHBondContact O-CA 3.46Å; G514-K517 VanDerWaalsContact O-CB 3.28Å; G514-K517 WeakPolarHBondContact O-CB 3.47Å; G514-K517 PolarHBondContact O-N 2.97Å; K517-F520 PolarHBondContact O-N 2.97Å; K517-E521 WeakPolarHBondContact O-CB 3.49Å; K517-E521 PolarHBondContact O-N 3.13Å; K517-Y540 HydrophobicContact CB-CE2 4.46Å; K517-Y540 HydrophobicContact CD-CE1 4.38Å; K517-Y540 HydrophobicContact CG-CD1 4.04Å; K517-Y540 HydrophobicContact CG-CD2 4.23Å; K517-Y540 HydrophobicContact CG-CE1 3.65Å; K517-Y540 HydrophobicContact CG-CE2 3.86Å; K517-Y540 HydrophobicContact CG-CG 4.31Å; K517-V646 HydrophobicContact CB-CG1 3.45Å; K517-V646 VanDerWaalsContact CB-CG1 3.45Å; K517-V646 HydrophobicContact CB-CG2 4.35Å; K517-V646 HydrophobicContact CD-CG1 3.88Å; K517-V646 HydrophobicContact CG-CG1 3.72Å; K517-V646 HydrophobicContact CG-CG2 4.23Å; K517-V646 PolarHBondContact NZ-O 2.99Å
518	L	94.9	Very high	91.6	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-59.9	-45.4	173.2	-72.1	171.2	0	0	0	112.4	L507 S511 L513 G514 F520 E521 F522 L582 W593	L507-L518 HydrophobicContact CD1-CD2 3.96Å; L507-L518 HydrophobicContact CG-CD2 3.9Å; S511-L518 WeakPolarHBondContact OG-CD2 3.33Å; L513-L518 HydrophobicContact CB-CD1 4.48Å; L513-L518 HydrophobicContact CB-CD2 3.94Å; L513-L518 HydrophobicContact CB-CG 3.82Å; L513-L518 HydrophobicContact CD1-CD2 4.06Å; G514-L518 PolarHBondContact O-N 2.71Å; L518-F520 VanDerWaalsContact C-N 3.34Å; L518-F520 PolarHBondContact O-N 3.44Å; L518-E521 PolarHBondContact O-N 3.34Å; L518-F522 WeakPolarHBondContact O-CB 3.23Å; L518-F522 PolarHBondContact O-N 3.29Å; L518-L582 HydrophobicContact CB-CD1 3.71Å; L518-L582 HydrophobicContact CD1-CD1 3.86Å; L518-L582 HydrophobicContact CG-CD1 4.44Å; L518-W593 HydrophobicContact CD1-CD2 4.31Å; L518-W593 HydrophobicContact CD1-CG 3.99Å
519	A	93.4	Very high	91.3	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-63.5	-40.7	178.8	0	0	0	0	0	112.1	K515 H516 R523 V578 L579	K515-A519 WeakPolarHBondContact O-CB 3.32Å; K515-A519 PolarHBondContact O-N 3.16Å; H516-A519 PolarHBondContact O-N 3.27Å; A519-R523 WeakPolarHBondContact O-CG 3.43Å; A519-R523 PolarHBondContact O-N 2.9Å; A519-R523 VanDerWaalsContact O-N 3.1Å; A519-V578 HydrophobicContact CB-CB 4.23Å; A519-V578 HydrophobicContact CB-CG1 3.82Å; A519-L579 HydrophobicContact CB-CD2 3.79Å; A519-L579 HydrophobicContact CB-CG 3.99Å
520	F	93.4	Very high	91.2	Very high	2 Å²	2	39.6 Å²	39.6	1%	0.009	20%	0.196	C	C	.	.	H	α-helix	trans	-63.9	-52.8	176.5	178.7	-113.5	0	0	0	111.6	H516 K517 L518 F522 R523 V524 Y540 Y543 T644 V646	H516-F520 WeakPolarHBondContact O-CB 3.46Å; H516-F520 PolarHBondContact O-N 2.87Å; K517-F520 PolarHBondContact O-N 2.97Å; L518-F520 VanDerWaalsContact C-N 3.34Å; L518-F520 PolarHBondContact O-N 3.44Å; F520-F522 VanDerWaalsContact C-N 3.29Å; F520-F522 PolarHBondContact O-N 3.34Å; F520-R523 PolarHBondContact O-N 3.25Å; F520-R523 VanDerWaalsContact O-N 3.13Å; F520-V524 HydrophobicContact CD2-CG2 4.26Å; F520-V524 HydrophobicContact CE1-CG2 4.31Å; F520-V524 HydrophobicContact CE2-CG2 3.86Å; F520-V524 HydrophobicContact CZ-CG2 3.9Å; F520-V524 WeakPolarHBondContact O-CG2 3.42Å; F520-V524 PolarHBondContact O-N 2.59Å; F520-Y540 HydrophobicContact CB-CD2 3.85Å; F520-Y540 HydrophobicContact CB-CE2 4.1Å; F520-Y540 AromaticContact CD1-CD2 3.65Å; F520-Y540 HydrophobicContact CD1-CD2 3.65Å; F520-Y540 HydrophobicContact CD1-CG 4.33Å; F520-Y540 HydrophobicContact CE1-CD2 4.38Å; F520-Y540 AromaticContact CG-CD2 3.85Å; F520-Y540 HydrophobicContact CG-CD2 3.85Å; F520-Y543 HydrophobicContact CB-CD1 4.27Å; F520-Y543 HydrophobicContact CB-CE1 4.32Å; F520-Y543 AromaticContact CD2-CD1 3.51Å; F520-Y543 HydrophobicContact CD2-CD1 3.51Å; F520-Y543 AromaticContact CD2-CD2 3.43Å; F520-Y543 HydrophobicContact CD2-CD2 3.43Å; F520-Y543 VanDerWaalsContact CD2-CD2 3.43Å; F520-Y543 AromaticContact CD2-CE1 3.86Å; F520-Y543 HydrophobicContact CD2-CE1 3.86Å; F520-Y543 AromaticContact CD2-CE2 3.77Å; F520-Y543 HydrophobicContact CD2-CE2 3.77Å; F520-Y543 AromaticContact CD2-CG 3.28Å; F520-Y543 HydrophobicContact CD2-CG 3.28Å; F520-Y543 AromaticContact CD2-CZ 3.97Å; F520-Y543 VanDerWaalsContact CE2-CB 3.49Å; F520-Y543 HydrophobicContact CE2-CD1 4.03Å; F520-Y543 AromaticContact CE2-CD2 3.28Å; F520-Y543 HydrophobicContact CE2-CD2 3.28Å; F520-Y543 AromaticContact CE2-CE2 4Å; F520-Y543 HydrophobicContact CE2-CE2 4Å; F520-Y543 AromaticContact CE2-CG 3.29Å; F520-Y543 HydrophobicContact CE2-CG 3.29Å; F520-Y543 AromaticContact CG-CD1 3.97Å; F520-Y543 HydrophobicContact CG-CD1 3.97Å; F520-Y543 HydrophobicContact CG-CE1 4.39Å; F520-Y543 HydrophobicContact CG-CG 4.08Å; F520-Y543 HydrophobicContact CZ-CD2 4.34Å; F520-Y543 HydrophobicContact CZ-CG 4.07Å; F520-T644 HydrophobicContact CD1-CG2 3.95Å; F520-T644 HydrophobicContact CE1-CG2 3.48Å; F520-T644 VanDerWaalsContact CE1-CG2 3.48Å; F520-T644 HydrophobicContact CZ-CG2 4.2Å; F520-V646 HydrophobicContact CD1-CG2 3.82Å
521	E	94	Very high	91.2	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-54.4	-46.5	178.1	179.5	61.5	-156.3	0	0	111.3	L507 K517 L518 R523 V524 F525 W640 Y642 L643 T644	L507-E521 HydrophobicContact CD1-CG 3.85Å; L507-E521 HydrophobicContact CD2-CB 4.15Å; L507-E521 HydrophobicContact CD2-CG 3.89Å; K517-E521 WeakPolarHBondContact O-CB 3.49Å; K517-E521 PolarHBondContact O-N 3.13Å; L518-E521 PolarHBondContact O-N 3.34Å; E521-R523 PolarHBondContact O-N 3.06Å; E521-V524 PolarHBondContact O-N 2.63Å; E521-F525 VanDerWaalsContact O-CB 3.28Å; E521-F525 WeakPolarHBondContact O-CB 3.49Å; E521-F525 PolarHBondContact O-N 2.94Å; E521-W640 PolarHBondContact OE1-NE1 3.45Å; E521-Y642 HydrophobicContact CG-CD1 3.88Å; E521-Y642 HydrophobicContact CG-CE1 4.22Å; E521-Y642 WeakPolarHBondContact OE1-CA 3.48Å; E521-L643 PolarHBondContact OE1-N 3.41Å; E521-T644 VanDerWaalsContact OE2-CB 3.29Å; E521-T644 WeakPolarHBondContact OE2-CB 3.45Å; E521-T644 WeakPolarHBondContact OE2-CG2 3.37Å; E521-T644 PolarHBondContact OE2-N 3.38Å; E521-T644 PolarHBondContact OE2-OG1 3Å
522	F	94.5	Very high	90.9	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-64.5	-39	179.7	-170.7	-114.4	0	0	0	113.2	I496 A500 F504 L507 L518 F520 F525 W526 L573 V578	I496-F522 HydrophobicContact CD1-CE1 4.27Å; I496-F522 HydrophobicContact CG2-CE1 4.1Å; I496-F522 HydrophobicContact CG2-CZ 4.43Å; A500-F522 HydrophobicContact CB-CZ 3.79Å; A500-F522 WeakPolarHBondContact O-CZ 3.2Å; F504-F522 HydrophobicContact CB-CD2 4.08Å; F504-F522 HydrophobicContact CB-CE1 4.22Å; F504-F522 HydrophobicContact CB-CE2 3.49Å; F504-F522 VanDerWaalsContact CB-CE2 3.49Å; F504-F522 HydrophobicContact CB-CZ 3.56Å; F504-F522 HydrophobicContact CD2-CB 4Å; F504-F522 AromaticContact CD2-CD1 3.63Å; F504-F522 HydrophobicContact CD2-CD1 3.63Å; F504-F522 AromaticContact CD2-CD2 3.46Å; F504-F522 HydrophobicContact CD2-CD2 3.46Å; F504-F522 VanDerWaalsContact CD2-CD2 3.46Å; F504-F522 AromaticContact CD2-CE1 3.9Å; F504-F522 HydrophobicContact CD2-CE1 3.9Å; F504-F522 AromaticContact CD2-CE2 3.76Å; F504-F522 HydrophobicContact CD2-CE2 3.76Å; F504-F522 AromaticContact CD2-CG 3.39Å; F504-F522 HydrophobicContact CD2-CG 3.39Å; F504-F522 AromaticContact CD2-CZ 3.95Å; F504-F522 HydrophobicContact CD2-CZ 3.95Å; F504-F522 HydrophobicContact CE2-CB 4.02Å; F504-F522 AromaticContact CE2-CD1 3.91Å; F504-F522 HydrophobicContact CE2-CD1 3.91Å; F504-F522 HydrophobicContact CE2-CD2 4.32Å; F504-F522 HydrophobicContact CE2-CE1 4.47Å; F504-F522 AromaticContact CE2-CG 3.81Å; F504-F522 HydrophobicContact CE2-CG 3.81Å; F504-F522 HydrophobicContact CG-CD1 4.3Å; F504-F522 HydrophobicContact CG-CD2 4.18Å; F504-F522 HydrophobicContact CG-CE1 4.11Å; F504-F522 AromaticContact CG-CE2 3.99Å; F504-F522 HydrophobicContact CG-CE2 3.99Å; F504-F522 HydrophobicContact CG-CG 4.32Å; F504-F522 AromaticContact CG-CZ 3.94Å; F504-F522 HydrophobicContact CG-CZ 3.94Å; L507-F522 HydrophobicContact CD2-CB 3.7Å; L507-F522 HydrophobicContact CD2-CD2 4.13Å; L507-F522 HydrophobicContact CD2-CG 4.39Å; L518-F522 WeakPolarHBondContact O-CB 3.23Å; L518-F522 PolarHBondContact O-N 3.29Å; F520-F522 VanDerWaalsContact C-N 3.29Å; F520-F522 PolarHBondContact O-N 3.34Å; F522-F525 HydrophobicContact CD2-CD1 4.31Å; F522-F525 HydrophobicContact CE2-CD1 4.29Å; F522-W526 VanDerWaalsContact O-CB 3.28Å; F522-W526 WeakPolarHBondContact O-CB 3.34Å; F522-W526 PolarHBondContact O-N 3.35Å; F522-L573 HydrophobicContact CD1-CD1 4.02Å; F522-L573 HydrophobicContact CE1-CD1 3.6Å; F522-V578 HydrophobicContact CB-CG1 4.29Å; F522-V578 HydrophobicContact CD1-CG1 3.88Å; F522-V578 HydrophobicContact CD1-CG2 4.09Å
523	R	92	Very high	90.6	Very high	10 Å²	10	43.6 Å²	43.6	4%	0.038	24%	0.235	C	C	.	.	H	α-helix	trans	-66.2	-42	178.5	-70.4	173.1	78.7	-167.2	1.2	111.5	A519 F520 E521 H527 Y543 W568 L571 L573 V578	A519-R523 WeakPolarHBondContact O-CG 3.43Å; A519-R523 PolarHBondContact O-N 2.9Å; A519-R523 VanDerWaalsContact O-N 3.1Å; F520-R523 PolarHBondContact O-N 3.25Å; F520-R523 VanDerWaalsContact O-N 3.13Å; E521-R523 PolarHBondContact O-N 3.06Å; R523-H527 PolarHBondContact O-N 3.34Å; R523-Y543 PolarHBondContact NH1-OH 3.27Å; R523-W568 PolarHBondContact NH2-O 3.14Å; R523-L571 HydrophobicContact CB-CD1 3.97Å; R523-L573 HydrophobicContact CG-CB 4.33Å; R523-L573 PolarHBondContact NE-O 3.37Å; R523-L573 PolarHBondContact NH2-O 2.95Å; R523-V578 HydrophobicContact CG-CG2 3.92Å
524	V	91.4	Very high	90.2	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.006	25%	0.249	C	C	.	.	H	α-helix	trans	-64.9	-47.5	176.4	172.5	0	0	0	0	110.3	F520 E521 W526 H527 R528 L534 P535 L538 L643 T644	F520-V524 HydrophobicContact CD2-CG2 4.26Å; F520-V524 HydrophobicContact CE1-CG2 4.31Å; F520-V524 HydrophobicContact CE2-CG2 3.86Å; F520-V524 HydrophobicContact CZ-CG2 3.9Å; F520-V524 WeakPolarHBondContact O-CG2 3.42Å; F520-V524 PolarHBondContact O-N 2.59Å; E521-V524 PolarHBondContact O-N 2.63Å; V524-W526 PolarHBondContact O-N 2.93Å; V524-H527 PolarHBondContact O-N 3.22Å; V524-R528 PolarHBondContact O-N 3.37Å; V524-L534 HydrophobicContact CG1-CD1 4.24Å; V524-P535 HydrophobicContact CG1-CG 4.14Å; V524-L538 HydrophobicContact CG1-CD2 3.54Å; V524-L643 HydrophobicContact CG1-CB 4.1Å; V524-L643 HydrophobicContact CG1-CD1 4.28Å; V524-T644 HydrophobicContact CB-CG2 3.98Å; V524-T644 HydrophobicContact CG1-CG2 3.86Å; V524-T644 HydrophobicContact CG2-CG2 3.9Å
525	F	92.4	Very high	89.6	Confident	31 Å²	31	45.4 Å²	45.4	14%	0.136	24%	0.236	C	C	.	.	H	α-helix	trans	-55.1	-50.9	174.5	170	-93.8	0	0	0	112.1	Y503 E521 F522 H527 R528 H529 W640 L643	Y503-F525 AromaticContact CD1-CE1 3.63Å; Y503-F525 HydrophobicContact CD1-CE1 3.63Å; Y503-F525 HydrophobicContact CD1-CE2 4.24Å; Y503-F525 AromaticContact CD1-CZ 3.22Å; Y503-F525 HydrophobicContact CD1-CZ 3.22Å; Y503-F525 HydrophobicContact CD2-CE1 4.15Å; Y503-F525 HydrophobicContact CD2-CZ 4.37Å; Y503-F525 HydrophobicContact CE1-CE1 4.33Å; Y503-F525 AromaticContact CE1-CZ 3.62Å; Y503-F525 HydrophobicContact CE1-CZ 3.62Å; Y503-F525 AromaticContact CG-CE1 3.5Å; Y503-F525 HydrophobicContact CG-CE1 3.5Å; Y503-F525 AromaticContact CG-CZ 3.63Å; Y503-F525 HydrophobicContact CG-CZ 3.63Å; E521-F525 VanDerWaalsContact O-CB 3.28Å; E521-F525 WeakPolarHBondContact O-CB 3.49Å; E521-F525 PolarHBondContact O-N 2.94Å; F522-F525 HydrophobicContact CD2-CD1 4.31Å; F522-F525 HydrophobicContact CE2-CD1 4.29Å; F525-H527 VanDerWaalsContact C-N 3.3Å; F525-H527 PolarHBondContact O-N 3.44Å; F525-R528 PolarHBondContact O-N 3.48Å; F525-H529 HydrophobicContact CE1-CB 4.22Å; F525-H529 HydrophobicContact CZ-CB 4.19Å; F525-H529 AromaticContact CZ-CD2 3.82Å; F525-H529 WeakPolarHBondContact O-CB 3.45Å; F525-H529 PolarHBondContact O-N 3.02Å; F525-W640 HydrophobicContact CB-CZ2 4.09Å; F525-W640 HydrophobicContact CD1-CH2 4.03Å; F525-W640 HydrophobicContact CD1-CZ2 4.03Å; F525-W640 HydrophobicContact CD2-CH2 4.05Å; F525-W640 AromaticContact CD2-CZ2 3.63Å; F525-W640 HydrophobicContact CD2-CZ2 3.63Å; F525-W640 HydrophobicContact CE1-CH2 4.09Å; F525-W640 HydrophobicContact CE1-CZ2 4.48Å; F525-W640 HydrophobicContact CE2-CH2 4.09Å; F525-W640 HydrophobicContact CE2-CZ2 4.1Å; F525-W640 HydrophobicContact CG-CH2 4.04Å; F525-W640 AromaticContact CG-CZ2 3.6Å; F525-W640 HydrophobicContact CG-CZ2 3.6Å; F525-W640 HydrophobicContact CZ-CH2 4.14Å; F525-L643 HydrophobicContact CB-CD1 4.16Å; F525-L643 HydrophobicContact CD2-CD1 4.32Å
526	W	92.6	Very high	88.8	Confident	12 Å²	12	48.1 Å²	48.1	5%	0.045	25%	0.25	C	S	.	.	H	α-helix	trans	-66.8	-33.8	-176.3	-167.9	-106.6	0	0	0	112.5	P497 E499 A500 Y503 F522 V524 H529 T530 L573	P497-W526 HydrophobicContact CB-CZ2 3.93Å; P497-W526 HydrophobicContact CG-CZ2 4.09Å; E499-W526 HydrophobicContact CB-CH2 4.22Å; A500-W526 VanDerWaalsContact CA-CH2 3.44Å; A500-W526 HydrophobicContact CB-CD2 3.7Å; A500-W526 HydrophobicContact CB-CE3 3.46Å; A500-W526 VanDerWaalsContact CB-CE3 3.46Å; A500-W526 HydrophobicContact CB-CH2 3.32Å; A500-W526 HydrophobicContact CB-CZ2 3.54Å; A500-W526 HydrophobicContact CB-CZ3 3.29Å; Y503-W526 HydrophobicContact CD2-CZ3 4.12Å; F522-W526 VanDerWaalsContact O-CB 3.28Å; F522-W526 WeakPolarHBondContact O-CB 3.34Å; F522-W526 PolarHBondContact O-N 3.35Å; V524-W526 PolarHBondContact O-N 2.93Å; W526-H529 HydrophobicContact CE3-CB 4.43Å; W526-H529 AromaticContact CZ3-ND1 3.74Å; W526-H529 PolarHBondContact O-N 2.95Å; W526-T530 HydrophobicContact CD2-CG2 4.22Å; W526-T530 HydrophobicContact CH2-CG2 4.5Å; W526-T530 HydrophobicContact CZ2-CG2 3.86Å; W526-T530 WeakPolarHBondContact O-CB 3.41Å; W526-T530 WeakPolarHBondContact O-CG2 3.49Å; W526-T530 PolarHBondContact O-N 2.9Å; W526-T530 PolarHBondContact O-OG1 3.09Å; W526-L573 HydrophobicContact CB-CD1 3.89Å; W526-L573 VanDerWaalsContact CD1-CD1 3.47Å; W526-L573 HydrophobicContact CD2-CD1 4.49Å; W526-L573 HydrophobicContact CG-CD1 3.64Å; W526-L573 HydrophobicContact CG-CG 4.22Å
527	H	87.7	Confident	87.9	Confident	28 Å²	28	44.7 Å²	44.7	13%	0.13	24%	0.235	C	C	.	.	H	α-helix	trans	-62.3	-53.7	171.8	-173	88.8	0	0	0	110.8	R523 V524 F525 H529 T530 T531 I533 P535 L571 P572	R523-H527 PolarHBondContact O-N 3.34Å; V524-H527 PolarHBondContact O-N 3.22Å; F525-H527 VanDerWaalsContact C-N 3.3Å; F525-H527 PolarHBondContact O-N 3.44Å; H527-H529 VanDerWaalsContact C-N 3.25Å; H527-H529 PolarHBondContact O-N 2.94Å; H527-T530 PolarHBondContact O-N 3.19Å; H527-T530 VanDerWaalsContact O-N 3.16Å; H527-T530 PolarHBondContact O-OG1 2.95Å; H527-T531 PolarHBondContact CD2-OG1 3.42Å; H527-T531 PolarHBondContact NE2-OG1 2.87Å; H527-T531 PolarHBondContact O-N 2.79Å; H527-T531 PolarHBondContact O-OG1 3.32Å; H527-I533 PolarHBondContact CD2-O 3.03Å; H527-I533 VanDerWaalsContact CD2-O 3.31Å; H527-P535 HydrophobicContact CB-CG 3.9Å; H527-L571 HydrophobicContact CB-CD2 3.62Å; H527-P572 HydrophobicContact CB-CG 4.4Å; H527-P572 VanDerWaalsContact ND1-CD 3.33Å; H527-P572 WeakPolarHBondContact ND1-CD 3.37Å
528	R	87.9	Confident	87.4	Confident	122 Å²	122	44.5 Å²	44.5	46%	0.46	24%	0.236	S	C	.	.	H	α-helix	trans	-56.3	-40.5	176.5	177.2	-174.7	169.3	176.8	-5	112.2	V524 F525 T530 G532 I533 L534 L643	V524-R528 PolarHBondContact O-N 3.37Å; F525-R528 PolarHBondContact O-N 3.48Å; R528-T530 VanDerWaalsContact C-N 3.35Å; R528-G532 WeakPolarHBondContact O-CA 3.36Å; R528-G532 PolarHBondContact O-N 2.79Å; R528-I533 WeakPolarHBondContact CA-O 3.43Å; R528-L534 HydrophobicContact CB-CD1 4.33Å; R528-L643 HydrophobicContact CB-CD1 4.21Å
529	H	86.2	Confident	87.1	Confident	85 Å²	85	49.2 Å²	49.2	39%	0.394	26%	0.258	S	S	.	.	H	α-helix	trans	-66.5	-36.5	-178.4	-171.3	-87.2	0	0	0	112.4	Y503 F525 W526 H527	Y503-H529 AromaticContact CE2-CE1 3.86Å; Y503-H529 AromaticContact CE2-NE2 3.56Å; Y503-H529 AromaticContact CZ-CD2 3.84Å; Y503-H529 AromaticContact CZ-NE2 3.27Å; Y503-H529 VanDerWaalsContact CZ-NE2 3.27Å; Y503-H529 PolarHBondContact OH-NE2 3.41Å; F525-H529 HydrophobicContact CE1-CB 4.22Å; F525-H529 HydrophobicContact CZ-CB 4.19Å; F525-H529 AromaticContact CZ-CD2 3.82Å; F525-H529 WeakPolarHBondContact O-CB 3.45Å; F525-H529 PolarHBondContact O-N 3.02Å; W526-H529 HydrophobicContact CE3-CB 4.43Å; W526-H529 AromaticContact CZ3-ND1 3.74Å; W526-H529 PolarHBondContact O-N 2.95Å; H527-H529 VanDerWaalsContact C-N 3.25Å; H527-H529 PolarHBondContact O-N 2.94Å
530	T	87.3	Confident	86.8	Confident	74 Å²	74	50.5 Å²	50.5	45%	0.454	26%	0.263	S	S	.	.	H	α-helix	trans	-89.6	-35.9	-177.7	51.2	0	0	0	0	114	W526 H527 R528	W526-T530 HydrophobicContact CD2-CG2 4.22Å; W526-T530 HydrophobicContact CH2-CG2 4.5Å; W526-T530 HydrophobicContact CZ2-CG2 3.86Å; W526-T530 WeakPolarHBondContact O-CB 3.41Å; W526-T530 WeakPolarHBondContact O-CG2 3.49Å; W526-T530 PolarHBondContact O-N 2.9Å; W526-T530 PolarHBondContact O-OG1 3.09Å; H527-T530 PolarHBondContact O-N 3.19Å; H527-T530 VanDerWaalsContact O-N 3.16Å; H527-T530 PolarHBondContact O-OG1 2.95Å; R528-T530 VanDerWaalsContact C-N 3.35Å
531	T	85.4	Confident	86.4	Confident	66 Å²	66	55 Å²	55	41%	0.405	29%	0.285	S	S	.	.	H	α-helix	trans	-98.1	-17.8	-177.4	66.2	0	0	0	0	113.2	H527 I533	H527-T531 PolarHBondContact CD2-OG1 3.42Å; H527-T531 PolarHBondContact NE2-OG1 2.87Å; H527-T531 PolarHBondContact O-N 2.79Å; H527-T531 PolarHBondContact O-OG1 3.32Å; T531-I533 PolarHBondContact O-N 3.09Å; T531-I533 PolarHBondContact OG1-N 3.05Å; T531-I533 PolarHBondContact OG1-O 3.23Å
532	G	84	Confident	85.9	Confident	64 Å²	64	59.2 Å²	59.2	66%	0.66	31%	0.305	S	S	*	.	S	Bend	trans	74.1	-6.7	-170.2	0	0	0	0	0	114	R528	R528-G532 WeakPolarHBondContact O-CA 3.36Å; R528-G532 PolarHBondContact O-N 2.79Å
533	I	85.2	Confident	85.2	Confident	118 Å²	118	59.5 Å²	59.5	61%	0.605	31%	0.306	S	S	*	.	S	Bend	trans	-110.2	136.8	-174.7	-57.6	169	0	0	0	108.8	H527 R528 T531	H527-I533 PolarHBondContact CD2-O 3.03Å; H527-I533 VanDerWaalsContact CD2-O 3.31Å; R528-I533 WeakPolarHBondContact CA-O 3.43Å; T531-I533 PolarHBondContact O-N 3.09Å; T531-I533 PolarHBondContact OG1-N 3.05Å; T531-I533 PolarHBondContact OG1-O 3.23Å
534	L	80.9	Confident	84.7	Confident	76 Å²	76	64.8 Å²	64.8	40%	0.398	33%	0.33	S	S	.	.			trans	-79.1	132	177.8	-167.6	63	0	0	0	109.6	V524 R528 L538 L643	V524-L534 HydrophobicContact CG1-CD1 4.24Å; R528-L534 HydrophobicContact CB-CD1 4.33Å; L534-L538 HydrophobicContact CD1-CD1 4.49Å; L534-L538 HydrophobicContact CD1-CD2 3.72Å; L534-L538 HydrophobicContact CD2-CD1 3.4Å; L534-L538 HydrophobicContact CD2-CD2 4.16Å; L534-L538 HydrophobicContact CD2-CG 4.33Å; L534-L538 HydrophobicContact CG-CD1 3.91Å; L534-L538 HydrophobicContact CG-CD2 3.79Å; L534-L538 HydrophobicContact CG-CG 4.33Å; L534-L643 HydrophobicContact CD1-CB 4.5Å; L534-L643 HydrophobicContact CD1-CD1 4.2Å
535	P	79.1	Confident	84	Confident	20 Å²	20	71.6 Å²	71.6	13%	0.13	36%	0.359	C	S	.	.			trans	-58.4	149.1	174.1	-19.4	29.5	0	0	0	111.5	V524 H527 C537 L571	V524-P535 HydrophobicContact CG1-CG 4.14Å; H527-P535 HydrophobicContact CB-CG 3.9Å; P535-C537 VanDerWaalsContact C-N 3.25Å; P535-C537 PolarHBondContact O-N 3.12Å; P535-L571 HydrophobicContact CB-CD2 4.02Å; P535-L571 HydrophobicContact CG-CD2 3.59Å
536	E	76.4	Confident	82.6	Confident	169 Å²	169	72.3 Å²	72.3	79%	0.79	37%	0.368	S	S	*	.	S	Bend	trans	-61.8	-30.7	-179.5	-172.5	175.2	-160.6	0	0	113.2	P566	E536-P566 HydrophobicContact CB-CB 4.26Å; E536-P566 HydrophobicContact CG-CB 4.36Å
537	C	72.9	Confident	81.1	Confident	6 Å²	6	74.1 Å²	74.1	4%	0.041	38%	0.378	C	S	.	.			trans	-103.2	112.4	179.7	-173.6	0	0	0	0	112.7	P535 P566 W568	P535-C537 VanDerWaalsContact C-N 3.25Å; P535-C537 PolarHBondContact O-N 3.12Å; C537-P566 HydrophobicContact CB-CB 3.98Å; C537-P566 HydrophobicContact CB-CG 4.23Å; C537-W568 PolarHBondContact SG-NE1 3.44Å; C537-W568 VanDerWaalsContact SG-NE1 3.41Å
538	L	84.3	Confident	79.4	Confident	50 Å²	50	76 Å²	76	26%	0.262	40%	0.398	S	S	.	.			trans	-115.4	-4.9	177.1	-57.6	172.9	0	0	0	113.4	V524 L534 T644 D645	V524-L538 HydrophobicContact CG1-CD2 3.54Å; L534-L538 HydrophobicContact CD1-CD1 4.49Å; L534-L538 HydrophobicContact CD1-CD2 3.72Å; L534-L538 HydrophobicContact CD2-CD1 3.4Å; L534-L538 HydrophobicContact CD2-CD2 4.16Å; L534-L538 HydrophobicContact CD2-CG 4.33Å; L534-L538 HydrophobicContact CG-CD1 3.91Å; L534-L538 HydrophobicContact CG-CD2 3.79Å; L534-L538 HydrophobicContact CG-CG 4.33Å; L538-T644 HydrophobicContact CD2-CG2 4.39Å; L538-T644 WeakPolarHBondContact O-CA 3.39Å; L538-T644 WeakPolarHBondContact O-CB 3.5Å; L538-D645 PolarHBondContact O-N 3.2Å
539	Q	88.6	Confident	77.4	Confident	100 Å²	100	73.1 Å²	73.1	47%	0.467	40%	0.397	S	S	.	.			trans	-90.6	113.6	178	-64.9	-150.5	17.3	0	0	110.8	M541 E542 Y543	Q539-M541 PolarHBondContact O-N 2.88Å; Q539-E542 HydrophobicContact CB-CB 4.08Å; Q539-E542 HydrophobicContact CB-CG 3.95Å; Q539-E542 PolarHBondContact O-N 3.38Å; Q539-Y543 PolarHBondContact O-N 3.19Å
540	Y	87.1	Confident	75.5	Confident	26 Å²	26	72.9 Å²	72.9	10%	0.102	40%	0.402	C	S	.	.	H	α-helix	trans	-62.6	-32.5	178.6	177.6	-102.6	0	0	0	112.5	H516 K517 F520 Y543 K544 D645 V646	H516-Y540 HydrophobicContact CB-CE2 4.49Å; H516-Y540 WeakPolarHBondContact CB-OH 3.42Å; K517-Y540 HydrophobicContact CB-CE2 4.46Å; K517-Y540 HydrophobicContact CD-CE1 4.38Å; K517-Y540 HydrophobicContact CG-CD1 4.04Å; K517-Y540 HydrophobicContact CG-CD2 4.23Å; K517-Y540 HydrophobicContact CG-CE1 3.65Å; K517-Y540 HydrophobicContact CG-CE2 3.86Å; K517-Y540 HydrophobicContact CG-CG 4.31Å; F520-Y540 HydrophobicContact CB-CD2 3.85Å; F520-Y540 HydrophobicContact CB-CE2 4.1Å; F520-Y540 AromaticContact CD1-CD2 3.65Å; F520-Y540 HydrophobicContact CD1-CD2 3.65Å; F520-Y540 HydrophobicContact CD1-CG 4.33Å; F520-Y540 HydrophobicContact CE1-CD2 4.38Å; F520-Y540 AromaticContact CG-CD2 3.85Å; F520-Y540 HydrophobicContact CG-CD2 3.85Å; Y540-Y543 HydrophobicContact CD2-CD1 4.25Å; Y540-Y543 HydrophobicContact CE2-CD1 4.28Å; Y540-Y543 WeakPolarHBondContact O-CB 3.5Å; Y540-Y543 PolarHBondContact O-N 3.36Å; Y540-K544 HydrophobicContact CE1-CD 4.29Å; Y540-K544 VanDerWaalsContact O-CB 3.26Å; Y540-K544 WeakPolarHBondContact O-CB 3.48Å; Y540-K544 PolarHBondContact O-N 3.4Å; Y540-D645 WeakPolarHBondContact CB-OD1 3.31Å; Y540-D645 PolarHBondContact N-OD1 3.35Å; Y540-V646 HydrophobicContact CD2-CG2 3.92Å; Y540-V646 HydrophobicContact CG-CG2 3.87Å
541	M	85.5	Confident	73.2	Confident	96 Å²	96	74 Å²	74	47%	0.473	41%	0.409	S	S	.	.	H	α-helix	trans	-70.8	-34.7	178.9	-70.4	-61.4	-70.8	0	0	112.1	Q539 K545	Q539-M541 PolarHBondContact O-N 2.88Å; M541-K545 VanDerWaalsContact O-CG 3.28Å; M541-K545 WeakPolarHBondContact O-CG 3.39Å; M541-K545 PolarHBondContact O-N 3.03Å
542	E	82.6	Confident	70.7	Confident	89 Å²	89	73.5 Å²	73.5	42%	0.416	42%	0.416	S	S	.	.	H	α-helix	trans	-67.2	-51.9	169.2	-66.3	175.8	179	0	0	109	Q539 K544 K545 C546 W568	Q539-E542 HydrophobicContact CB-CB 4.08Å; Q539-E542 HydrophobicContact CB-CG 3.95Å; Q539-E542 PolarHBondContact O-N 3.38Å; E542-K544 PolarHBondContact O-N 3.16Å; E542-K544 VanDerWaalsContact O-N 3.08Å; E542-K545 WeakPolarHBondContact O-CA 3.49Å; E542-K545 WeakPolarHBondContact O-CB 3.49Å; E542-K545 PolarHBondContact O-N 3.38Å; E542-C546 PolarHBondContact O-N 2.99Å; E542-W568 VanDerWaalsContact C-CH2 3.41Å; E542-W568 WeakPolarHBondContact O-CH2 3.44Å
543	Y	80.4	Confident	68.2	Low	6 Å²	6	74.3 Å²	74.3	2%	0.024	41%	0.412	C	S	.	.	H	α-helix	trans	-44.1	-45.6	172.9	-178.1	-100.7	0	0	0	113	F520 R523 Q539 Y540 N547 W568 Q575	F520-Y543 HydrophobicContact CB-CD1 4.27Å; F520-Y543 HydrophobicContact CB-CE1 4.32Å; F520-Y543 AromaticContact CD2-CD1 3.51Å; F520-Y543 HydrophobicContact CD2-CD1 3.51Å; F520-Y543 AromaticContact CD2-CD2 3.43Å; F520-Y543 HydrophobicContact CD2-CD2 3.43Å; F520-Y543 VanDerWaalsContact CD2-CD2 3.43Å; F520-Y543 AromaticContact CD2-CE1 3.86Å; F520-Y543 HydrophobicContact CD2-CE1 3.86Å; F520-Y543 AromaticContact CD2-CE2 3.77Å; F520-Y543 HydrophobicContact CD2-CE2 3.77Å; F520-Y543 AromaticContact CD2-CG 3.28Å; F520-Y543 HydrophobicContact CD2-CG 3.28Å; F520-Y543 AromaticContact CD2-CZ 3.97Å; F520-Y543 VanDerWaalsContact CE2-CB 3.49Å; F520-Y543 HydrophobicContact CE2-CD1 4.03Å; F520-Y543 AromaticContact CE2-CD2 3.28Å; F520-Y543 HydrophobicContact CE2-CD2 3.28Å; F520-Y543 AromaticContact CE2-CE2 4Å; F520-Y543 HydrophobicContact CE2-CE2 4Å; F520-Y543 AromaticContact CE2-CG 3.29Å; F520-Y543 HydrophobicContact CE2-CG 3.29Å; F520-Y543 AromaticContact CG-CD1 3.97Å; F520-Y543 HydrophobicContact CG-CD1 3.97Å; F520-Y543 HydrophobicContact CG-CE1 4.39Å; F520-Y543 HydrophobicContact CG-CG 4.08Å; F520-Y543 HydrophobicContact CZ-CD2 4.34Å; F520-Y543 HydrophobicContact CZ-CG 4.07Å; R523-Y543 PolarHBondContact NH1-OH 3.27Å; Q539-Y543 PolarHBondContact O-N 3.19Å; Y540-Y543 HydrophobicContact CD2-CD1 4.25Å; Y540-Y543 HydrophobicContact CE2-CD1 4.28Å; Y540-Y543 WeakPolarHBondContact O-CB 3.5Å; Y540-Y543 PolarHBondContact O-N 3.36Å; Y543-N547 VanDerWaalsContact CZ-ND2 3.33Å; Y543-N547 WeakPolarHBondContact O-CB 3.23Å; Y543-N547 PolarHBondContact O-N 2.97Å; Y543-N547 PolarHBondContact OH-ND2 2.7Å; Y543-N547 VanDerWaalsContact OH-ND2 3.08Å; Y543-W568 VanDerWaalsContact C-CH2 3.41Å; Y543-W568 VanDerWaalsContact CA-CZ2 3.45Å; Y543-W568 AromaticContact CD2-CD2 3.53Å; Y543-W568 HydrophobicContact CD2-CD2 3.53Å; Y543-W568 AromaticContact CD2-CE3 3.16Å; Y543-W568 HydrophobicContact CD2-CE3 3.16Å; Y543-W568 HydrophobicContact CD2-CG 4.17Å; Y543-W568 HydrophobicContact CD2-CH2 4.34Å; Y543-W568 AromaticContact CD2-CZ3 3.65Å; Y543-W568 HydrophobicContact CD2-CZ3 3.65Å; Y543-W568 HydrophobicContact CE2-CB 4.36Å; Y543-W568 HydrophobicContact CE2-CD2 4.03Å; Y543-W568 AromaticContact CE2-CE3 3.5Å; Y543-W568 HydrophobicContact CE2-CE3 3.5Å; Y543-W568 VanDerWaalsContact CE2-CE3 3.5Å; Y543-W568 HydrophobicContact CE2-CG 4.41Å; Y543-W568 HydrophobicContact CE2-CZ3 4.23Å; Y543-W568 HydrophobicContact CG-CE3 4.06Å; Y543-W568 HydrophobicContact CG-CZ3 4.1Å; Y543-W568 VanDerWaalsContact O-CH2 3.27Å; Y543-W568 WeakPolarHBondContact O-CH2 3.47Å; Y543-W568 WeakPolarHBondContact O-CZ3 3.39Å; Y543-Q575 PolarHBondContact OH-OE1 3.42Å
544	K	80.7	Confident	65.5	Low	122 Å²	122	72.8 Å²	72.8	53%	0.53	41%	0.412	S	S	.	.	H	α-helix	trans	-71.5	-34.5	-178.9	-170.4	-178	175.7	-169	0	112.3	Y540 E542 A548	Y540-K544 HydrophobicContact CE1-CD 4.29Å; Y540-K544 VanDerWaalsContact O-CB 3.26Å; Y540-K544 WeakPolarHBondContact O-CB 3.48Å; Y540-K544 PolarHBondContact O-N 3.4Å; E542-K544 PolarHBondContact O-N 3.16Å; E542-K544 VanDerWaalsContact O-N 3.08Å; K544-A548 PolarHBondContact O-N 3.23Å
545	K	77.8	Confident	63	Low	143 Å²	143	76.6 Å²	76.6	62%	0.622	43%	0.431	S	S	*	.	H	α-helix	trans	-70.6	-49.5	179	-74.7	172.2	-176.7	179.5	0	111.4	M541 E542 N547 A548 S549	M541-K545 VanDerWaalsContact O-CG 3.28Å; M541-K545 WeakPolarHBondContact O-CG 3.39Å; M541-K545 PolarHBondContact O-N 3.03Å; E542-K545 WeakPolarHBondContact O-CA 3.49Å; E542-K545 WeakPolarHBondContact O-CB 3.49Å; E542-K545 PolarHBondContact O-N 3.38Å; K545-N547 VanDerWaalsContact C-N 3.32Å; K545-N547 PolarHBondContact O-N 3Å; K545-A548 WeakPolarHBondContact O-CA 3.37Å; K545-A548 WeakPolarHBondContact O-CB 3.34Å; K545-A548 PolarHBondContact O-N 3.39Å; K545-S549 PolarHBondContact O-N 2.92Å; K545-S549 PolarHBondContact O-OG 2.98Å
546	C	62.6	Low	60.7	Low	47 Å²	47	79.2 Å²	79.2	32%	0.318	45%	0.449	S	S	.	.	H	α-helix	trans	-70.4	-29.7	-180	-39	0	0	0	0	112.7	E542 A548 S549 T550 W568	E542-C546 PolarHBondContact O-N 2.99Å; C546-A548 PolarHBondContact O-N 3.4Å; C546-S549 VanDerWaalsContact CA-OG 3.27Å; C546-S549 WeakPolarHBondContact CA-OG 3.36Å; C546-S549 PolarHBondContact O-N 2.97Å; C546-S549 PolarHBondContact O-OG 3.12Å; C546-T550 WeakPolarHBondContact O-CB 3.47Å; C546-T550 PolarHBondContact O-N 3.22Å; C546-T550 PolarHBondContact O-OG1 3.42Å; C546-W568 HydrophobicContact CB-CE3 4.36Å; C546-W568 HydrophobicContact CB-CH2 3.06Å; C546-W568 HydrophobicContact CB-CZ2 3.9Å; C546-W568 HydrophobicContact CB-CZ3 3.39Å; C546-W568 WeakPolarHBondContact SG-CH2 3.43Å
547	N	60.4	Low	58.5	Low	49 Å²	49	82.9 Å²	82.9	26%	0.262	46%	0.456	S	S	.	.	H	α-helix	trans	-67.6	-20.4	172.2	-92.8	22.2	0	0	0	112.1	Y543 K545 V551 W568 Q575	Y543-N547 VanDerWaalsContact CZ-ND2 3.33Å; Y543-N547 WeakPolarHBondContact O-CB 3.23Å; Y543-N547 PolarHBondContact O-N 2.97Å; Y543-N547 PolarHBondContact OH-ND2 2.7Å; Y543-N547 VanDerWaalsContact OH-ND2 3.08Å; K545-N547 VanDerWaalsContact C-N 3.32Å; K545-N547 PolarHBondContact O-N 3Å; N547-V551 WeakPolarHBondContact O-CG2 3.48Å; N547-W568 HydrophobicContact CB-CZ3 4.42Å; N547-Q575 PolarHBondContact ND2-OE1 3.18Å
548	A	52	Low	56.3	Low	67 Å²	67	87.2 Å²	87.2	55%	0.554	50%	0.501	S	S	*	.	H	α-helix	trans	-81.7	-38.2	169.5	0	0	0	0	0	111.6	K544 K545 C546 V551 G552	K544-A548 PolarHBondContact O-N 3.23Å; K545-A548 WeakPolarHBondContact O-CA 3.37Å; K545-A548 WeakPolarHBondContact O-CB 3.34Å; K545-A548 PolarHBondContact O-N 3.39Å; C546-A548 PolarHBondContact O-N 3.4Å; A548-V551 PolarHBondContact O-N 3.42Å; A548-G552 PolarHBondContact O-N 3.33Å
549	S	46.1	Very low	53.5	Low	62 Å²	62	87.1 Å²	87.1	43%	0.434	51%	0.513	S	S	.	.	H	α-helix	trans	-81.6	-32.4	-178.5	55.7	0	0	0	0	114.5	K545 C546 V551 G552 S553	K545-S549 PolarHBondContact O-N 2.92Å; K545-S549 PolarHBondContact O-OG 2.98Å; C546-S549 VanDerWaalsContact CA-OG 3.27Å; C546-S549 WeakPolarHBondContact CA-OG 3.36Å; C546-S549 PolarHBondContact O-N 2.97Å; C546-S549 PolarHBondContact O-OG 3.12Å; S549-V551 PolarHBondContact O-N 2.99Å; S549-G552 CarbonylContact O-C 3.53Å; S549-G552 PolarHBondContact O-N 3.44Å; S549-S553 WeakPolarHBondContact O-CB 3.44Å; S549-S553 PolarHBondContact O-N 3.44Å
550	T	45.9	Very low	50.6	Low	80 Å²	80	90.6 Å²	90.6	49%	0.491	53%	0.534	S	S	.	.	H	α-helix	trans	-59.3	-27.1	167.1	-49.5	0	0	0	0	110.7	C546	C546-T550 WeakPolarHBondContact O-CB 3.47Å; C546-T550 PolarHBondContact O-N 3.22Å; C546-T550 PolarHBondContact O-OG1 3.42Å
551	V	39.1	Very low	47.9	Very low	99 Å²	99	93.5 Å²	93.5	60%	0.6	56%	0.558	S	S	*	*	H	α-helix	trans	-83.8	-20	175	-177.4	0	0	0	0	112.2	N547 A548 S549	N547-V551 WeakPolarHBondContact O-CG2 3.48Å; A548-V551 PolarHBondContact O-N 3.42Å; S549-V551 PolarHBondContact O-N 2.99Å
552	G	32.2	Very low	45.4	Very low	55 Å²	55	94.1 Å²	94.1	57%	0.567	57%	0.567	S	S	*	*	H	α-helix	trans	-98.5	-24.7	-179.5	0	0	0	0	0	116.3	A548 S549	A548-G552 PolarHBondContact O-N 3.33Å; S549-G552 CarbonylContact O-C 3.53Å; S549-G552 PolarHBondContact O-N 3.44Å
553	S	31.3	Very low	43.1	Very low	80 Å²	80	96.6 Å²	96.6	56%	0.559	58%	0.582	S	S	*	*			trans	-110.4	9	-164.2	-123.6	0	0	0	0	116.5	S549 I555	S549-S553 WeakPolarHBondContact O-CB 3.44Å; S549-S553 PolarHBondContact O-N 3.44Å; S553-I555 PolarHBondContact O-N 3Å
554	S	29.4	Very low	40.9	Very low	87 Å²	87	101.7 Å²	101.7	61%	0.608	62%	0.618	S	S	*	*			trans	-76.9	36.5	170.6	-46.7	0	0	0	0	113.2
555	I	28	Very low	38.8	Very low	156 Å²	156	97.9 Å²	97.9	80%	0.8	61%	0.614	S	S	*	*			trans	-112.8	74.7	166.2	-55.4	171.6	0	0	0	106.4	S553	S553-I555 PolarHBondContact O-N 3Å
556	S	31.9	Very low	37.4	Very low	74 Å²	74	93.1 Å²	93.1	52%	0.517	60%	0.597	S	S	.	*			trans	-167	88.5	158.9	32	0	0	0	0	105.2
557	R	29	Very low	36.5	Very low	247 Å²	247	93.3 Å²	93.3	93%	0.932	61%	0.607	S	S	*	*				43	92.1	108.4	-78	-166.4	-78.9	-161.2	-1.9	112.1	G559	R557-G559 VanDerWaalsContact C-N 3.26Å; R557-G559 PolarHBondContact O-N 2.68Å
558	G	26.9	Very low	36.1	Very low	96 Å²	96	92 Å²	92	99%	0.99	60%	0.599	S	S	*	*	S	Bend	trans	63.9	8.5	138.2	0	0	0	0	0	119.8
559	G	26.5	Very low	36.1	Very low	49 Å²	49	95.9 Å²	95.9	51%	0.505	61%	0.61	S	S	.	*			trans	-117.7	133.9	174	0	0	0	0	0	110	R557 S561	R557-G559 VanDerWaalsContact C-N 3.26Å; R557-G559 PolarHBondContact O-N 2.68Å; G559-S561 PolarHBondContact O-N 3Å
560	L	28.2	Very low	36.7	Very low	172 Å²	172	97 Å²	97	90%	0.901	62%	0.618	S	S	*	*			trans	-62.4	77.8	161.6	-84.1	99.4	0	0	0	108.3	V562	L560-V562 PolarHBondContact O-N 3.48Å
561	S	30.5	Very low	37.6	Very low	87 Å²	87	93.9 Å²	93.9	61%	0.608	60%	0.599	S	S	*	*			trans	-72.3	89.6	163	-63	0	0	0	0	105.6	G559 L563	G559-S561 PolarHBondContact O-N 3Å; S561-L563 PolarHBondContact O-N 2.97Å
562	V	32.3	Very low	39	Very low	109 Å²	109	92.8 Å²	92.8	66%	0.661	59%	0.593	S	S	*	*			trans	-59.4	82	158.6	-179.8	0	0	0	0	104.9	L560 S564	L560-V562 PolarHBondContact O-N 3.48Å; V562-S564 PolarHBondContact O-N 2.98Å
563	L	33.3	Very low	41.4	Very low	141 Å²	141	90.6 Å²	90.6	74%	0.738	57%	0.569	S	S	*	*			trans	-65.4	95.3	165.1	-71.2	177.6	0	0	0	104.5	S561 G565	S561-L563 PolarHBondContact O-N 2.97Å; L563-G565 PolarHBondContact O-N 2.97Å
564	S	35.8	Very low	44	Very low	113 Å²	113	89.3 Å²	89.3	79%	0.79	56%	0.56	S	S	*	*			trans	-63.5	39.9	164.4	-59.9	0	0	0	0	111.1	V562	V562-S564 PolarHBondContact O-N 2.98Å
565	G	36.1	Very low	46.8	Very low	42 Å²	42	87.4 Å²	87.4	43%	0.433	54%	0.541	S	S	.	.	S	Bend	trans	-69.7	149.5	156.2	0	0	0	0	0	107.6	L563 G567	L563-G565 PolarHBondContact O-N 2.97Å; G565-G567 PolarHBondContact O-N 3.01Å; G565-G567 VanDerWaalsContact O-N 3.1Å
566	P	47.4	Very low	49.6	Very low	43 Å²	43	84.1 Å²	84.1	28%	0.279	53%	0.532	S	S	.	.			trans	-53.6	128.2	-179.6	-15.2	24.4	0	0	0	107.6	E536 C537 W568	E536-P566 HydrophobicContact CB-CB 4.26Å; E536-P566 HydrophobicContact CG-CB 4.36Å; C537-P566 HydrophobicContact CB-CB 3.98Å; C537-P566 HydrophobicContact CB-CG 4.23Å; P566-W568 VanDerWaalsContact C-N 3.26Å; P566-W568 PolarHBondContact O-N 3.3Å; P566-W568 PolarHBondContact O-NE1 3.3Å
567	G	43.6	Very low	52.3	Low	51 Å²	51	82.2 Å²	82.2	53%	0.526	52%	0.516	S	S	.	.			trans	-66	79.4	-170	0	0	0	0	0	112	G565 D569 S570	G565-G567 PolarHBondContact O-N 3.01Å; G565-G567 VanDerWaalsContact O-N 3.1Å; G567-D569 PolarHBondContact O-N 3.44Å; G567-S570 WeakPolarHBondContact O-CA 3.49Å; G567-S570 WeakPolarHBondContact O-CB 3.5Å; G567-S570 PolarHBondContact O-N 3.21Å
568	W	52.8	Low	55.4	Low	23 Å²	23	70.5 Å²	70.5	9%	0.087	47%	0.471	C	S	.	.	G	3₁₀ helix	trans	-70.9	-20	-177.8	-59.8	-3.4	0	0	0	112.5	R523 C537 E542 Y543 C546 N547 P566 L571	R523-W568 PolarHBondContact NH2-O 3.14Å; C537-W568 PolarHBondContact SG-NE1 3.44Å; C537-W568 VanDerWaalsContact SG-NE1 3.41Å; E542-W568 VanDerWaalsContact C-CH2 3.41Å; E542-W568 WeakPolarHBondContact O-CH2 3.44Å; Y543-W568 VanDerWaalsContact C-CH2 3.41Å; Y543-W568 VanDerWaalsContact CA-CZ2 3.45Å; Y543-W568 AromaticContact CD2-CD2 3.53Å; Y543-W568 HydrophobicContact CD2-CD2 3.53Å; Y543-W568 AromaticContact CD2-CE3 3.16Å; Y543-W568 HydrophobicContact CD2-CE3 3.16Å; Y543-W568 HydrophobicContact CD2-CG 4.17Å; Y543-W568 HydrophobicContact CD2-CH2 4.34Å; Y543-W568 AromaticContact CD2-CZ3 3.65Å; Y543-W568 HydrophobicContact CD2-CZ3 3.65Å; Y543-W568 HydrophobicContact CE2-CB 4.36Å; Y543-W568 HydrophobicContact CE2-CD2 4.03Å; Y543-W568 AromaticContact CE2-CE3 3.5Å; Y543-W568 HydrophobicContact CE2-CE3 3.5Å; Y543-W568 VanDerWaalsContact CE2-CE3 3.5Å; Y543-W568 HydrophobicContact CE2-CG 4.41Å; Y543-W568 HydrophobicContact CE2-CZ3 4.23Å; Y543-W568 HydrophobicContact CG-CE3 4.06Å; Y543-W568 HydrophobicContact CG-CZ3 4.1Å; Y543-W568 VanDerWaalsContact O-CH2 3.27Å; Y543-W568 WeakPolarHBondContact O-CH2 3.47Å; Y543-W568 WeakPolarHBondContact O-CZ3 3.39Å; C546-W568 HydrophobicContact CB-CE3 4.36Å; C546-W568 HydrophobicContact CB-CH2 3.06Å; C546-W568 HydrophobicContact CB-CZ2 3.9Å; C546-W568 HydrophobicContact CB-CZ3 3.39Å; C546-W568 WeakPolarHBondContact SG-CH2 3.43Å; N547-W568 HydrophobicContact CB-CZ3 4.42Å; P566-W568 VanDerWaalsContact C-N 3.26Å; P566-W568 PolarHBondContact O-N 3.3Å; P566-W568 PolarHBondContact O-NE1 3.3Å; W568-L571 PolarHBondContact O-N 3.13Å
569	D	52.7	Low	58.6	Low	147 Å²	147	67.6 Å²	67.6	79%	0.786	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-73.7	-11.9	166.9	-68.9	-30.5	0	0	0	112.4	G567 L571	G567-D569 PolarHBondContact O-N 3.44Å; D569-L571 PolarHBondContact O-N 2.99Å
570	S	58.5	Low	61.8	Low	87 Å²	87	69 Å²	69	61%	0.608	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-76.5	-4.3	170.4	-165.1	0	0	0	0	113.2	G567	G567-S570 WeakPolarHBondContact O-CA 3.49Å; G567-S570 WeakPolarHBondContact O-CB 3.5Å; G567-S570 PolarHBondContact O-N 3.21Å
571	L	63.6	Low	64.9	Low	14 Å²	14	62.5 Å²	62.5	7%	0.073	40%	0.399	C	S	.	.	S	Bend	trans	-74.7	128.9	172.2	-64.4	173.8	0	0	0	109.6	R523 H527 P535 W568 D569 L573	R523-L571 HydrophobicContact CB-CD1 3.97Å; H527-L571 HydrophobicContact CB-CD2 3.62Å; P535-L571 HydrophobicContact CB-CD2 4.02Å; P535-L571 HydrophobicContact CG-CD2 3.59Å; W568-L571 PolarHBondContact O-N 3.13Å; D569-L571 PolarHBondContact O-N 2.99Å; L571-L573 PolarHBondContact O-N 3.11Å; L571-L573 VanDerWaalsContact O-N 3.12Å
572	P	69.7	Low	68	Low	75 Å²	75	58.5 Å²	58.5	49%	0.487	37%	0.371	S	S	.	.	S	Bend	trans	-62.7	-27.3	-169.2	22.1	-34.5	0	0	0	114.2	H527	H527-P572 HydrophobicContact CB-CG 4.4Å; H527-P572 VanDerWaalsContact ND1-CD 3.33Å; H527-P572 WeakPolarHBondContact ND1-CD 3.37Å
573	L	82.3	Confident	70.8	Confident	10 Å²	10	56.8 Å²	56.8	5%	0.052	37%	0.369	C	S	.	.	S	Bend	trans	-99.4	134.7	177	-60.9	179.2	0	0	0	110	I496 F522 R523 W526 L571 V578	I496-L573 HydrophobicContact CG2-CD1 4.37Å; F522-L573 HydrophobicContact CD1-CD1 4.02Å; F522-L573 HydrophobicContact CE1-CD1 3.6Å; R523-L573 HydrophobicContact CG-CB 4.33Å; R523-L573 PolarHBondContact NE-O 3.37Å; R523-L573 PolarHBondContact NH2-O 2.95Å; W526-L573 HydrophobicContact CB-CD1 3.89Å; W526-L573 VanDerWaalsContact CD1-CD1 3.47Å; W526-L573 HydrophobicContact CD2-CD1 4.49Å; W526-L573 HydrophobicContact CG-CD1 3.64Å; W526-L573 HydrophobicContact CG-CG 4.22Å; L571-L573 PolarHBondContact O-N 3.11Å; L571-L573 VanDerWaalsContact O-N 3.12Å; L573-V578 HydrophobicContact CB-CG2 3.97Å; L573-V578 HydrophobicContact CD1-CG2 4.22Å
574	S	86.2	Confident	73.6	Confident	53 Å²	53	55.4 Å²	55.4	37%	0.371	36%	0.359	S	S	.	.			trans	-75.1	146.7	173.8	77.1	0	0	0	0	111.4	S576 L577 V578	S574-S576 VanDerWaalsContact C-N 3.3Å; S574-S576 PolarHBondContact O-N 3.35Å; S574-S576 PolarHBondContact OG-OG 3.11Å; S574-L577 PolarHBondContact O-N 2.94Å; S574-L577 WeakPolarHBondContact OG-CB 3.46Å; S574-L577 PolarHBondContact OG-N 2.9Å; S574-V578 PolarHBondContact O-N 3.31Å
575	Q	86.7	Confident	76.3	Confident	47 Å²	47	50.1 Å²	50.1	22%	0.22	32%	0.322	C	S	.	.	H	α-helix	trans	-58	-44	177.1	-172.8	-176.9	-23.1	0	0	112.4	Y543 N547 L577 V578 L579	Y543-Q575 PolarHBondContact OH-OE1 3.42Å; N547-Q575 PolarHBondContact ND2-OE1 3.18Å; Q575-L577 VanDerWaalsContact C-N 3.29Å; Q575-L577 PolarHBondContact O-N 3.47Å; Q575-V578 PolarHBondContact O-N 3.16Å; Q575-L579 HydrophobicContact CG-CD1 3.93Å; Q575-L579 HydrophobicContact CG-CG 4.37Å; Q575-L579 WeakPolarHBondContact O-CB 3.41Å; Q575-L579 WeakPolarHBondContact O-CG 3.24Å; Q575-L579 PolarHBondContact O-N 3.3Å
576	S	87.1	Confident	79	Confident	86 Å²	86	48.3 Å²	48.3	60%	0.601	30%	0.302	S	S	*	.	H	α-helix	trans	-63.3	-37.8	-178.2	54.9	0	0	0	0	111.6	S574 S580	S574-S576 VanDerWaalsContact C-N 3.3Å; S574-S576 PolarHBondContact O-N 3.35Å; S574-S576 PolarHBondContact OG-OG 3.11Å; S576-S580 VanDerWaalsContact O-CB 3.29Å; S576-S580 WeakPolarHBondContact O-CB 3.38Å; S576-S580 PolarHBondContact O-N 3Å
577	L	90.2	Very high	81.2	Confident	35 Å²	35	49.9 Å²	49.9	18%	0.183	31%	0.311	C	S	.	.	H	α-helix	trans	-64.3	-46.9	176.6	178.6	59.2	0	0	0	111.5	K494 I496 S574 Q575 S580 K581	K494-L577 WeakPolarHBondContact O-CD1 3.42Å; K494-L577 VanDerWaalsContact O-CD2 3.26Å; K494-L577 WeakPolarHBondContact O-CD2 3.43Å; I496-L577 HydrophobicContact CG1-CD1 4.4Å; I496-L577 HydrophobicContact CG1-CD2 4.13Å; I496-L577 HydrophobicContact CG1-CG 3.85Å; S574-L577 PolarHBondContact O-N 2.94Å; S574-L577 WeakPolarHBondContact OG-CB 3.46Å; S574-L577 PolarHBondContact OG-N 2.9Å; Q575-L577 VanDerWaalsContact C-N 3.29Å; Q575-L577 PolarHBondContact O-N 3.47Å; L577-S580 PolarHBondContact O-N 2.91Å; L577-K581 WeakPolarHBondContact O-CB 3.31Å; L577-K581 PolarHBondContact O-N 2.9Å
578	V	93.4	Very high	83.5	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-64.7	-43	178.9	-178.4	0	0	0	0	111.6	I496 F504 A519 F522 R523 L573 S574 Q575 K581 L582	I496-V578 HydrophobicContact CD1-CG2 4.17Å; F504-V578 HydrophobicContact CE2-CG1 3.73Å; F504-V578 HydrophobicContact CZ-CG1 3.74Å; A519-V578 HydrophobicContact CB-CB 4.23Å; A519-V578 HydrophobicContact CB-CG1 3.82Å; F522-V578 HydrophobicContact CB-CG1 4.29Å; F522-V578 HydrophobicContact CD1-CG1 3.88Å; F522-V578 HydrophobicContact CD1-CG2 4.09Å; R523-V578 HydrophobicContact CG-CG2 3.92Å; L573-V578 HydrophobicContact CB-CG2 3.97Å; L573-V578 HydrophobicContact CD1-CG2 4.22Å; S574-V578 PolarHBondContact O-N 3.31Å; Q575-V578 PolarHBondContact O-N 3.16Å; V578-K581 PolarHBondContact O-N 2.68Å; V578-L582 WeakPolarHBondContact O-CB 3.34Å; V578-L582 PolarHBondContact O-N 3.06Å
579	L	94.8	Very high	85.2	Confident	36 Å²	36	53.9 Å²	53.9	19%	0.188	32%	0.319	C	S	.	.	H	α-helix	trans	-64.6	-40.6	176.5	-73.8	174	0	0	0	112.8	K515 A519 Q575 K581 L582 A583	K515-L579 HydrophobicContact CB-CD2 3.92Å; K515-L579 HydrophobicContact CD-CD2 4.43Å; K515-L579 HydrophobicContact CG-CD2 4.02Å; K515-L579 WeakPolarHBondContact O-CD2 3.42Å; A519-L579 HydrophobicContact CB-CD2 3.79Å; A519-L579 HydrophobicContact CB-CG 3.99Å; Q575-L579 HydrophobicContact CG-CD1 3.93Å; Q575-L579 HydrophobicContact CG-CG 4.37Å; Q575-L579 WeakPolarHBondContact O-CB 3.41Å; Q575-L579 WeakPolarHBondContact O-CG 3.24Å; Q575-L579 PolarHBondContact O-N 3.3Å; L579-K581 VanDerWaalsContact C-N 3.35Å; L579-L582 PolarHBondContact O-N 3.33Å; L579-A583 PolarHBondContact O-N 3.3Å; L579-A583 VanDerWaalsContact O-N 3.12Å
580	S	91.9	Very high	86.7	Confident	77 Å²	77	56.1 Å²	56.1	54%	0.538	33%	0.325	S	S	.	.	H	α-helix	trans	-63.6	-44.3	175.8	-170.8	0	0	0	0	110.5	S576 L577 A583 E584	S576-S580 VanDerWaalsContact O-CB 3.29Å; S576-S580 WeakPolarHBondContact O-CB 3.38Å; S576-S580 PolarHBondContact O-N 3Å; L577-S580 PolarHBondContact O-N 2.91Å; S580-A583 PolarHBondContact O-N 3.43Å; S580-E584 PolarHBondContact O-N 2.89Å
581	K	94.2	Very high	88.1	Confident	36 Å²	36	53.9 Å²	53.9	16%	0.157	32%	0.316	C	S	.	.	H	α-helix	trans	-67.2	-38.6	179.2	-166	57.1	172.6	180	0	111.8	I496 M501 F504 L577 V578 L579 A583 E584 I585	I496-K581 HydrophobicContact CD1-CB 3.48Å; I496-K581 VanDerWaalsContact CD1-CB 3.48Å; I496-K581 HydrophobicContact CD1-CG 3.67Å; I496-K581 HydrophobicContact CG1-CB 4.17Å; I496-K581 HydrophobicContact CG1-CG 4.24Å; M501-K581 HydrophobicContact CE-CG 4.07Å; M501-K581 VanDerWaalsContact SD-CE 3.51Å; M501-K581 HydrophobicContact SD-CG 4.31Å; F504-K581 HydrophobicContact CD1-CG 4.44Å; F504-K581 HydrophobicContact CE1-CB 4.16Å; F504-K581 HydrophobicContact CE1-CG 4.08Å; L577-K581 WeakPolarHBondContact O-CB 3.31Å; L577-K581 PolarHBondContact O-N 2.9Å; V578-K581 PolarHBondContact O-N 2.68Å; L579-K581 VanDerWaalsContact C-N 3.35Å; K581-A583 VanDerWaalsContact C-N 3.33Å; K581-A583 PolarHBondContact O-N 3Å; K581-E584 HydrophobicContact CD-CB 4.48Å; K581-E584 VanDerWaalsContact CD-OE2 3.24Å; K581-E584 WeakPolarHBondContact CD-OE2 3.44Å; K581-E584 IonicContact NZ-OE1 3.12Å; K581-E584 PolarHBondContact NZ-OE1 3.19Å; K581-E584 IonicContact NZ-OE2 3.69Å; K581-E584 PolarHBondContact NZ-OE2 3.44Å; K581-E584 VanDerWaalsContact NZ-OE2 3.12Å; K581-E584 WeakPolarHBondContact O-CB 3.48Å; K581-E584 PolarHBondContact O-N 2.97Å; K581-I585 HydrophobicContact CD-CG2 3.96Å; K581-I585 HydrophobicContact CG-CG2 4.23Å; K581-I585 WeakPolarHBondContact O-CG1 3.42Å; K581-I585 WeakPolarHBondContact O-CG2 3.44Å; K581-I585 PolarHBondContact O-N 2.91Å
582	L	94.3	Very high	89.4	Confident	3 Å²	3	59.4 Å²	59.4	2%	0.016	34%	0.336	C	S	.	.	H	α-helix	trans	-56.1	-48.1	174.5	-167.4	149.7	0	0	0	111.5	F504 V508 K515 L518 V578 L579 E584 I585 A586 W593	F504-L582 HydrophobicContact CE1-CB 4.33Å; F504-L582 HydrophobicContact CZ-CB 3.82Å; F504-L582 HydrophobicContact CZ-CD1 4.27Å; F504-L582 HydrophobicContact CZ-CG 4.28Å; V508-L582 HydrophobicContact CG2-CD1 4.36Å; K515-L582 HydrophobicContact CB-CD1 4.46Å; K515-L582 HydrophobicContact CB-CD2 4.19Å; L518-L582 HydrophobicContact CB-CD1 3.71Å; L518-L582 HydrophobicContact CD1-CD1 3.86Å; L518-L582 HydrophobicContact CG-CD1 4.44Å; V578-L582 WeakPolarHBondContact O-CB 3.34Å; V578-L582 PolarHBondContact O-N 3.06Å; L579-L582 PolarHBondContact O-N 3.33Å; L582-E584 VanDerWaalsContact C-N 3.3Å; L582-E584 PolarHBondContact O-N 3.01Å; L582-I585 PolarHBondContact O-N 3.22Å; L582-A586 PolarHBondContact O-N 3.25Å; L582-A586 VanDerWaalsContact O-N 3.08Å; L582-W593 HydrophobicContact CD2-CD2 4.12Å; L582-W593 HydrophobicContact CD2-CE3 3.7Å; L582-W593 HydrophobicContact CD2-CH2 3.15Å; L582-W593 HydrophobicContact CD2-CZ2 3.61Å; L582-W593 HydrophobicContact CD2-CZ3 3.2Å; L582-W593 HydrophobicContact CG-CZ3 4.47Å
583	A	91.9	Very high	90.6	Very high	74 Å²	74	57.1 Å²	57.1	61%	0.612	32%	0.318	S	S	*	.	H	α-helix	trans	-69.8	-26.3	179.4	0	0	0	0	0	113.4	L579 S580 K581	L579-A583 PolarHBondContact O-N 3.3Å; L579-A583 VanDerWaalsContact O-N 3.12Å; S580-A583 PolarHBondContact O-N 3.43Å; K581-A583 VanDerWaalsContact C-N 3.33Å; K581-A583 PolarHBondContact O-N 3Å
584	E	92.9	Very high	91	Very high	112 Å²	112	58.8 Å²	58.8	52%	0.523	33%	0.326	S	S	.	.	H	α-helix	trans	-72.4	-41.1	173.9	-172.7	-164.1	137.8	0	0	111.4	S580 K581 L582	S580-E584 PolarHBondContact O-N 2.89Å; K581-E584 HydrophobicContact CD-CB 4.48Å; K581-E584 VanDerWaalsContact CD-OE2 3.24Å; K581-E584 WeakPolarHBondContact CD-OE2 3.44Å; K581-E584 IonicContact NZ-OE1 3.12Å; K581-E584 PolarHBondContact NZ-OE1 3.19Å; K581-E584 IonicContact NZ-OE2 3.69Å; K581-E584 PolarHBondContact NZ-OE2 3.44Å; K581-E584 VanDerWaalsContact NZ-OE2 3.12Å; K581-E584 WeakPolarHBondContact O-CB 3.48Å; K581-E584 PolarHBondContact O-N 2.97Å; L582-E584 VanDerWaalsContact C-N 3.3Å; L582-E584 PolarHBondContact O-N 3.01Å
585	I	92.7	Very high	91.3	Very high	2 Å²	2	56.2 Å²	56.2	1%	0.01	31%	0.308	C	S	.	.	H	α-helix	trans	-95.4	-21.9	-168.2	74.1	175.5	0	0	0	115.8	F504 K581 L582 N596 I599	F504-I585 HydrophobicContact CD1-CD1 3.37Å; F504-I585 HydrophobicContact CE1-CD1 3.55Å; F504-I585 HydrophobicContact CE1-CG1 4.35Å; F504-I585 HydrophobicContact CG-CD1 4.41Å; K581-I585 HydrophobicContact CD-CG2 3.96Å; K581-I585 HydrophobicContact CG-CG2 4.23Å; K581-I585 WeakPolarHBondContact O-CG1 3.42Å; K581-I585 WeakPolarHBondContact O-CG2 3.44Å; K581-I585 PolarHBondContact O-N 2.91Å; L582-I585 PolarHBondContact O-N 3.22Å; I585-N596 PolarHBondContact O-N 3.25Å; I585-I599 HydrophobicContact CB-CD1 3.49Å; I585-I599 VanDerWaalsContact CB-CD1 3.49Å; I585-I599 HydrophobicContact CB-CG2 4.28Å; I585-I599 HydrophobicContact CG2-CD1 3.67Å; I585-I599 HydrophobicContact CG2-CG2 4.34Å
586	A	92.6	Very high	91.5	Very high	4 Å²	4	57 Å²	57	3%	0.033	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	148	-170.8	0	0	0	0	0	112	V508 L582 W593 I594 V595	V508-A586 HydrophobicContact CG1-CB 3.62Å; L582-A586 PolarHBondContact O-N 3.25Å; L582-A586 VanDerWaalsContact O-N 3.08Å; A586-W593 HydrophobicContact CB-CE3 3.84Å; A586-I594 CarbonylContact C-O 3.5Å; A586-I594 WeakPolarHBondContact CA-O 3.29Å; A586-I594 WeakPolarHBondContact CB-O 3.38Å; A586-V595 HydrophobicContact CB-CG2 4.24Å
587	V	92.1	Very high	91.3	Very high	76 Å²	76	54.6 Å²	54.6	46%	0.461	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	139.5	174.7	-173	0	0	0	0	108.4	T589 I594	V587-T589 HydrophobicContact CG1-CG2 3.84Å; V587-I594 PolarHBondContact N-O 3.42Å; V587-I594 PolarHBondContact O-N 3.49Å
588	F	93.4	Very high	91.3	Very high	100 Å²	100	60.5 Å²	60.5	44%	0.439	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	106.8	175.7	-171.3	-103.5	0	0	0	109.7	G591 R592 W593	F588-G591 VanDerWaalsContact CE2-C 3.45Å; F588-G591 WeakPolarHBondContact CE2-O 3.19Å; F588-G591 VanDerWaalsContact CZ-CA 3.49Å; F588-G591 WeakPolarHBondContact CZ-O 3.44Å; F588-R592 CarbonylContact C-O 3.54Å; F588-R592 WeakPolarHBondContact CA-O 3.37Å; F588-R592 WeakPolarHBondContact CD2-O 3.48Å; F588-W593 HydrophobicContact CB-CD2 4.08Å; F588-W593 HydrophobicContact CB-CE3 4.01Å; F588-W593 HydrophobicContact CB-CH2 4Å; F588-W593 HydrophobicContact CB-CZ2 4.08Å; F588-W593 HydrophobicContact CB-CZ3 3.97Å; F588-W593 AromaticContact CD2-CD1 3.59Å; F588-W593 AromaticContact CD2-CD2 3.81Å; F588-W593 HydrophobicContact CD2-CD2 3.81Å; F588-W593 AromaticContact CD2-CE2 3.58Å; F588-W593 AromaticContact CD2-CG 3.81Å; F588-W593 HydrophobicContact CD2-CG 3.81Å; F588-W593 HydrophobicContact CD2-CZ2 4.16Å; F588-W593 AromaticContact CD2-NE1 3.45Å; F588-W593 AromaticContact CE2-CD1 3.95Å; F588-W593 AromaticContact CE2-NE1 3.85Å; F588-W593 HydrophobicContact CG-CD2 4.42Å; F588-W593 HydrophobicContact CG-CZ2 4.38Å
589	T	87.3	Confident	91.1	Very high	57 Å²	57	61.8 Å²	61.8	35%	0.35	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	142.9	-179.1	55.4	0	0	0	0	109.9	V587 G591 R592 I594	V587-T589 HydrophobicContact CG1-CG2 3.84Å; T589-G591 PolarHBondContact O-N 3.38Å; T589-R592 PolarHBondContact N-O 2.92Å; T589-R592 PolarHBondContact O-N 3.15Å; T589-I594 WeakPolarHBondContact OG1-CD1 3.41Å; T589-I594 WeakPolarHBondContact OG1-CG1 3.46Å
590	E	85.3	Confident	90.6	Very high	195 Å²	195	60.1 Å²	60.1	91%	0.911	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	30.9	176.1	-56.2	-179.6	178.7	0	0	114.7	R592	E590-R592 VanDerWaalsContact C-N 3.31Å; E590-R592 PolarHBondContact O-N 3.16Å
591	G	88	Confident	90.3	Very high	40 Å²	40	62.6 Å²	62.6	41%	0.412	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.6	10	-179.7	0	0	0	0	0	114.7	F588 T589	F588-G591 VanDerWaalsContact CE2-C 3.45Å; F588-G591 WeakPolarHBondContact CE2-O 3.19Å; F588-G591 VanDerWaalsContact CZ-CA 3.49Å; F588-G591 WeakPolarHBondContact CZ-O 3.44Å; T589-G591 PolarHBondContact O-N 3.38Å
592	R	90.6	Very high	90.1	Very high	129 Å²	129	68 Å²	68	49%	0.487	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	153.5	179	-62.1	-177.4	-176.9	-82.3	-2	111.3	R510 S511 F588 T589 E590	R510-R592 PolarHBondContact O-NH1 3.32Å; S511-R592 WeakPolarHBondContact O-CA 3.42Å; F588-R592 CarbonylContact C-O 3.54Å; F588-R592 WeakPolarHBondContact CA-O 3.37Å; F588-R592 WeakPolarHBondContact CD2-O 3.48Å; T589-R592 PolarHBondContact N-O 2.92Å; T589-R592 PolarHBondContact O-N 3.15Å; E590-R592 VanDerWaalsContact C-N 3.31Å; E590-R592 PolarHBondContact O-N 3.16Å
593	W	93.6	Very high	89.9	Confident	28 Å²	28	68.7 Å²	68.7	11%	0.106	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	128.9	170.9	-71.8	93.9	0	0	0	110.6	V508 R510 S511 L513 K515 L518 L582 A586 F588	V508-W593 HydrophobicContact CG1-CB 3.79Å; V508-W593 HydrophobicContact CG1-CG 4.26Å; V508-W593 WeakPolarHBondContact O-CB 3.43Å; R510-W593 WeakPolarHBondContact CA-O 3.44Å; R510-W593 PolarHBondContact N-O 3.46Å; S511-W593 PolarHBondContact O-N 3.02Å; L513-W593 PolarHBondContact O-NE1 3.2Å; K515-W593 HydrophobicContact CB-CH2 4.38Å; K515-W593 HydrophobicContact CB-CZ2 3.9Å; L518-W593 HydrophobicContact CD1-CD2 4.31Å; L518-W593 HydrophobicContact CD1-CG 3.99Å; L582-W593 HydrophobicContact CD2-CD2 4.12Å; L582-W593 HydrophobicContact CD2-CE3 3.7Å; L582-W593 HydrophobicContact CD2-CH2 3.15Å; L582-W593 HydrophobicContact CD2-CZ2 3.61Å; L582-W593 HydrophobicContact CD2-CZ3 3.2Å; L582-W593 HydrophobicContact CG-CZ3 4.47Å; A586-W593 HydrophobicContact CB-CE3 3.84Å; F588-W593 HydrophobicContact CB-CD2 4.08Å; F588-W593 HydrophobicContact CB-CE3 4.01Å; F588-W593 HydrophobicContact CB-CH2 4Å; F588-W593 HydrophobicContact CB-CZ2 4.08Å; F588-W593 HydrophobicContact CB-CZ3 3.97Å; F588-W593 AromaticContact CD2-CD1 3.59Å; F588-W593 AromaticContact CD2-CD2 3.81Å; F588-W593 HydrophobicContact CD2-CD2 3.81Å; F588-W593 AromaticContact CD2-CE2 3.58Å; F588-W593 AromaticContact CD2-CG 3.81Å; F588-W593 HydrophobicContact CD2-CG 3.81Å; F588-W593 HydrophobicContact CD2-CZ2 4.16Å; F588-W593 AromaticContact CD2-NE1 3.45Å; F588-W593 AromaticContact CE2-CD1 3.95Å; F588-W593 AromaticContact CE2-NE1 3.85Å; F588-W593 HydrophobicContact CG-CD2 4.42Å; F588-W593 HydrophobicContact CG-CZ2 4.38Å
594	I	91.2	Very high	89.5	Confident	44 Å²	44	65.5 Å²	65.5	23%	0.226	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	124.7	174	-55.3	-171.2	0	0	0	107.9	A586 V587 T589	A586-I594 CarbonylContact C-O 3.5Å; A586-I594 WeakPolarHBondContact CA-O 3.29Å; A586-I594 WeakPolarHBondContact CB-O 3.38Å; V587-I594 PolarHBondContact N-O 3.42Å; V587-I594 PolarHBondContact O-N 3.49Å; T589-I594 WeakPolarHBondContact OG1-CD1 3.41Å; T589-I594 WeakPolarHBondContact OG1-CG1 3.46Å
595	V	92.1	Very high	89	Confident	0 Å²	0	64 Å²	64	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	135.5	177.4	178.7	0	0	0	0	108.5	I505 V508 H509 A586 A597 I599 L600	I505-V595 HydrophobicContact CG1-CG1 4.37Å; I505-V595 HydrophobicContact CG2-CG2 4.41Å; V508-V595 HydrophobicContact CB-CG2 4.43Å; V508-V595 HydrophobicContact CG1-CG2 4.1Å; H509-V595 HydrophobicContact CB-CG2 4Å; A586-V595 HydrophobicContact CB-CG2 4.24Å; V595-A597 PolarHBondContact O-N 2.96Å; V595-I599 HydrophobicContact CG1-CB 4.14Å; V595-I599 HydrophobicContact CG1-CG2 4.07Å; V595-L600 HydrophobicContact CB-CD2 4.26Å; V595-L600 HydrophobicContact CB-CG 4.26Å; V595-L600 HydrophobicContact CG1-CD2 4.09Å; V595-L600 HydrophobicContact CG1-CG 4.01Å
596	N	90.9	Very high	88.7	Confident	62 Å²	62	68.7 Å²	68.7	33%	0.332	35%	0.346	S	S	.	.			trans	-59.2	137.5	-179	-65.3	-23.3	0	0	0	111.1	I585 E598 I599 L600	I585-N596 PolarHBondContact O-N 3.25Å; N596-E598 VanDerWaalsContact C-N 3.27Å; N596-E598 PolarHBondContact O-N 3.07Å; N596-I599 HydrophobicContact CB-CD1 4.11Å; N596-I599 HydrophobicContact CB-CG1 4.29Å; N596-I599 WeakPolarHBondContact O-CB 3.46Å; N596-I599 PolarHBondContact O-N 2.95Å; N596-L600 PolarHBondContact O-N 2.88Å; N596-L600 VanDerWaalsContact O-N 3.15Å
597	A	84.9	Confident	88.2	Confident	37 Å²	37	68.6 Å²	68.6	31%	0.306	35%	0.345	S	S	.	.	H	α-helix	trans	-56.7	-38.4	-176.7	0	0	0	0	0	113.2	V595 I599 L600 Q601	V595-A597 PolarHBondContact O-N 2.96Å; A597-I599 PolarHBondContact O-N 3.28Å; A597-L600 PolarHBondContact O-N 2.86Å; A597-Q601 PolarHBondContact O-N 3.49Å
598	E	88.6	Confident	87.7	Confident	159 Å²	159	66 Å²	66	74%	0.743	33%	0.33	S	S	*	.	H	α-helix	trans	-58.6	-33.9	176.4	-63.8	172.9	-167.4	0	0	112.5	N596 K602	N596-E598 VanDerWaalsContact C-N 3.27Å; N596-E598 PolarHBondContact O-N 3.07Å; E598-K602 WeakPolarHBondContact O-CB 3.46Å; E598-K602 PolarHBondContact O-N 3.38Å
599	I	89.6	Confident	87.1	Confident	26 Å²	26	67.4 Å²	67.4	13%	0.133	34%	0.342	C	S	.	.	H	α-helix	trans	-81	-38.5	-178.4	-61	176.8	0	0	0	110.3	I505 I585 V595 N596 A597 Q601 K602 Y603	I505-I599 HydrophobicContact CD1-CG2 4.16Å; I585-I599 HydrophobicContact CB-CD1 3.49Å; I585-I599 VanDerWaalsContact CB-CD1 3.49Å; I585-I599 HydrophobicContact CB-CG2 4.28Å; I585-I599 HydrophobicContact CG2-CD1 3.67Å; I585-I599 HydrophobicContact CG2-CG2 4.34Å; V595-I599 HydrophobicContact CG1-CB 4.14Å; V595-I599 HydrophobicContact CG1-CG2 4.07Å; N596-I599 HydrophobicContact CB-CD1 4.11Å; N596-I599 HydrophobicContact CB-CG1 4.29Å; N596-I599 WeakPolarHBondContact O-CB 3.46Å; N596-I599 PolarHBondContact O-N 2.95Å; A597-I599 PolarHBondContact O-N 3.28Å; I599-Q601 VanDerWaalsContact C-N 3.29Å; I599-Q601 PolarHBondContact O-N 3.42Å; I599-K602 PolarHBondContact O-N 3.39Å; I599-Y603 HydrophobicContact CG2-CD2 3.9Å; I599-Y603 HydrophobicContact CG2-CE2 4.11Å; I599-Y603 WeakPolarHBondContact O-CD2 3.5Å; I599-Y603 PolarHBondContact O-N 2.82Å
600	L	84.9	Confident	86.8	Confident	1 Å²	1	67.1 Å²	67.1	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-59.3	-42.5	170.1	-69.6	174.4	0	0	0	111	I505 V595 N596 A597 Y603 A604 F632 L635 F637	I505-L600 HydrophobicContact CG2-CD2 3.55Å; V595-L600 HydrophobicContact CB-CD2 4.26Å; V595-L600 HydrophobicContact CB-CG 4.26Å; V595-L600 HydrophobicContact CG1-CD2 4.09Å; V595-L600 HydrophobicContact CG1-CG 4.01Å; N596-L600 PolarHBondContact O-N 2.88Å; N596-L600 VanDerWaalsContact O-N 3.15Å; A597-L600 PolarHBondContact O-N 2.86Å; L600-Y603 CarbonylContact O-C 3.45Å; L600-Y603 PolarHBondContact O-N 3.48Å; L600-A604 WeakPolarHBondContact O-CA 3.47Å; L600-A604 WeakPolarHBondContact O-CB 3.46Å; L600-A604 PolarHBondContact O-N 2.65Å; L600-F632 HydrophobicContact CB-CD1 4.18Å; L600-F632 HydrophobicContact CD1-CB 4.17Å; L600-F632 HydrophobicContact CD1-CD1 4.33Å; L600-L635 HydrophobicContact CD1-CD1 4.44Å; L600-F637 HydrophobicContact CD2-CZ 4.37Å
601	Q	85.8	Confident	86.1	Confident	130 Å²	130	58.5 Å²	58.5	61%	0.607	30%	0.3	S	S	*	.	H	α-helix	trans	-64.9	-45	176.1	-169.2	177.5	14.6	0	0	111.7	A597 I599 Y603 A604	A597-Q601 PolarHBondContact O-N 3.49Å; I599-Q601 VanDerWaalsContact C-N 3.29Å; I599-Q601 PolarHBondContact O-N 3.42Å; Q601-Y603 VanDerWaalsContact C-N 3.29Å; Q601-Y603 PolarHBondContact O-N 3.07Å; Q601-A604 WeakPolarHBondContact O-CB 3.47Å; Q601-A604 PolarHBondContact O-N 2.98Å
602	K	90.4	Very high	85.2	Confident	149 Å²	149	63.3 Å²	63.3	65%	0.648	32%	0.316	S	S	*	.	H	α-helix	trans	-58.5	-38.4	178.5	-178.5	175.8	178.3	175.6	0	113.1	E598 I599	E598-K602 WeakPolarHBondContact O-CB 3.46Å; E598-K602 PolarHBondContact O-N 3.38Å; I599-K602 PolarHBondContact O-N 3.39Å
603	Y	88.9	Confident	83.9	Confident	17 Å²	17	58.4 Å²	58.4	7%	0.067	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	13.6	-178.9	-63.2	-74.6	0	0	0	113.4	M501 I505 I599 L600 Q601 S605 R606 V607	M501-Y603 HydrophobicContact CB-CD1 3.97Å; M501-Y603 HydrophobicContact CB-CD2 4.35Å; M501-Y603 HydrophobicContact CB-CE1 3.74Å; M501-Y603 HydrophobicContact CB-CE2 4.13Å; M501-Y603 HydrophobicContact CB-CG 4.27Å; M501-Y603 HydrophobicContact CG-CE1 3.98Å; M501-Y603 HydrophobicContact CG-CE2 4.25Å; I505-Y603 HydrophobicContact CD1-CD2 3.84Å; I505-Y603 HydrophobicContact CD1-CG 4.1Å; I599-Y603 HydrophobicContact CG2-CD2 3.9Å; I599-Y603 HydrophobicContact CG2-CE2 4.11Å; I599-Y603 WeakPolarHBondContact O-CD2 3.5Å; I599-Y603 PolarHBondContact O-N 2.82Å; L600-Y603 CarbonylContact O-C 3.45Å; L600-Y603 PolarHBondContact O-N 3.48Å; Q601-Y603 VanDerWaalsContact C-N 3.29Å; Q601-Y603 PolarHBondContact O-N 3.07Å; Y603-S605 PolarHBondContact O-N 3.38Å; Y603-R606 PolarHBondContact O-N 3.42Å; Y603-V607 WeakPolarHBondContact O-CB 3.27Å; Y603-V607 WeakPolarHBondContact O-CG2 3.37Å; Y603-V607 PolarHBondContact O-N 3.26Å
604	A	83.3	Confident	82	Confident	8 Å²	8	65.4 Å²	65.4	7%	0.066	33%	0.333	C	S	.	.	H	α-helix	trans	-53.3	-50.7	-171.8	0	0	0	0	0	112.3	L600 Q601 R606 V607 C608	L600-A604 WeakPolarHBondContact O-CA 3.47Å; L600-A604 WeakPolarHBondContact O-CB 3.46Å; L600-A604 PolarHBondContact O-N 2.65Å; Q601-A604 WeakPolarHBondContact O-CB 3.47Å; Q601-A604 PolarHBondContact O-N 2.98Å; A604-R606 PolarHBondContact O-N 3.08Å; A604-V607 PolarHBondContact O-N 2.94Å; A604-C608 WeakPolarHBondContact O-CB 3.39Å; A604-C608 PolarHBondContact O-N 2.99Å; A604-C608 PolarHBondContact O-SG 2.96Å
605	S	83	Confident	80.3	Confident	81 Å²	81	71.1 Å²	71.1	57%	0.566	36%	0.359	S	S	*	.	H	α-helix	trans	-60.9	-40.7	179.5	-48.5	0	0	0	0	112.8	Y603 N609	Y603-S605 PolarHBondContact O-N 3.38Å; S605-N609 WeakPolarHBondContact O-CB 3.46Å; S605-N609 PolarHBondContact O-N 2.94Å; S605-N609 VanDerWaalsContact O-N 3.12Å; S605-N609 PolarHBondContact O-ND2 3.01Å; S605-N609 PolarHBondContact O-OD1 3.28Å
606	R	85.3	Confident	78.3	Confident	100 Å²	100	71.5 Å²	71.5	38%	0.377	36%	0.361	S	S	.	.	H	α-helix	trans	-69.5	-39.4	178.4	-67.9	-171.4	179.1	146.1	2.6	111.4	E498 A502 Y603 A604 N609 L610	E498-R606 PolarHBondContact O-NH1 3.49Å; E498-R606 VanDerWaalsContact O-NH1 3.15Å; E498-R606 IonicContact OE2-CZ 3.58Å; E498-R606 IonicContact OE2-NH1 3.12Å; E498-R606 PolarHBondContact OE2-NH1 3.42Å; E498-R606 VanDerWaalsContact OE2-NH1 3.12Å; E498-R606 IonicContact OE2-NH2 3.01Å; E498-R606 PolarHBondContact OE2-NH2 2.95Å; A502-R606 HydrophobicContact CB-CB 4.07Å; Y603-R606 PolarHBondContact O-N 3.42Å; A604-R606 PolarHBondContact O-N 3.08Å; R606-N609 PolarHBondContact O-N 3.46Å; R606-L610 WeakPolarHBondContact O-CB 3.48Å; R606-L610 PolarHBondContact O-N 3.48Å
607	V	83.8	Confident	76.3	Confident	1 Å²	1	72.3 Å²	72.3	1%	0.006	37%	0.371	C	S	.	.	H	α-helix	trans	-68.7	-40.3	177.6	173	0	0	0	0	111.4	A502 I505 Y603 A604 N609 L610 C611 L616 F637	A502-V607 HydrophobicContact CB-CG2 4.21Å; I505-V607 HydrophobicContact CB-CG2 4.46Å; I505-V607 HydrophobicContact CD1-CG2 4.11Å; I505-V607 HydrophobicContact CG2-CG2 4.25Å; Y603-V607 WeakPolarHBondContact O-CB 3.27Å; Y603-V607 WeakPolarHBondContact O-CG2 3.37Å; Y603-V607 PolarHBondContact O-N 3.26Å; A604-V607 PolarHBondContact O-N 2.94Å; V607-N609 PolarHBondContact O-N 3.46Å; V607-L610 PolarHBondContact O-N 3.39Å; V607-C611 PolarHBondContact O-N 3.3Å; V607-L616 HydrophobicContact CB-CD1 4.21Å; V607-L616 HydrophobicContact CG1-CD1 3.73Å; V607-F637 HydrophobicContact CG1-CD1 4.37Å; V607-F637 HydrophobicContact CG1-CE1 3.26Å; V607-F637 HydrophobicContact CG1-CZ 3.72Å
608	C	81.2	Confident	74.1	Confident	22 Å²	22	74 Å²	74	15%	0.149	39%	0.392	C	S	.	.	H	α-helix	trans	-55.5	-50.3	171.4	-78.7	0	0	0	0	112.1	A604 L610 N612 I613 L616	A604-C608 WeakPolarHBondContact O-CB 3.39Å; A604-C608 PolarHBondContact O-N 2.99Å; A604-C608 PolarHBondContact O-SG 2.96Å; C608-L610 VanDerWaalsContact C-N 3.27Å; C608-L610 PolarHBondContact O-N 3.03Å; C608-N612 WeakPolarHBondContact O-CA 3.44Å; C608-N612 PolarHBondContact O-N 3.34Å; C608-I613 PolarHBondContact O-N 2.93Å; C608-I613 PolarHBondContact SG-O 3.17Å; C608-L616 WeakPolarHBondContact SG-CB 3.44Å
609	N	81.2	Confident	71.9	Confident	130 Å²	130	68.5 Å²	68.5	70%	0.695	38%	0.378	S	S	*	.	H	α-helix	trans	-66.5	-32.2	-177.5	-68.4	-12.2	0	0	0	111.8	S605 R606 V607	S605-N609 WeakPolarHBondContact O-CB 3.46Å; S605-N609 PolarHBondContact O-N 2.94Å; S605-N609 VanDerWaalsContact O-N 3.12Å; S605-N609 PolarHBondContact O-ND2 3.01Å; S605-N609 PolarHBondContact O-OD1 3.28Å; R606-N609 PolarHBondContact O-N 3.46Å; V607-N609 PolarHBondContact O-N 3.46Å
610	L	79.7	Confident	69.4	Low	51 Å²	51	73.5 Å²	73.5	27%	0.267	40%	0.404	S	S	.	.	H	α-helix	trans	-74.8	-46.5	179	-168.1	80.7	0	0	0	112.7	A502 Y503 H506 R606 V607 C608	A502-L610 HydrophobicContact CB-CB 4.44Å; A502-L610 HydrophobicContact CB-CD2 4.19Å; Y503-L610 HydrophobicContact CD1-CD1 3.81Å; Y503-L610 HydrophobicContact CD1-CD2 3.63Å; Y503-L610 HydrophobicContact CD1-CG 4.31Å; Y503-L610 HydrophobicContact CE1-CD1 3.15Å; Y503-L610 HydrophobicContact CE1-CD2 3.89Å; Y503-L610 HydrophobicContact CE1-CG 4.05Å; Y503-L610 HydrophobicContact CE2-CD1 3.93Å; Y503-L610 HydrophobicContact CG-CD1 4.45Å; Y503-L610 HydrophobicContact CG-CD2 4.13Å; Y503-L610 WeakPolarHBondContact OH-CD1 3.48Å; H506-L610 HydrophobicContact CB-CD2 4.41Å; R606-L610 WeakPolarHBondContact O-CB 3.48Å; R606-L610 PolarHBondContact O-N 3.48Å; V607-L610 PolarHBondContact O-N 3.39Å; C608-L610 VanDerWaalsContact C-N 3.27Å; C608-L610 PolarHBondContact O-N 3.03Å
611	C	71.6	Confident	67	Low	14 Å²	14	79.1 Å²	79.1	10%	0.095	44%	0.443	C	S	.	.	H	α-helix	trans	-98.6	1.5	-169.9	-58.5	0	0	0	0	113.3	V607 I613 F637 P638	V607-C611 PolarHBondContact O-N 3.3Å; C611-I613 HydrophobicContact CB-CD1 3.52Å; C611-I613 HydrophobicContact CB-CG1 3.64Å; C611-I613 PolarHBondContact O-N 3Å; C611-I613 VanDerWaalsContact O-N 3.17Å; C611-F637 HydrophobicContact CB-CD1 4.24Å; C611-P638 HydrophobicContact CB-CG 4.2Å
612	N	68.1	Low	64.5	Low	141 Å²	141	75.9 Å²	75.9	75%	0.754	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	31.8	-170.4	-75.3	43.1	0	0	0	113.5	C608 Q614	C608-N612 WeakPolarHBondContact O-CA 3.44Å; C608-N612 PolarHBondContact O-N 3.34Å; N612-Q614 PolarHBondContact O-N 2.94Å
613	I	63	Low	61.8	Low	25 Å²	25	77.7 Å²	77.7	13%	0.128	46%	0.461	C	S	.	.			trans	-88.4	105.5	179.6	-60.2	169.9	0	0	0	108.7	C608 C611 Q615 F637	C608-I613 PolarHBondContact O-N 2.93Å; C608-I613 PolarHBondContact SG-O 3.17Å; C611-I613 HydrophobicContact CB-CD1 3.52Å; C611-I613 HydrophobicContact CB-CG1 3.64Å; C611-I613 PolarHBondContact O-N 3Å; C611-I613 VanDerWaalsContact O-N 3.17Å; I613-Q615 VanDerWaalsContact C-N 3.26Å; I613-Q615 HydrophobicContact CG2-CB 4.12Å; I613-Q615 PolarHBondContact O-N 3.39Å; I613-F637 HydrophobicContact CD1-CD1 3.56Å; I613-F637 HydrophobicContact CD1-CE1 3.74Å
614	Q	54.5	Low	59.4	Low	175 Å²	175	80.7 Å²	80.7	82%	0.818	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-70.1	-20.8	178.8	-66.5	179.2	-1	0	0	113.3	N612 L616 S617	N612-Q614 PolarHBondContact O-N 2.94Å; Q614-L616 PolarHBondContact O-N 3Å; Q614-S617 PolarHBondContact O-OG 3.34Å; Q614-S617 VanDerWaalsContact O-OG 3.06Å
615	Q	55.2	Low	57.5	Low	164 Å²	164	88.8 Å²	88.8	77%	0.766	53%	0.527	S	S	*	.	G	3₁₀ helix	trans	-73.3	-19.9	-168.8	-100.1	176.3	-8.9	0	0	116.3	I613 S617 G618	I613-Q615 VanDerWaalsContact C-N 3.26Å; I613-Q615 HydrophobicContact CG2-CB 4.12Å; I613-Q615 PolarHBondContact O-N 3.39Å; Q615-S617 VanDerWaalsContact C-N 3.29Å; Q615-S617 PolarHBondContact O-N 3.47Å; Q615-G618 PolarHBondContact O-N 3.49Å
616	L	50.4	Low	55.6	Low	8 Å²	8	93.3 Å²	93.3	4%	0.042	54%	0.537	C	S	.	.	G	3₁₀ helix	trans	-73	-21.3	-177.7	-90.6	165.9	0	0	0	112.8	V607 C608 Q614 G618 F632 L635	V607-L616 HydrophobicContact CB-CD1 4.21Å; V607-L616 HydrophobicContact CG1-CD1 3.73Å; C608-L616 WeakPolarHBondContact SG-CB 3.44Å; Q614-L616 PolarHBondContact O-N 3Å; L616-G618 VanDerWaalsContact C-N 3.28Å; L616-G618 PolarHBondContact O-N 3.09Å; L616-F632 HydrophobicContact CD2-CD1 3.93Å; L616-F632 HydrophobicContact CD2-CE1 3.55Å; L616-L635 HydrophobicContact CD2-CD1 3.51Å; L616-L635 HydrophobicContact CD2-CD2 4.46Å; L616-L635 HydrophobicContact CG-CD1 4.05Å; L616-L635 HydrophobicContact CG-CD2 4.28Å
617	S	48	Very low	53.8	Low	80 Å²	80	92.7 Å²	92.7	56%	0.559	54%	0.543	S	S	*	.	G	3₁₀ helix	trans	-74.1	-16.2	179.6	66.8	0	0	0	0	114	Q614 Q615 G619 I620	Q614-S617 PolarHBondContact O-OG 3.34Å; Q614-S617 VanDerWaalsContact O-OG 3.06Å; Q615-S617 VanDerWaalsContact C-N 3.29Å; Q615-S617 PolarHBondContact O-N 3.47Å; S617-G619 PolarHBondContact O-N 3.37Å; S617-G619 VanDerWaalsContact O-N 3.09Å; S617-I620 PolarHBondContact O-N 3.01Å
618	G	40.7	Very low	52.3	Low	72 Å²	72	96.9 Å²	96.9	74%	0.742	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-68.1	-6.7	-176.4	0	0	0	0	0	115.7	Q615 L616	Q615-G618 PolarHBondContact O-N 3.49Å; L616-G618 VanDerWaalsContact C-N 3.28Å; L616-G618 PolarHBondContact O-N 3.09Å
619	G	40.8	Very low	50.9	Low	44 Å²	44	103.4 Å²	103.4	45%	0.454	59%	0.592	S	S	.	*	G	3₁₀ helix	trans	-100.9	-1.6	-179.1	0	0	0	0	0	116	S617	S617-G619 PolarHBondContact O-N 3.37Å; S617-G619 VanDerWaalsContact O-N 3.09Å
620	I	38.5	Very low	49.7	Very low	131 Å²	131	102.3 Å²	102.3	67%	0.672	59%	0.586	S	S	*	*	S	Bend	trans	-86.8	-12.8	-172.9	-56.3	178.6	0	0	0	112.3	S617	S617-I620 PolarHBondContact O-N 3.01Å
621	S	33.1	Very low	48.8	Very low	119 Å²	119	106.1 Å²	106.1	83%	0.832	60%	0.602	S	S	*	*	S	Bend	trans	-114	96.2	-177.1	-175.9	0	0	0	0	112
622	G	33	Very low	48.4	Very low	61 Å²	61	106.9 Å²	106.9	63%	0.629	60%	0.604	S	S	*	*			trans	122.4	96.7	157.1	0	0	0	0	0	115.9	S624	G622-S624 VanDerWaalsContact C-N 3.3Å; G622-S624 PolarHBondContact O-N 3Å
623	N	33.7	Very low	48.2	Very low	188 Å²	188	102.6 Å²	102.6	100%	1.005	58%	0.581	S	S	*	*			trans	15.5	51.8	136.2	-110.1	34.8	0	0	0	120.2
624	S	38.9	Very low	48.4	Very low	80 Å²	80	106.4 Å²	106.4	56%	0.559	60%	0.601	S	S	*	*			trans	-129	109.8	169.2	-175.4	0	0	0	0	109.4	G622 K626 V627	G622-S624 VanDerWaalsContact C-N 3.3Å; G622-S624 PolarHBondContact O-N 3Å; S624-K626 PolarHBondContact O-N 2.83Å; S624-V627 PolarHBondContact O-N 3.46Å
625	D	44.2	Very low	49.2	Very low	178 Å²	178	98.7 Å²	98.7	95%	0.952	57%	0.566	S	S	*	*	S	Bend	trans	-61.7	15.7	175.8	-76.7	-40.3	0	0	0	114.5
626	K	42.6	Very low	50.1	Low	176 Å²	176	97.4 Å²	97.4	77%	0.765	56%	0.563	S	S	*	*			trans	-131.8	63.6	173	-69	-177.2	-179.5	177.7	0	108.9	S624 D628	S624-K626 PolarHBondContact O-N 2.83Å; K626-D628 PolarHBondContact O-N 2.99Å
627	V	48.7	Very low	51.6	Low	86 Å²	86	98.1 Å²	98.1	52%	0.521	57%	0.565	S	S	.	*			trans	-62.7	107.7	156.4	178.1	0	0	0	0	105.5	S624 K629 F632	S624-V627 PolarHBondContact O-N 3.46Å; V627-K629 PolarHBondContact O-N 2.95Å; V627-F632 HydrophobicContact CG1-CD2 3.94Å; V627-F632 HydrophobicContact CG1-CE2 3.38Å; V627-F632 HydrophobicContact CG1-CZ 4.44Å
628	D	50.4	Low	53.2	Low	89 Å²	89	97.3 Å²	97.3	48%	0.476	56%	0.559	S	S	.	*			trans	-50.1	104.1	177.1	-84.4	-25.4	0	0	0	108.4	K626 D630 H631	K626-D628 PolarHBondContact O-N 2.99Å; D628-D630 PolarHBondContact O-N 3.48Å; D628-H631 HydrophobicContact CB-CB 4.12Å; D628-H631 WeakPolarHBondContact CB-ND1 3.42Å; D628-H631 WeakPolarHBondContact O-CB 3.5Å; D628-H631 PolarHBondContact O-N 3.28Å; D628-H631 IonicContact OD2-CE1 3.75Å; D628-H631 IonicContact OD2-ND1 3.28Å; D628-H631 PolarHBondContact OD2-ND1 3.39Å
629	K	52.3	Low	55.2	Low	160 Å²	160	99.2 Å²	99.2	70%	0.696	56%	0.561	S	S	*	*	H	α-helix	trans	-52.7	-27.9	173	-72.5	-178.4	177.1	177.5	0	110.3	V627 N633	V627-K629 PolarHBondContact O-N 2.95Å; K629-N633 PolarHBondContact O-N 2.95Å; K629-N633 PolarHBondContact O-ND2 3.36Å; K629-N633 VanDerWaalsContact O-ND2 3.1Å
630	D	56.6	Low	57.5	Low	106 Å²	106	98.2 Å²	98.2	57%	0.567	54%	0.543	S	S	*	.	H	α-helix	trans	-68.5	-32	177.9	-58.8	-25.8	0	0	0	113.5	D628 N633 N634	D628-D630 PolarHBondContact O-N 3.48Å; D630-N633 PolarHBondContact O-N 3.33Å; D630-N634 WeakPolarHBondContact O-CB 3.34Å; D630-N634 VanDerWaalsContact O-CG 3.28Å; D630-N634 PolarHBondContact O-N 3.47Å; D630-N634 VanDerWaalsContact O-N 3.09Å; D630-N634 PolarHBondContact O-ND2 3.09Å
631	H	61.4	Low	59.8	Low	132 Å²	132	99.8 Å²	99.8	61%	0.611	55%	0.547	S	S	*	.	H	α-helix	trans	-64.5	-44.4	177.9	-98	90.8	0	0	0	111.5	D628 N634	D628-H631 HydrophobicContact CB-CB 4.12Å; D628-H631 WeakPolarHBondContact CB-ND1 3.42Å; D628-H631 WeakPolarHBondContact O-CB 3.5Å; D628-H631 PolarHBondContact O-N 3.28Å; D628-H631 IonicContact OD2-CE1 3.75Å; D628-H631 IonicContact OD2-ND1 3.28Å; D628-H631 PolarHBondContact OD2-ND1 3.39Å; H631-N634 PolarHBondContact O-N 2.98Å
632	F	62	Low	62.5	Low	29 Å²	29	97.8 Å²	97.8	13%	0.127	52%	0.522	C	S	.	.	H	α-helix	trans	-70.2	-40	178.6	-75.4	-86.1	0	0	0	112.2	L600 L616 V627 N634 L635	L600-F632 HydrophobicContact CB-CD1 4.18Å; L600-F632 HydrophobicContact CD1-CB 4.17Å; L600-F632 HydrophobicContact CD1-CD1 4.33Å; L616-F632 HydrophobicContact CD2-CD1 3.93Å; L616-F632 HydrophobicContact CD2-CE1 3.55Å; V627-F632 HydrophobicContact CG1-CD2 3.94Å; V627-F632 HydrophobicContact CG1-CE2 3.38Å; V627-F632 HydrophobicContact CG1-CZ 4.44Å; F632-N634 PolarHBondContact O-N 3.21Å; F632-N634 VanDerWaalsContact O-N 3.17Å; F632-L635 HydrophobicContact CB-CD1 4.42Å; F632-L635 HydrophobicContact CD1-CD1 3.83Å; F632-L635 WeakPolarHBondContact O-CB 3.33Å; F632-L635 WeakPolarHBondContact O-CD1 3.49Å; F632-L635 WeakPolarHBondContact O-CG 3.29Å; F632-L635 PolarHBondContact O-N 3.24Å; F632-L635 VanDerWaalsContact O-N 3.16Å
633	N	64	Low	65	Low	52 Å²	52	96.5 Å²	96.5	28%	0.278	50%	0.501	S	S	.	.	H	α-helix	trans	-61.1	-25.1	175.2	-68.5	-22.6	0	0	0	112.1	R510 K629 D630	R510-N633 PolarHBondContact NE-O 3.16Å; R510-N633 PolarHBondContact NH2-O 2.95Å; K629-N633 PolarHBondContact O-N 2.95Å; K629-N633 PolarHBondContact O-ND2 3.36Å; K629-N633 VanDerWaalsContact O-ND2 3.1Å; D630-N633 PolarHBondContact O-N 3.33Å
634	N	67	Low	67.7	Low	104 Å²	104	88 Å²	88	56%	0.556	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-0.3	180	-74.5	-34.6	0	0	0	115.8	R510 D630 H631 F632 I636	R510-N634 PolarHBondContact NH1-O 3.34Å; R510-N634 PolarHBondContact NH2-OD1 3.43Å; R510-N634 VanDerWaalsContact NH2-OD1 3.15Å; D630-N634 WeakPolarHBondContact O-CB 3.34Å; D630-N634 VanDerWaalsContact O-CG 3.28Å; D630-N634 PolarHBondContact O-N 3.47Å; D630-N634 VanDerWaalsContact O-N 3.09Å; D630-N634 PolarHBondContact O-ND2 3.09Å; H631-N634 PolarHBondContact O-N 2.98Å; F632-N634 PolarHBondContact O-N 3.21Å; F632-N634 VanDerWaalsContact O-N 3.17Å; N634-I636 PolarHBondContact O-N 2.96Å
635	L	71.7	Confident	69.9	Low	14 Å²	14	86.6 Å²	86.6	7%	0.073	44%	0.442	C	S	.	.			trans	-61.7	125.8	175.6	-67.4	166.9	0	0	0	111.4	H509 R510 L600 L616 F632	H509-L635 PolarHBondContact CE1-O 2.93Å; H509-L635 PolarHBondContact ND1-O 3.34Å; R510-L635 VanDerWaalsContact NH1-C 3.35Å; R510-L635 PolarHBondContact NH1-O 3.47Å; L600-L635 HydrophobicContact CD1-CD1 4.44Å; L616-L635 HydrophobicContact CD2-CD1 3.51Å; L616-L635 HydrophobicContact CD2-CD2 4.46Å; L616-L635 HydrophobicContact CG-CD1 4.05Å; L616-L635 HydrophobicContact CG-CD2 4.28Å; F632-L635 HydrophobicContact CB-CD1 4.42Å; F632-L635 HydrophobicContact CD1-CD1 3.83Å; F632-L635 WeakPolarHBondContact O-CB 3.33Å; F632-L635 WeakPolarHBondContact O-CD1 3.49Å; F632-L635 WeakPolarHBondContact O-CG 3.29Å; F632-L635 PolarHBondContact O-N 3.24Å; F632-L635 VanDerWaalsContact O-N 3.16Å
636	I	74.8	Confident	71.9	Confident	137 Å²	137	78.1 Å²	78.1	70%	0.703	40%	0.397	S	S	*	.			trans	-104.6	111.5	175.6	-60.5	172.8	0	0	0	106.9	R510 N634	R510-I636 VanDerWaalsContact NH1-CG1 3.35Å; N634-I636 PolarHBondContact O-N 2.96Å
637	F	81.3	Confident	73.6	Confident	22 Å²	22	71.9 Å²	71.9	10%	0.096	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-78.5	151.8	170.9	-68.9	-70	0	0	0	110.4	I505 H509 L600 V607 C611 I613	I505-F637 HydrophobicContact CG2-CE2 4.4Å; I505-F637 HydrophobicContact CG2-CZ 4.21Å; H509-F637 HydrophobicContact CB-CD2 3.7Å; H509-F637 HydrophobicContact CB-CE2 3.61Å; H509-F637 AromaticContact CG-CD2 3.82Å; H509-F637 AromaticContact CG-CE2 3.55Å; H509-F637 AromaticContact ND1-CD2 3.49Å; H509-F637 WeakPolarHBondContact ND1-CD2 3.5Å; H509-F637 AromaticContact ND1-CE2 3.46Å; H509-F637 WeakPolarHBondContact ND1-CE2 3.32Å; L600-F637 HydrophobicContact CD2-CZ 4.37Å; V607-F637 HydrophobicContact CG1-CD1 4.37Å; V607-F637 HydrophobicContact CG1-CE1 3.26Å; V607-F637 HydrophobicContact CG1-CZ 3.72Å; C611-F637 HydrophobicContact CB-CD1 4.24Å; I613-F637 HydrophobicContact CD1-CD1 3.56Å; I613-F637 HydrophobicContact CD1-CE1 3.74Å
638	P	82	Confident	74.7	Confident	64 Å²	64	72.7 Å²	72.7	42%	0.416	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-50.2	154.4	167.4	-25.4	34.2	0	0	0	111.3	H506 C611 W640	H506-P638 PolarHBondContact NE2-O 2.98Å; C611-P638 HydrophobicContact CB-CG 4.2Å; P638-W640 PolarHBondContact O-N 2.94Å
639	S	82.8	Confident	74.9	Confident	112 Å²	112	74.3 Å²	74.3	78%	0.783	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-59.2	132.1	177.2	-173.3	0	0	0	0	110.5	E641	S639-E641 PolarHBondContact O-N 3.4Å
640	W	89.1	Confident	74.6	Confident	22 Å²	22	70.9 Å²	70.9	8%	0.083	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-70.9	126.9	173.4	-173.2	-88	0	0	0	110	Y503 H506 L507 E521 F525 P638 Y642	Y503-W640 HydrophobicContact CD1-CH2 4.49Å; Y503-W640 WeakPolarHBondContact O-CH2 3.36Å; Y503-W640 WeakPolarHBondContact O-CZ3 3.45Å; H506-W640 HydrophobicContact CB-CE3 4.07Å; H506-W640 HydrophobicContact CB-CZ3 3.88Å; H506-W640 AromaticContact CD2-CE3 3.83Å; H506-W640 AromaticContact CE1-CE3 3.92Å; H506-W640 AromaticContact CG-CE3 3.6Å; H506-W640 AromaticContact CG-CZ3 3.78Å; H506-W640 AromaticContact ND1-CE3 3.68Å; H506-W640 AromaticContact ND1-CZ3 3.74Å; L507-W640 HydrophobicContact CB-CD2 3.79Å; L507-W640 HydrophobicContact CB-CE3 3.74Å; L507-W640 HydrophobicContact CB-CH2 3.9Å; L507-W640 HydrophobicContact CB-CZ2 3.95Å; L507-W640 HydrophobicContact CB-CZ3 3.81Å; L507-W640 HydrophobicContact CD1-CD2 3.86Å; L507-W640 HydrophobicContact CD1-CG 3.79Å; L507-W640 HydrophobicContact CD1-CZ2 4.48Å; L507-W640 HydrophobicContact CD2-CZ2 4.18Å; L507-W640 HydrophobicContact CG-CD2 4.34Å; L507-W640 HydrophobicContact CG-CZ2 4.42Å; E521-W640 PolarHBondContact OE1-NE1 3.45Å; F525-W640 HydrophobicContact CB-CZ2 4.09Å; F525-W640 HydrophobicContact CD1-CH2 4.03Å; F525-W640 HydrophobicContact CD1-CZ2 4.03Å; F525-W640 HydrophobicContact CD2-CH2 4.05Å; F525-W640 AromaticContact CD2-CZ2 3.63Å; F525-W640 HydrophobicContact CD2-CZ2 3.63Å; F525-W640 HydrophobicContact CE1-CH2 4.09Å; F525-W640 HydrophobicContact CE1-CZ2 4.48Å; F525-W640 HydrophobicContact CE2-CH2 4.09Å; F525-W640 HydrophobicContact CE2-CZ2 4.1Å; F525-W640 HydrophobicContact CG-CH2 4.04Å; F525-W640 AromaticContact CG-CZ2 3.6Å; F525-W640 HydrophobicContact CG-CZ2 3.6Å; F525-W640 HydrophobicContact CZ-CH2 4.14Å; P638-W640 PolarHBondContact O-N 2.94Å; W640-Y642 HydrophobicContact CB-CE2 4.26Å; W640-Y642 AromaticContact CD1-CD1 3.88Å; W640-Y642 AromaticContact CD1-CE1 3.95Å; W640-Y642 VanDerWaalsContact O-CD2 3.27Å; W640-Y642 WeakPolarHBondContact O-CD2 3.46Å; W640-Y642 PolarHBondContact O-N 2.93Å
641	E	87	Confident	73.6	Confident	164 Å²	164	73.6 Å²	73.6	77%	0.766	41%	0.405	S	S	*	.			trans	-79.8	96.9	173.7	-67.4	-173	172.1	0	0	109.5	S639 L643	S639-E641 PolarHBondContact O-N 3.4Å; E641-L643 PolarHBondContact O-N 3.25Å
642	Y	88.7	Confident	72.3	Confident	78 Å²	78	77 Å²	77	31%	0.306	41%	0.412	S	S	.	.			trans	-66.3	126.9	-179.5	-70	-85	0	0	0	111.4	L507 L513 E521 W640 A647	L507-Y642 HydrophobicContact CD1-CE1 4Å; L513-Y642 HydrophobicContact CD1-CD1 4.39Å; L513-Y642 HydrophobicContact CD1-CE1 3.33Å; L513-Y642 WeakPolarHBondContact CD1-OH 3.34Å; E521-Y642 HydrophobicContact CG-CD1 3.88Å; E521-Y642 HydrophobicContact CG-CE1 4.22Å; E521-Y642 WeakPolarHBondContact OE1-CA 3.48Å; W640-Y642 HydrophobicContact CB-CE2 4.26Å; W640-Y642 AromaticContact CD1-CD1 3.88Å; W640-Y642 AromaticContact CD1-CE1 3.95Å; W640-Y642 VanDerWaalsContact O-CD2 3.27Å; W640-Y642 WeakPolarHBondContact O-CD2 3.46Å; W640-Y642 PolarHBondContact O-N 2.93Å; Y642-A647 HydrophobicContact CD1-CB 3.97Å; Y642-A647 HydrophobicContact CD2-CB 3.56Å; Y642-A647 HydrophobicContact CE1-CB 4.27Å; Y642-A647 HydrophobicContact CE2-CB 3.86Å; Y642-A647 HydrophobicContact CG-CB 3.61Å
643	L	86.9	Confident	71	Confident	33 Å²	33	81.7 Å²	81.7	17%	0.173	44%	0.443	C	S	.	.	S	Bend	trans	-85.8	-16.5	174.6	-57.5	-173.9	0	0	0	112.5	E521 V524 F525 R528 L534 E641	E521-L643 PolarHBondContact OE1-N 3.41Å; V524-L643 HydrophobicContact CG1-CB 4.1Å; V524-L643 HydrophobicContact CG1-CD1 4.28Å; F525-L643 HydrophobicContact CB-CD1 4.16Å; F525-L643 HydrophobicContact CD2-CD1 4.32Å; R528-L643 HydrophobicContact CB-CD1 4.21Å; L534-L643 HydrophobicContact CD1-CB 4.5Å; L534-L643 HydrophobicContact CD1-CD1 4.2Å; E641-L643 PolarHBondContact O-N 3.25Å
644	T	89.2	Confident	69.5	Low	11 Å²	11	86.4 Å²	86.4	7%	0.067	47%	0.469	C	S	.	.	S	Bend	trans	-120.4	167	-175.3	72.6	0	0	0	0	111.9	F520 E521 V524 L538 V646	F520-T644 HydrophobicContact CD1-CG2 3.95Å; F520-T644 HydrophobicContact CE1-CG2 3.48Å; F520-T644 VanDerWaalsContact CE1-CG2 3.48Å; F520-T644 HydrophobicContact CZ-CG2 4.2Å; E521-T644 VanDerWaalsContact OE2-CB 3.29Å; E521-T644 WeakPolarHBondContact OE2-CB 3.45Å; E521-T644 WeakPolarHBondContact OE2-CG2 3.37Å; E521-T644 PolarHBondContact OE2-N 3.38Å; E521-T644 PolarHBondContact OE2-OG1 3Å; V524-T644 HydrophobicContact CB-CG2 3.98Å; V524-T644 HydrophobicContact CG1-CG2 3.86Å; V524-T644 HydrophobicContact CG2-CG2 3.9Å; L538-T644 HydrophobicContact CD2-CG2 4.39Å; L538-T644 WeakPolarHBondContact O-CA 3.39Å; L538-T644 WeakPolarHBondContact O-CB 3.5Å; T644-V646 PolarHBondContact O-N 3.4Å; T644-V646 VanDerWaalsContact OG1-CB 3.31Å; T644-V646 WeakPolarHBondContact OG1-CB 3.44Å; T644-V646 WeakPolarHBondContact OG1-CG2 3.42Å; T644-V646 PolarHBondContact OG1-N 2.89Å
645	D	86.1	Confident	67.8	Low	49 Å²	49	93 Å²	93	26%	0.262	49%	0.485	S	S	.	.	G	3₁₀ helix	trans	-69	3.1	176.2	72.6	-21.6	0	0	0	114	L538 Y540 A647 V648	L538-D645 PolarHBondContact O-N 3.2Å; Y540-D645 WeakPolarHBondContact CB-OD1 3.31Å; Y540-D645 PolarHBondContact N-OD1 3.35Å; D645-A647 PolarHBondContact O-N 2.69Å; D645-A647 VanDerWaalsContact O-N 3.16Å; D645-V648 HydrophobicContact CB-CG2 4.4Å; D645-V648 WeakPolarHBondContact O-CB 3.14Å; D645-V648 PolarHBondContact O-N 3.16Å
646	V	85.6	Confident	65.8	Low	1 Å²	1	96 Å²	96	1%	0.006	52%	0.521	C	S	.	.	G	3₁₀ helix	trans	-55.8	-36.8	-174.3	163.9	0	0	0	0	112.9	L513 K517 F520 Y540 T644 V648	L513-V646 HydrophobicContact CD1-CG1 3.53Å; L513-V646 HydrophobicContact CD2-CG1 3.81Å; L513-V646 HydrophobicContact CG-CG1 4.21Å; K517-V646 HydrophobicContact CB-CG1 3.45Å; K517-V646 VanDerWaalsContact CB-CG1 3.45Å; K517-V646 HydrophobicContact CB-CG2 4.35Å; K517-V646 HydrophobicContact CD-CG1 3.88Å; K517-V646 HydrophobicContact CG-CG1 3.72Å; K517-V646 HydrophobicContact CG-CG2 4.23Å; K517-V646 PolarHBondContact NZ-O 2.99Å; F520-V646 HydrophobicContact CD1-CG2 3.82Å; Y540-V646 HydrophobicContact CD2-CG2 3.92Å; Y540-V646 HydrophobicContact CG-CG2 3.87Å; T644-V646 PolarHBondContact O-N 3.4Å; T644-V646 VanDerWaalsContact OG1-CB 3.31Å; T644-V646 WeakPolarHBondContact OG1-CB 3.44Å; T644-V646 WeakPolarHBondContact OG1-CG2 3.42Å; T644-V646 PolarHBondContact OG1-N 2.89Å; V646-V648 VanDerWaalsContact C-N 3.34Å
647	A	78.6	Confident	63.7	Low	44 Å²	44	94 Å²	94	36%	0.364	52%	0.524	S	S	.	.	G	3₁₀ helix	trans	-78.2	-15.5	178.8	0	0	0	0	0	113.6	Y642 D645 T649	Y642-A647 HydrophobicContact CD1-CB 3.97Å; Y642-A647 HydrophobicContact CD2-CB 3.56Å; Y642-A647 HydrophobicContact CE1-CB 4.27Å; Y642-A647 HydrophobicContact CE2-CB 3.86Å; Y642-A647 HydrophobicContact CG-CB 3.61Å; D645-A647 PolarHBondContact O-N 2.69Å; D645-A647 VanDerWaalsContact O-N 3.16Å; A647-T649 PolarHBondContact O-N 2.93Å; A647-T649 VanDerWaalsContact O-N 3.1Å
648	V	72.2	Confident	61.3	Low	104 Å²	104	98.2 Å²	98.2	63%	0.63	56%	0.556	S	S	*	*			trans	-72.6	107.5	178.1	-174.2	0	0	0	0	108.8	D645 V646 S650	D645-V648 HydrophobicContact CB-CG2 4.4Å; D645-V648 WeakPolarHBondContact O-CB 3.14Å; D645-V648 PolarHBondContact O-N 3.16Å; V646-V648 VanDerWaalsContact C-N 3.34Å; V648-S650 PolarHBondContact O-N 3.49Å
649	T	54.7	Low	59	Low	122 Å²	122	101.4 Å²	101.4	75%	0.748	58%	0.575	S	S	*	*			trans	-78.6	104.4	169	45	0	0	0	0	108.1	A647 I651	A647-T649 PolarHBondContact O-N 2.93Å; A647-T649 VanDerWaalsContact O-N 3.1Å; T649-I651 PolarHBondContact O-N 3.2Å
650	S	44.6	Very low	56.7	Low	88 Å²	88	102.3 Å²	102.3	62%	0.615	58%	0.576	S	S	*	*			trans	-57.6	117.9	170.8	65.1	0	0	0	0	108.3	V648 R652	V648-S650 PolarHBondContact O-N 3.49Å; S650-R652 PolarHBondContact O-N 3.31Å
651	I	36.9	Very low	53.8	Low	163 Å²	163	109.1 Å²	109.1	84%	0.836	61%	0.614	S	S	*	*			trans	-64.2	89.7	170.1	-57.8	170.4	0	0	0	106.4	T649 V653	T649-I651 PolarHBondContact O-N 3.2Å; I651-V653 PolarHBondContact O-N 2.92Å
652	R	33.2	Very low	51	Low	203 Å²	203	112.8 Å²	112.8	77%	0.766	62%	0.621	S	S	*	*			trans	-75	106.1	168.9	-80.8	-173.5	178.3	-164.8	-2.9	106.4	S650 N654	S650-R652 PolarHBondContact O-N 3.31Å; R652-N654 PolarHBondContact O-N 3.35Å
653	V	34.3	Very low	48	Very low	128 Å²	128	121.1 Å²	121.1	78%	0.776	65%	0.652	S	S	*	*			trans	-54.8	105.8	164.4	-178.8	0	0	0	0	106.7	I651 R655	I651-V653 PolarHBondContact O-N 2.92Å; V653-R655 PolarHBondContact O-N 3.01Å
654	N	32	Very low	45.3	Very low	152 Å²	152	125.1 Å²	125.1	81%	0.813	68%	0.682	S	S	*	*			trans	-59.3	105.3	179.8	-87.4	-20.3	0	0	0	109	R652 G656	R652-N654 PolarHBondContact O-N 3.35Å; N654-G656 PolarHBondContact O-N 2.93Å
655	R	31.7	Very low	42.4	Very low	241 Å²	241	132.5 Å²	132.5	91%	0.909	72%	0.721	S	S	*	*			trans	-68.7	123.3	157.1	-72.4	-175.2	175.9	172.8	-1.1	106.6	V653 A657	V653-R655 PolarHBondContact O-N 3.01Å; R655-A657 PolarHBondContact O-N 3.11Å
656	G	29.3	Very low	39.5	Very low	79 Å²	79	139.3 Å²	139.3	81%	0.814	75%	0.751	S	S	*	*			trans	-42.5	122.3	-164.9	0	0	0	0	0	114.8	N654	N654-G656 PolarHBondContact O-N 2.93Å
657	A	31.4	Very low	36.8	Very low	93 Å²	93	145.5 Å²	145.5	77%	0.769	79%	0.788	S	S	*	*			trans	-75.4	120.1	161.8	0	0	0	0	0	107.9	R655 T659	R655-A657 PolarHBondContact O-N 3.11Å; A657-T659 PolarHBondContact O-N 3.37Å
658	S	30.5	Very low	34.2	Very low	111 Å²	111	149.4 Å²	149.4	78%	0.776	81%	0.81	S	S	*	*			trans	-64.5	120.7	172	58.8	0	0	0	0	109.3	T660	S658-T660 PolarHBondContact O-N 3.31Å
659	T	34.2	Very low	32	Very low	132 Å²	132	153.9 Å²	153.9	81%	0.81	82%	0.824	S	S	*	*			trans	-77.5	100.1	177.9	48.8	0	0	0	0	109.3	A657 N661	A657-T659 PolarHBondContact O-N 3.37Å; T659-N661 PolarHBondContact O-N 2.97Å
660	T	33.3	Very low	30.7	Very low	130 Å²	130	152.9 Å²	152.9	80%	0.798	82%	0.822	S	S	*	*			trans	-72	107.4	164.4	49.8	0	0	0	0	109.3	S658 R662	S658-T660 PolarHBondContact O-N 3.31Å; T660-R662 PolarHBondContact O-N 2.99Å
661	N	29.3	Very low	29.8	Very low	166 Å²	166	156.9 Å²	156.9	89%	0.888	83%	0.831	S	S	*	*			trans	-12.6	102	167.4	-68.7	-31	0	0	0	116.5	T659	T659-N661 PolarHBondContact O-N 2.97Å
662	R	27.9	Very low	29.3	Very low	240 Å²	240	157 Å²	157	91%	0.906	83%	0.833	S	S	*	*			trans	-109.2	111.3	154.5	-143.2	-178.3	-164.5	-152.4	3.7	107.2	T660 S664	T660-R662 PolarHBondContact O-N 2.99Å; R662-S664 PolarHBondContact O-N 3.44Å; R662-S664 VanDerWaalsContact O-N 3.16Å
663	R	26.6	Very low	29	Very low	254 Å²	254	152.4 Å²	152.4	96%	0.958	83%	0.829	S	S	*	*			trans	-52.8	115	173.6	-78.8	176.1	171.1	176.1	-3.9	108.9
664	S	30	Very low	28.6	Very low	117 Å²	117	152 Å²	152	82%	0.818	83%	0.829	S	S	*	*			trans	-118.7	132.8	170.2	-169.8	0	0	0	0	108.6	R662	R662-S664 PolarHBondContact O-N 3.44Å; R662-S664 VanDerWaalsContact O-N 3.16Å
665	L	28.8	Very low	28.3	Very low	166 Å²	166	151.3 Å²	151.3	87%	0.869	83%	0.83	S	S	*	*			trans	-60.9	135.3	-175.1	-137.4	68	0	0	0	111.3
666	E	23.4	Very low	28	Very low	192 Å²	192	145.7 Å²	145.7	90%	0.897	82%	0.823	S	S	*	*			trans	-68.6	128.5	176.3	-69.2	175	150.6	0	0	111.2
667	V	28.9	Very low	27.9	Very low	131 Å²	131	149.1 Å²	149.1	79%	0.794	82%	0.822	S	S	*	*			trans	-133.5	135.6	158.8	178.7	0	0	0	0	108
668	P	25.7	Very low	27.6	Very low	125 Å²	125	156 Å²	156	81%	0.812	83%	0.828	S	S	*	*			trans	-77.3	136.8	-157.7	-16.1	32.9	0	0	0	114.7
669	Q	25.4	Very low	27.3	Very low	198 Å²	198	159.2 Å²	159.2	93%	0.925	84%	0.836	S	S	*	*			trans	-65.4	132.1	172.2	-72.9	172	-49.5	0	0	111.8
670	S	26.3	Very low	27	Very low	102 Å²	102	161.6 Å²	161.6	71%	0.713	84%	0.837	S	S	*	*			trans	-137.8	135.5	158	79.4	0	0	0	0	110.3
671	Q	26.9	Very low	26.5	Very low	172 Å²	172	163.6 Å²	163.6	80%	0.804	84%	0.838	S	S	*	*			trans	72.9	96.3	152.2	-61.9	-173	-5.1	0	0	119.4
672	L	26.5	Very low	26.5	Very low	166 Å²	166	161.4 Å²	161.4	87%	0.869	83%	0.833	S	S	*	*				159.8	151.9	103.9	-83.2	160.3	0	0	0	112.3
673	P	26.6	Very low	26.4	Very low	106 Å²	106	161.2 Å²	161.2	69%	0.688	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-93.2	169.1	-164	13.6	6.8	0	0	0	114.2
674	P	25.3	Very low	26.2	Very low	120 Å²	120	158.7 Å²	158.7	78%	0.779	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-91.2	131.2	-160.8	35	-31	0	0	0	113
675	T	27.3	Very low	26	Very low	137 Å²	137	160.3 Å²	160.3	84%	0.84	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-97.2	116	167.1	-50.4	0	0	0	0	109.1
676	V	24.6	Very low	25.7	Very low	123 Å²	123	160 Å²	160	75%	0.745	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-85	120.2	169.5	173.7	0	0	0	0	106.7
677	D	28	Very low	25.7	Very low	151 Å²	151	159.5 Å²	159.5	81%	0.807	83%	0.825	S	S	*	*			trans	-153.3	139.5	150.6	-109.6	-29.5	0	0	0	114.4
678	R	23.7	Very low	25.5	Very low	237 Å²	237	158.9 Å²	158.9	89%	0.894	82%	0.821	S	S	*	*			trans	-73.7	131.4	-171.3	-68	169.6	161.8	-174.3	-5.3	110.6
679	L	25.4	Very low	25.5	Very low	179 Å²	179	159.2 Å²	159.2	94%	0.937	82%	0.821	S	S	*	*			trans	-121	142.2	167.7	-98.3	167.4	0	0	0	112.5
680	H	27.2	Very low	25.6	Very low	181 Å²	181	157.4 Å²	157.4	84%	0.838	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-79	147	-156	-135.5	73.2	0	0	0	113.2
681	E	23.8	Very low	25.5	Very low	172 Å²	172	160.6 Å²	160.6	80%	0.804	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-74.7	131	178	-165.4	170.2	-166.8	0	0	111.4
682	P	28.8	Very low	25.4	Very low	121 Å²	121	157.8 Å²	157.8	79%	0.786	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-85.8	122.8	-175.9	30.9	-29.4	0	0	0	111.6
683	R	24.6	Very low	25.4	Very low	235 Å²	235	155.4 Å²	155.4	89%	0.887	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-69.3	140.5	176.7	-73.2	179.6	170.6	164.8	-2.7	112.1	N685	R683-N685 PolarHBondContact O-N 3.46Å
684	K	22.1	Very low	25.2	Very low	202 Å²	202	156.7 Å²	156.7	88%	0.878	83%	0.827	S	S	*	*			trans	-65.5	111.6	172.8	-62	171.2	179.8	176.8	0	110.1
685	N	26.5	Very low	25.2	Very low	151 Å²	151	157 Å²	157	81%	0.807	83%	0.826	S	S	*	*			trans	-97.8	107	166.8	-79.7	-12.5	0	0	0	109.1	R683 M687	R683-N685 PolarHBondContact O-N 3.46Å; N685-M687 PolarHBondContact O-N 3.2Å
686	I	21.8	Very low	25	Very low	158 Å²	158	157.4 Å²	157.4	81%	0.81	82%	0.822	S	S	*	*			trans	-75.9	107.7	164.8	-64.6	164.7	0	0	0	105.3
687	M	23.8	Very low	24.9	Very low	183 Å²	183	159.2 Å²	159.2	90%	0.901	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-101.1	116.6	175	-127.7	165.7	78.4	0	0	108.8	N685	N685-M687 PolarHBondContact O-N 3.2Å
688	T	25.3	Very low	24.6	Very low	117 Å²	117	160.2 Å²	160.2	72%	0.718	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-71.5	151.7	180	37.9	0	0	0	0	112.2
689	T	25.2	Very low	24.7	Very low	133 Å²	133	154.7 Å²	154.7	82%	0.816	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-51.8	124.6	178.9	51.2	0	0	0	0	113.6
690	N	27.9	Very low	24.5	Very low	159 Å²	159	154.5 Å²	154.5	85%	0.85	82%	0.82	S	S	*	*			trans	-121	124.3	163.3	-89.3	-28.8	0	0	0	110.5
691	N	24.9	Very low	24.4	Very low	169 Å²	169	155.1 Å²	155.1	90%	0.904	82%	0.824	S	S	*	*			trans	-61.3	129.1	173.7	-69.7	-36.4	0	0	0	111.7
692	S	25.1	Very low	24.4	Very low	113 Å²	113	152.7 Å²	152.7	79%	0.79	83%	0.826	S	S	*	*			trans	-155.3	149	151.4	57.8	0	0	0	0	110.2
693	P	26	Very low	24.2	Very low	117 Å²	117	152.2 Å²	152.2	76%	0.76	83%	0.826	S	S	*	*			trans	-94.9	154.3	-145.4	35.2	-33	0	0	0	114.9
694	V	22.7	Very low	24.2	Very low	133 Å²	133	148.4 Å²	148.4	81%	0.806	82%	0.822	S	S	*	*			trans	-62.4	121.4	175	175	0	0	0	0	110.8
695	V	23.5	Very low	24.3	Very low	127 Å²	127	145.1 Å²	145.1	77%	0.77	82%	0.819	S	S	*	*			trans	-90.2	103.7	169.7	177.6	0	0	0	0	108
696	L	23.3	Very low	24.2	Very low	145 Å²	145	143.8 Å²	143.8	76%	0.759	82%	0.816	S	S	*	*			trans	-84.3	109.1	175.2	-150.5	107.2	0	0	0	108.4	Q698	L696-Q698 PolarHBondContact O-N 3.29Å
697	L	22.4	Very low	24.2	Very low	160 Å²	160	141.6 Å²	141.6	84%	0.838	82%	0.815	S	S	*	*			trans	-79.8	113.4	175	-72.1	170.4	0	0	0	109.6
698	Q	22.7	Very low	24.3	Very low	173 Å²	173	138.3 Å²	138.3	81%	0.808	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-75.4	144.5	175.6	-81.1	178.6	-82.8	0	0	112.1	L696	L696-Q698 PolarHBondContact O-N 3.29Å
699	P	24.9	Very low	24.2	Very low	121 Å²	121	141.6 Å²	141.6	79%	0.786	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-68.7	136.8	174	-16.4	30.7	0	0	0	112.6	Q701	P699-Q701 PolarHBondContact O-N 3.33Å
700	L	22.7	Very low	24.1	Very low	174 Å²	174	142.7 Å²	142.7	91%	0.911	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-64	122.1	178.4	-71.3	161.9	0	0	0	111.4
701	Q	24.1	Very low	24.1	Very low	194 Å²	194	142 Å²	142	91%	0.907	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-73.5	126.6	169.6	-64.4	-158.6	-50.6	0	0	109.9	P699	P699-Q701 PolarHBondContact O-N 3.33Å
702	S	24.2	Very low	24	Very low	122 Å²	122	140.6 Å²	140.6	85%	0.853	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-85.1	118.6	170.2	15.8	0	0	0	0	108.3
703	S	25.5	Very low	24.2	Very low	111 Å²	111	145.3 Å²	145.3	78%	0.776	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-84	146.5	-179.8	50.4	0	0	0	0	112.7
704	D	22.9	Very low	24.1	Very low	154 Å²	154	149.1 Å²	149.1	82%	0.824	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-49.5	137.9	178	-54.5	-66.8	0	0	0	116
705	V	25.1	Very low	24.3	Very low	134 Å²	134	150.6 Å²	150.6	81%	0.812	82%	0.818	S	S	*	*			trans	-148.1	106.3	150.9	179.6	0	0	0	0	111.4
706	V	23.8	Very low	24.2	Very low	122 Å²	122	149 Å²	149	74%	0.739	81%	0.813	S	S	*	*			trans	71.8	96.8	136.6	-172.3	0	0	0	0	120
707	S	22.1	Very low	24.3	Very low	113 Å²	113	149 Å²	149	79%	0.79	81%	0.812	S	S	*	*			trans	-46.4	132.4	148.5	175.2	0	0	0	0	114.1
708	S	25.6	Very low	24.5	Very low	114 Å²	114	148.9 Å²	148.9	80%	0.797	81%	0.806	S	S	*	*			trans	-117.8	112.9	160.7	-77	0	0	0	0	111
709	K	24.7	Very low	24.7	Very low	185 Å²	185	150.7 Å²	150.7	80%	0.804	81%	0.812	S	S	*	*			trans	-14.4	124.3	160.2	-66.9	176.4	179.7	179.2	0	116.2
710	Q	21.8	Very low	24.8	Very low	156 Å²	156	151.5 Å²	151.5	73%	0.729	81%	0.809	S	S	*	*				81.9	109.8	91.7	-162.6	179	37.5	0	0	113
711	T	27.5	Very low	24.8	Very low	146 Å²	146	151.4 Å²	151.4	90%	0.896	80%	0.804	S	S	*	*			trans	-158.9	117.8	133.8	35.5	0	0	0	0	109.8
712	D	23.4	Very low	25	Very low	138 Å²	138	147.9 Å²	147.9	74%	0.738	80%	0.798	S	S	*	*			trans	-67.9	131.5	174.4	-60.2	-69.9	0	0	0	111.7
713	K	29	Very low	25	Very low	212 Å²	212	149.5 Å²	149.5	92%	0.922	80%	0.796	S	S	*	*			trans	-137.1	95.8	150.7	-77.5	-166.6	179.6	174.8	0	110.9
714	K	23.6	Very low	24.9	Very low	198 Å²	198	150.7 Å²	150.7	86%	0.861	79%	0.794	S	S	*	*			trans	-57.9	122.7	165.6	-168.7	-179.1	-170.8	-179.2	0	110.4
715	L	26.7	Very low	25	Very low	164 Å²	164	151.1 Å²	151.1	86%	0.859	79%	0.791	S	S	*	*			trans	-147.6	95.4	156.6	-103.5	156.7	0	0	0	108.5
716	S	22.5	Very low	25	Very low	94 Å²	94	150.4 Å²	150.4	66%	0.657	79%	0.792	S	S	*	*			trans	-65.8	147.3	161.6	53.8	0	0	0	0	110.1
717	I	25.8	Very low	25.1	Very low	145 Å²	145	153.8 Å²	153.8	74%	0.744	80%	0.796	S	S	*	*			trans	-167.2	120.3	135.1	-91.4	142.7	0	0	0	109.2
718	H	26.3	Very low	25.2	Very low	156 Å²	156	158.6 Å²	158.6	72%	0.722	80%	0.803	S	S	*	*			trans	35.6	103.6	150.9	-72.9	-79.4	0	0	0	120.8
719	K	26.3	Very low	25.3	Very low	211 Å²	211	160.5 Å²	160.5	92%	0.917	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-100.3	117.9	146.6	-70	-177.9	177	-178.5	0	107.6
720	N	27.3	Very low	25.5	Very low	138 Å²	138	159.9 Å²	159.9	74%	0.738	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-93.1	118.7	172.2	-76.1	-17.8	0	0	0	108.9
721	E	23.5	Very low	25.5	Very low	172 Å²	172	157.2 Å²	157.2	80%	0.804	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-68.4	149.7	153.6	-78.6	-170.8	135.1	0	0	109.3
722	P	28.2	Very low	25.5	Very low	121 Å²	121	155.5 Å²	155.5	79%	0.786	80%	0.795	S	S	*	*				-141.2	127.7	105.1	29.7	-11.7	0	0	0	113.9
723	L	22.5	Very low	25.6	Very low	155 Å²	155	157.5 Å²	157.5	81%	0.812	80%	0.8	S	S	*	*			trans	-59.6	125.9	158.3	-178.9	83.5	0	0	0	110.7
724	L	24.5	Very low	25.7	Very low	137 Å²	137	156.1 Å²	156.1	72%	0.717	79%	0.794	S	S	*	*			trans	-158	112	158.9	-99.7	167.9	0	0	0	112.9
725	Q	25.1	Very low	25.8	Very low	163 Å²	163	153.4 Å²	153.4	76%	0.762	79%	0.789	S	S	*	*			trans	66.8	103.2	135.8	-76.3	167.6	-1	0	0	121.4
726	S	24	Very low	25.9	Very low	119 Å²	119	152.4 Å²	152.4	83%	0.832	78%	0.783	S	S	*	*			trans	-45.5	129.3	143.9	42	0	0	0	0	113.4
727	K	27.7	Very low	25.9	Very low	193 Å²	193	155.3 Å²	155.3	84%	0.839	79%	0.791	S	S	*	*			trans	-118.3	108.7	159.3	-91	-177.8	176.3	176.8	0	109.2
728	K	23.9	Very low	26	Very low	213 Å²	213	155.6 Å²	155.6	93%	0.926	79%	0.793	S	S	*	*			trans	-92.6	118	171.2	-165.1	175.4	-173.7	-179.2	0	105.8
729	I	28.1	Very low	26	Very low	154 Å²	154	153 Å²	153	79%	0.79	79%	0.793	S	S	*	*			trans	-118.7	136.6	175	-66.4	177.4	0	0	0	108.9
730	H	26.9	Very low	25.8	Very low	173 Å²	173	149.3 Å²	149.3	80%	0.801	79%	0.787	S	S	*	*			trans	-63.2	145.7	-170.8	-105.3	-48.7	0	0	0	115.6
731	S	22.6	Very low	25.8	Very low	100 Å²	100	148.3 Å²	148.3	70%	0.699	79%	0.791	S	S	*	*			trans	-6.5	132	138.1	52	0	0	0	0	118.3
732	S	27.2	Very low	25.9	Very low	110 Å²	110	148.3 Å²	148.3	77%	0.769	79%	0.793	S	S	*	*			trans	-148.9	100.7	142.6	64.7	0	0	0	0	109.9
733	E	25.4	Very low	25.8	Very low	179 Å²	179	148.5 Å²	148.5	84%	0.836	80%	0.797	S	S	*	*			trans	-67.8	126.8	162.3	-152.3	166.4	-161.2	0	0	107.4
734	K	30.8	Very low	25.9	Very low	183 Å²	183	149.1 Å²	149.1	80%	0.796	80%	0.796	S	S	*	*			trans	-136.4	96.3	170.5	-86.7	-172.1	177.6	179.3	0	108.5
735	D	25.9	Very low	26.1	Very low	142 Å²	142	152 Å²	152	76%	0.759	81%	0.806	S	S	*	*			trans	-57.6	126.9	159.2	-65.4	-50	0	0	0	109.6
736	I	28.9	Very low	26.2	Very low	142 Å²	142	150.7 Å²	150.7	73%	0.728	80%	0.804	S	S	*	*			trans	-131.7	95.5	163.3	-28	175.2	0	0	0	107	L738	I736-L738 PolarHBondContact O-N 3.37Å
737	N	24	Very low	26.5	Very low	156 Å²	156	151.4 Å²	151.4	83%	0.834	81%	0.807	S	S	*	*			trans	-64.1	120.2	164.7	-76.4	-63.9	0	0	0	109.1
738	L	27	Very low	26.4	Very low	151 Å²	151	147.1 Å²	147.1	79%	0.791	80%	0.802	S	S	*	*			trans	-129.2	93.2	164.7	-88.2	163.2	0	0	0	109.8	I736	I736-L738 PolarHBondContact O-N 3.37Å
739	S	25.5	Very low	26.5	Very low	102 Å²	102	142 Å²	142	71%	0.713	79%	0.793	S	S	*	*			trans	23.6	119.9	142	54.6	0	0	0	0	120.1
740	V	23.4	Very low	26.6	Very low	132 Å²	132	143.9 Å²	143.9	80%	0.8	80%	0.795	S	S	*	*			trans	-50.4	132.9	154.9	174.9	0	0	0	0	112.4	M742	V740-M742 HydrophobicContact CG1-CB 4.43Å
741	S	26.6	Very low	26.6	Very low	117 Å²	117	142.1 Å²	142.1	82%	0.818	80%	0.797	S	S	*	*			trans	-134.6	83.2	155.1	60.4	0	0	0	0	108.7
742	M	25	Very low	26.9	Very low	173 Å²	173	143 Å²	143	85%	0.852	80%	0.798	S	S	*	*			trans	-89	108.2	163.7	-85.6	-175.8	57.1	0	0	108	V740	V740-M742 HydrophobicContact CG1-CB 4.43Å
743	S	26.9	Very low	26.7	Very low	124 Å²	124	142.8 Å²	142.8	87%	0.867	79%	0.792	S	S	*	*			trans	-75.1	122.1	166.7	36.5	0	0	0	0	109.5
744	Q	24.7	Very low	26.8	Very low	169 Å²	169	139.6 Å²	139.6	79%	0.79	79%	0.785	S	S	*	*			trans	-94.4	116.3	-177.5	-170.9	-179.7	25.7	0	0	107.5
745	E	28.8	Very low	26.5	Very low	198 Å²	198	137.5 Å²	137.5	93%	0.925	78%	0.781	S	S	*	*			trans	-125	129.9	161.9	-90.9	-172.3	164.5	0	0	110.2
746	N	27.7	Very low	26.6	Very low	134 Å²	134	136.7 Å²	136.7	72%	0.717	78%	0.781	S	S	*	*			trans	-93.5	131.4	-164.8	-72.4	-41.1	0	0	0	111.7
747	C	29.9	Very low	26.4	Very low	134 Å²	134	135 Å²	135	91%	0.905	78%	0.783	S	S	*	*			trans	-145.9	83.9	152	-75	0	0	0	0	106.4
748	S	25.6	Very low	26.7	Very low	104 Å²	104	134.2 Å²	134.2	73%	0.727	78%	0.783	S	S	*	*				61.6	111	85.2	-162.4	0	0	0	0	116.4
749	S	26.7	Very low	26.6	Very low	106 Å²	106	132.4 Å²	132.4	74%	0.741	78%	0.783	S	S	*	*			trans	71.3	127.7	143.9	-49.6	0	0	0	0	117.2
750	K	29.5	Very low	26.6	Very low	192 Å²	192	133 Å²	133	84%	0.835	79%	0.787	S	S	*	*				-173.2	114.9	52.6	-139.2	172.8	-175.6	178.1	0	107.2
751	V	26.3	Very low	27	Very low	136 Å²	136	132 Å²	132	82%	0.824	79%	0.787	S	S	*	*			trans	-113.6	109.1	172	174.5	0	0	0	0	106.9
752	T	28.7	Very low	26.9	Very low	120 Å²	120	135 Å²	135	74%	0.736	79%	0.787	S	S	*	*			trans	-93.3	98.7	174.6	-58.6	0	0	0	0	107.8	T754	T752-T754 PolarHBondContact O-N 3.05Å
753	T	24.7	Very low	27.1	Very low	105 Å²	105	132.9 Å²	132.9	64%	0.644	78%	0.784	S	S	*	*			trans	-86.6	98.5	174.9	-38.2	0	0	0	0	108.5	I755	T753-I755 HydrophobicContact CG2-CD1 4.43Å; T753-I755 HydrophobicContact CG2-CG1 3.99Å
754	T	26.7	Very low	27.1	Very low	111 Å²	111	132.3 Å²	132.3	68%	0.681	78%	0.778	S	S	*	*			trans	-95	104.2	170.2	-55.2	0	0	0	0	108.7	T752	T752-T754 PolarHBondContact O-N 3.05Å
755	I	24.7	Very low	27.4	Very low	140 Å²	140	130 Å²	130	72%	0.718	78%	0.78	S	S	*	*			trans	-93.7	108.4	173.5	-44.3	168.2	0	0	0	105.9	T753	T753-I755 HydrophobicContact CG2-CD1 4.43Å; T753-I755 HydrophobicContact CG2-CG1 3.99Å
756	T	27	Very low	27.4	Very low	124 Å²	124	130.4 Å²	130.4	76%	0.761	77%	0.773	S	S	*	*			trans	-129.5	104.2	168.5	29.3	0	0	0	0	109.4
757	S	24.7	Very low	27.5	Very low	108 Å²	108	135.9 Å²	135.9	76%	0.755	78%	0.784	S	S	*	*			trans	-88.4	118.6	169	4.1	0	0	0	0	108.1
758	T	30.1	Very low	27.6	Very low	138 Å²	138	138.1 Å²	138.1	85%	0.847	78%	0.778	S	S	*	*			trans	-139	117.9	161.2	53.1	0	0	0	0	109.9
759	S	25.4	Very low	27.7	Very low	113 Å²	113	136.8 Å²	136.8	79%	0.79	78%	0.78	S	S	*	*			trans	-72.6	154.1	177.4	51	0	0	0	0	114.1
760	S	24.9	Very low	28	Very low	114 Å²	114	138.2 Å²	138.2	80%	0.797	78%	0.784	S	S	*	*			trans	72.7	110.6	142.9	-179.6	0	0	0	0	119.1
761	S	31.7	Very low	28.2	Very low	113 Å²	113	134.3 Å²	134.3	79%	0.79	78%	0.777	S	S	*	*				-173.9	124.1	113.1	58.3	0	0	0	0	111.4
762	H	25.3	Very low	28.2	Very low	178 Å²	178	135.6 Å²	135.6	82%	0.824	78%	0.779	S	S	*	*			trans	-101.9	115.5	178.2	-158.3	-62.8	0	0	0	107.7
763	T	30	Very low	28.4	Very low	129 Å²	129	139 Å²	139	79%	0.791	78%	0.784	S	S	*	*			trans	-147.5	114.4	164.7	49.4	0	0	0	0	111
764	P	26.2	Very low	28.5	Very low	113 Å²	113	141 Å²	141	73%	0.734	79%	0.789	S	S	*	*			trans	-91.9	133.4	171	34	-26.6	0	0	0	109.6
765	S	30	Very low	28.8	Very low	119 Å²	119	141.8 Å²	141.8	83%	0.832	80%	0.796	S	S	*	*			trans	-150.3	131.2	167.9	-151.7	0	0	0	0	113.8
766	R	30.5	Very low	28.8	Very low	207 Å²	207	140.7 Å²	140.7	78%	0.781	80%	0.796	S	S	*	*			trans	97.7	81	141.9	-148.3	168.8	-174.2	178.9	1.8	118.7	K768	R766-K768 PolarHBondContact O-N 2.97Å
767	R	29	Very low	28.8	Very low	249 Å²	249	139.6 Å²	139.6	94%	0.94	79%	0.793	S	S	*	*			trans	-43.4	127.4	142.1	-92.4	177.8	171	171.1	-2.3	110.7
768	K	32.2	Very low	29	Very low	182 Å²	182	143 Å²	143	79%	0.791	80%	0.797	S	S	*	*			trans	-110.4	103.9	155	-81.9	-172.7	177.2	177.4	0	108	R766	R766-K768 PolarHBondContact O-N 2.97Å
769	G	27.6	Very low	29	Very low	75 Å²	75	145.6 Å²	145.6	77%	0.773	80%	0.797	S	S	*	*			trans	-81.3	128.5	162.7	0	0	0	0	0	108.9
770	V	33.7	Very low	29.3	Very low	136 Å²	136	148.4 Å²	148.4	82%	0.824	80%	0.803	S	S	*	*			trans	-113.2	133.3	166.8	175.8	0	0	0	0	107.6
771	T	32.2	Very low	29.4	Very low	111 Å²	111	147.8 Å²	147.8	68%	0.681	81%	0.805	S	S	*	*			trans	-79.3	133.6	-160.4	47.9	0	0	0	0	113.4	K773	T771-K773 PolarHBondContact O-N 2.89Å
772	N	27.9	Very low	29.4	Very low	162 Å²	162	147.8 Å²	147.8	87%	0.866	81%	0.805	S	S	*	*			trans	-62.5	125.1	160.5	-73.2	-14.7	0	0	0	109.9
773	K	31.8	Very low	29.4	Very low	192 Å²	192	145 Å²	145	84%	0.835	81%	0.806	S	S	*	*			trans	-112.6	115.1	164.4	-76.3	-161.1	175.3	-174.1	0	109.1	T771	T771-K773 PolarHBondContact O-N 2.89Å
774	I	28	Very low	29.2	Very low	148 Å²	148	147.5 Å²	147.5	76%	0.759	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-92.5	123.4	169.3	-64.7	163.8	0	0	0	106.9	T776	I774-T776 HydrophobicContact CG2-CG2 4.22Å
775	P	32	Very low	29.2	Very low	126 Å²	126	145.8 Å²	145.8	82%	0.818	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-99.4	124.4	158.6	6.7	13.7	0	0	0	109.7
776	T	25.5	Very low	29.1	Very low	118 Å²	118	146.4 Å²	146.4	72%	0.724	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-97.8	159.2	167.6	44	0	0	0	0	110.3	I774	I774-T776 HydrophobicContact CG2-CG2 4.22Å
777	S	26.8	Very low	29.2	Very low	101 Å²	101	143.3 Å²	143.3	71%	0.706	80%	0.801	S	S	*	*			trans	85.9	140.1	174.1	103.6	0	0	0	0	113.8
778	E	29.4	Very low	29.3	Very low	178 Å²	178	138.1 Å²	138.1	83%	0.832	79%	0.792	S	S	*	*			cis	-157.2	155.1	13.5	-124.1	149	165.9	0	0	110.2
779	K	28.8	Very low	29.1	Very low	194 Å²	194	138.2 Å²	138.2	84%	0.843	79%	0.793	S	S	*	*			trans	-64	131.5	169.1	-85.4	162.8	168.7	176.3	0	110.8
780	D	32.5	Very low	29.4	Very low	171 Å²	171	144.2 Å²	144.2	91%	0.914	80%	0.8	S	S	*	*			trans	-127.1	122.5	147.9	-87.7	-37.6	0	0	0	110.3
781	A	26.7	Very low	29.1	Very low	102 Å²	102	144.3 Å²	144.3	84%	0.843	80%	0.796	S	S	*	*			trans	-105.1	119.2	172.6	0	0	0	0	0	107.3
782	S	30.8	Very low	29.2	Very low	113 Å²	113	145.6 Å²	145.6	79%	0.79	81%	0.808	S	S	*	*			trans	-138	113.4	170.9	63	0	0	0	0	112
783	S	27.2	Very low	29.3	Very low	120 Å²	120	143.4 Å²	143.4	84%	0.839	81%	0.806	S	S	*	*			trans	66.7	104.2	137.5	-148.7	0	0	0	0	120.7
784	F	24.1	Very low	29.2	Very low	181 Å²	181	139.2 Å²	139.2	79%	0.794	80%	0.8	S	S	*	*			trans	-44.2	142.4	142.5	-92.5	-108.5	0	0	0	112.9
785	G	27.8	Very low	29.7	Very low	76 Å²	76	138 Å²	138	78%	0.784	80%	0.802	S	S	*	*			trans	-141.4	82.8	165.9	0	0	0	0	0	109.2
786	N	26.7	Very low	29.3	Very low	133 Å²	133	141 Å²	141	71%	0.711	80%	0.802	S	S	*	*			trans	-78.5	128.6	167.2	-85.1	-29.1	0	0	0	108.7
787	N	32.2	Very low	29.5	Very low	142 Å²	142	143.6 Å²	143.6	76%	0.759	81%	0.811	S	S	*	*			trans	-135.5	109.7	161	-80.2	-36.7	0	0	0	109.9
788	N	31.3	Very low	29.4	Very low	139 Å²	139	144 Å²	144	74%	0.743	81%	0.809	S	S	*	*				57.9	106.5	124.7	-54.8	-19.3	0	0	0	116.8
789	K	27.4	Very low	29.3	Very low	185 Å²	185	141.7 Å²	141.7	80%	0.804	81%	0.808	S	S	*	*			cis	63.8	84.2	47.3	-137.5	-175.6	-168.2	-173.9	0	112.4
790	E	35.2	Very low	29.2	Very low	200 Å²	200	136.1 Å²	136.1	94%	0.935	80%	0.798	S	S	*	*			trans	-125	129.3	154	-80.4	-171.4	165.2	0	0	109.2
791	D	27.9	Very low	28.8	Very low	139 Å²	139	134 Å²	134	74%	0.743	79%	0.791	S	S	*	*			trans	-83.6	141.2	179.2	-65.5	-62.6	0	0	0	110.5
792	C	33.2	Very low	28.9	Very low	137 Å²	137	136.2 Å²	136.2	93%	0.926	79%	0.794	S	S	*	*			trans	-160.4	115.8	146.3	-99.7	0	0	0	0	113.2
793	S	30	Very low	28.6	Very low	117 Å²	117	134.2 Å²	134.2	82%	0.818	79%	0.792	S	S	*	*			trans	-13.2	139.8	157.9	-167.3	0	0	0	0	122
794	S	30.2	Very low	28.6	Very low	103 Å²	103	133.8 Å²	133.8	72%	0.72	79%	0.789	S	S	*	*			trans	-42.7	165.4	149.1	-44.6	0	0	0	0	114.1
795	P	37.4	Very low	28.7	Very low	122 Å²	122	129.6 Å²	129.6	79%	0.792	78%	0.782	S	S	*	*			cis	-148.7	158.1	34.7	39.7	-17.1	0	0	0	120
796	K	24.2	Very low	29	Very low	189 Å²	189	134.9 Å²	134.9	82%	0.822	78%	0.783	S	S	*	*			trans	10.7	118.4	139.3	-157.4	173.4	-169.8	175.3	0	119.9
797	L	29.5	Very low	29	Very low	174 Å²	174	135.1 Å²	135.1	91%	0.911	79%	0.79	S	S	*	*			trans	-150.2	129.9	135.4	-133.9	95.7	0	0	0	110.9
798	T	25	Very low	29.2	Very low	108 Å²	108	133.3 Å²	133.3	66%	0.663	80%	0.795	S	S	*	*			trans	-79.4	154.3	170.5	45.1	0	0	0	0	110.3
799	T	27.4	Very low	29.1	Very low	131 Å²	131	130.7 Å²	130.7	80%	0.804	80%	0.8	S	S	*	*				149.5	130.1	127.5	-52.6	0	0	0	0	113.2
800	A	25.8	Very low	29.2	Very low	77 Å²	77	133.6 Å²	133.6	64%	0.636	81%	0.806	S	S	*	*			trans	60.9	116.3	153	0	0	0	0	0	120.5
801	T	23.7	Very low	29	Very low	126 Å²	126	134 Å²	134	77%	0.773	81%	0.805	S	S	*	*				79.1	140.1	78.9	-46.9	0	0	0	0	112.6
802	T	29.7	Very low	29.1	Very low	148 Å²	148	138.5 Å²	138.5	91%	0.908	81%	0.811	S	S	*	*			trans	89.8	126.5	-176.1	75.3	0	0	0	0	112.3
803	G	24.4	Very low	29.1	Very low	72 Å²	72	138.7 Å²	138.7	74%	0.742	81%	0.808	S	S	*	*			cis	153	136.7	7.6	0	0	0	0	0	107
804	S	26.4	Very low	29.3	Very low	111 Å²	111	138.5 Å²	138.5	78%	0.776	80%	0.802	S	S	*	*			trans	83.1	117.8	151.2	-154.9	0	0	0	0	120.8
805	S	26.7	Very low	29.3	Very low	93 Å²	93	141.1 Å²	141.1	65%	0.65	81%	0.807	S	S	*	*			trans	79	112.9	132.1	72.7	0	0	0	0	120
806	K	34.1	Very low	29.1	Very low	187 Å²	187	141.4 Å²	141.4	81%	0.813	80%	0.802	S	S	*	*				172.2	102.4	109.5	-92.2	172.8	-177.8	179.9	0	110.3
807	T	27.7	Very low	29.5	Very low	138 Å²	138	137.3 Å²	137.3	85%	0.847	80%	0.797	S	S	*	*				63.2	100.6	114.9	58.7	0	0	0	0	116.5
808	A	35.8	Very low	29.7	Very low	104 Å²	104	138.6 Å²	138.6	86%	0.86	80%	0.796	S	S	*	*			trans	-140.6	110.9	149.1	0	0	0	0	0	108.1
809	G	28.4	Very low	30	Very low	84 Å²	84	140.9 Å²	140.9	87%	0.866	80%	0.803	S	S	*	*			trans	-75.5	135.3	-179.9	0	0	0	0	0	111.8
810	R	31	Very low	30.5	Very low	246 Å²	246	142.5 Å²	142.5	93%	0.928	81%	0.805	S	S	*	*			trans	-145.8	122.1	155	-155.9	166.9	-178.9	168.4	-0.9	109.8
811	K	29.5	Very low	31	Very low	207 Å²	207	143.8 Å²	143.8	90%	0.9	81%	0.807	S	S	*	*			trans	-62.1	123.9	-174	-61.1	167.6	177.7	177.5	0	110.5
812	R	31.3	Very low	31.6	Very low	234 Å²	234	143.7 Å²	143.7	88%	0.883	81%	0.809	S	S	*	*			trans	-130.6	115.3	160.2	-152.3	176.9	-151.9	177.8	5.7	107.6	T814	R812-T814 PolarHBondContact O-N 3.38Å
813	V	32	Very low	31.7	Very low	142 Å²	142	141.2 Å²	141.2	86%	0.861	80%	0.803	S	S	*	*			trans	-72.4	117.1	179.9	174.1	0	0	0	0	107.6
814	T	34.3	Very low	32.2	Very low	112 Å²	112	147.9 Å²	147.9	69%	0.687	81%	0.811	S	S	*	*			trans	-99.3	131.3	174.1	45.8	0	0	0	0	109.7	R812 D816	R812-T814 PolarHBondContact O-N 3.38Å; T814-D816 PolarHBondContact O-N 3.44Å
815	L	31.6	Very low	32.5	Very low	159 Å²	159	154.4 Å²	154.4	83%	0.832	82%	0.819	S	S	*	*			trans	-90.9	80.2	-178.5	-166.8	140.7	0	0	0	107.5
816	D	32.4	Very low	32.8	Very low	128 Å²	128	154.7 Å²	154.7	68%	0.684	82%	0.821	S	S	*	*			trans	-110	88.2	174.9	-84	-33.3	0	0	0	109.2	T814	T814-D816 PolarHBondContact O-N 3.44Å
817	S	32.9	Very low	32.6	Very low	102 Å²	102	153.6 Å²	153.6	71%	0.713	82%	0.824	S	S	*	*			trans	-161.3	46	165.3	-74.8	0	0	0	0	112.1
818	F	33.7	Very low	32.9	Very low	202 Å²	202	152.3 Å²	152.3	89%	0.886	82%	0.816	S	S	*	*			trans	-149.6	66.9	162.7	-73.7	-70	0	0	0	110.6
819	L	31.5	Very low	32.7	Very low	156 Å²	156	154.3 Å²	154.3	82%	0.817	81%	0.812	S	S	*	*			trans	-122.4	78.4	168.3	-92.3	157.5	0	0	0	108.4
820	I	37.5	Very low	32.9	Very low	164 Å²	164	158.2 Å²	158.2	84%	0.841	81%	0.812	S	S	*	*			trans	-112.8	109.3	156.5	-60.7	175.9	0	0	0	105.7
821	P	36.8	Very low	32.8	Very low	104 Å²	104	151.7 Å²	151.7	68%	0.675	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-72.4	145.5	-175.1	27.9	-32	0	0	0	111.5
822	P	35.4	Very low	33	Very low	125 Å²	125	146.8 Å²	146.8	81%	0.812	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-74.6	138.8	-174.4	29.6	-33.1	0	0	0	111.9
823	A	32.7	Very low	33	Very low	95 Å²	95	144.6 Å²	144.6	79%	0.785	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-61	132.5	177.8	0	0	0	0	0	112	R825	A823-R825 PolarHBondContact O-N 3.03Å; A823-R825 VanDerWaalsContact O-N 3.12Å
824	K	34.7	Very low	33	Very low	212 Å²	212	145.1 Å²	145.1	92%	0.922	79%	0.792	S	S	*	*			trans	-59.4	107.9	173.7	-65	176.2	178.1	178	0	109.8
825	R	32.1	Very low	32.9	Very low	249 Å²	249	147.6 Å²	147.6	94%	0.94	80%	0.796	S	S	*	*			trans	-86.4	112.5	163.4	-77.9	-173.8	166.8	178.6	-3.4	108.6	A823	A823-R825 PolarHBondContact O-N 3.03Å; A823-R825 VanDerWaalsContact O-N 3.12Å
826	S	34.4	Very low	32.9	Very low	99 Å²	99	144.8 Å²	144.8	69%	0.692	79%	0.789	S	S	*	*			trans	-64	130.7	171	47	0	0	0	0	110.7	V828	S826-V828 PolarHBondContact O-N 3.44Å; S826-V828 VanDerWaalsContact O-N 3.09Å
827	N	30	Very low	33.1	Very low	164 Å²	164	145.9 Å²	145.9	88%	0.877	80%	0.796	S	S	*	*			trans	-60.7	104.5	164.6	-96.7	-37.2	0	0	0	109.1
828	V	33.5	Very low	33.3	Very low	111 Å²	111	149.8 Å²	149.8	67%	0.673	80%	0.802	S	S	*	*			trans	-97.8	106.2	164.8	179.3	0	0	0	0	106.2	S826 L830	S826-V828 PolarHBondContact O-N 3.44Å; S826-V828 VanDerWaalsContact O-N 3.09Å; V828-L830 PolarHBondContact O-N 2.88Å
829	N	31.6	Very low	33.4	Very low	145 Å²	145	148.1 Å²	148.1	78%	0.775	80%	0.803	S	S	*	*			trans	-62.9	110.1	167.1	-80.5	-38.8	0	0	0	108.1	S831	N829-S831 PolarHBondContact O-N 3.19Å
830	L	31.4	Very low	33.4	Very low	166 Å²	166	146.5 Å²	146.5	87%	0.869	80%	0.803	S	S	*	*			trans	-79	91.4	167.6	-83.3	152.7	0	0	0	107.9	V828 S832	V828-L830 PolarHBondContact O-N 2.88Å; L830-S832 PolarHBondContact O-N 3.21Å
831	S	30.7	Very low	33.2	Very low	109 Å²	109	144.5 Å²	144.5	76%	0.762	80%	0.798	S	S	*	*			trans	-70.7	111.7	162.8	-52.2	0	0	0	0	107.8	N829 E833	N829-S831 PolarHBondContact O-N 3.19Å; S831-E833 PolarHBondContact O-N 2.94Å
832	S	33	Very low	33.1	Very low	104 Å²	104	147.3 Å²	147.3	73%	0.727	81%	0.806	S	S	*	*			trans	-71.8	105	170.9	51.5	0	0	0	0	109.6	L830 I834	L830-S832 PolarHBondContact O-N 3.21Å; S832-I834 PolarHBondContact O-N 2.88Å
833	E	31.1	Very low	33.3	Very low	189 Å²	189	147.9 Å²	147.9	88%	0.883	80%	0.801	S	S	*	*			trans	-81.9	95.8	167.3	-163.6	153.5	-163.6	0	0	107.4	S831 Q835	S831-E833 PolarHBondContact O-N 2.94Å; E833-Q835 PolarHBondContact O-N 3.46Å
834	I	32.5	Very low	33.5	Very low	152 Å²	152	150.8 Å²	150.8	78%	0.779	80%	0.803	S	S	*	*			trans	-84.3	100.7	170.5	-64.9	172.3	0	0	0	105.7	S832 S836	S832-I834 PolarHBondContact O-N 2.88Å; I834-S836 PolarHBondContact O-N 3.48Å
835	Q	32	Very low	33.6	Very low	164 Å²	164	146 Å²	146	77%	0.766	80%	0.797	S	S	*	*			trans	-73.3	115.9	172	-162	156.5	-9.5	0	0	108	E833 D837	E833-Q835 PolarHBondContact O-N 3.46Å; Q835-D837 PolarHBondContact O-N 3.39Å
836	S	32.1	Very low	33.8	Very low	100 Å²	100	147.5 Å²	147.5	70%	0.699	81%	0.81	S	S	*	*			trans	-77.7	101	178	51	0	0	0	0	110	I834 E838	I834-S836 PolarHBondContact O-N 3.48Å; S836-E838 PolarHBondContact O-N 3.33Å
837	D	36.2	Very low	33.8	Very low	152 Å²	152	150 Å²	150	81%	0.813	82%	0.816	S	S	*	*			trans	-86	85	163.6	-70.6	-30.1	0	0	0	108.3	Q835	Q835-D837 PolarHBondContact O-N 3.39Å
838	E	36.7	Very low	34	Very low	183 Å²	183	149.2 Å²	149.2	86%	0.855	81%	0.813	S	S	*	*			trans	-110.7	82.6	166.3	-70.8	-144.8	170.3	0	0	109.9	S836	S836-E838 PolarHBondContact O-N 3.33Å
839	D	34.9	Very low	34	Very low	168 Å²	168	151.3 Å²	151.3	90%	0.898	82%	0.82	S	S	*	*			trans	-118.4	90.4	162.8	-85.8	-28.6	0	0	0	108.5
840	C	32	Very low	34.2	Very low	121 Å²	121	151.7 Å²	151.7	82%	0.818	82%	0.823	S	S	*	*			trans	-150.8	86	160.8	-142.9	0	0	0	0	112.6
841	V	33.9	Very low	34.4	Very low	123 Å²	123	150.8 Å²	150.8	75%	0.745	82%	0.82	S	S	*	*			trans	22.1	98.7	138.1	-169.6	0	0	0	0	116.1	I843	V841-I843 HydrophobicContact CG1-CG1 4.18Å; V841-I843 PolarHBondContact O-N 3.11Å
842	I	34.4	Very low	34.6	Very low	162 Å²	162	153.6 Å²	153.6	83%	0.831	82%	0.824	S	S	*	*			trans	-74	113	158.4	-63	174.6	0	0	0	107.3	D844	I842-D844 PolarHBondContact O-N 3.02Å
843	I	38.8	Very low	34.7	Very low	137 Å²	137	157.1 Å²	157.1	70%	0.703	83%	0.831	S	S	*	*			trans	-77.1	107.2	172	-58.1	176.2	0	0	0	107.3	V841 S845	V841-I843 HydrophobicContact CG1-CG1 4.18Å; V841-I843 PolarHBondContact O-N 3.11Å; I843-S845 PolarHBondContact O-N 3.38Å
844	D	37.5	Very low	35	Very low	157 Å²	157	154.7 Å²	154.7	84%	0.84	83%	0.827	S	S	*	*			trans	-56.7	107.4	167.7	-99.6	-26.6	0	0	0	109.4	I842	I842-D844 PolarHBondContact O-N 3.02Å
845	S	37.2	Very low	35.2	Very low	112 Å²	112	154.9 Å²	154.9	78%	0.783	83%	0.831	S	S	*	*			trans	-93.4	113.3	165.8	-63.2	0	0	0	0	108.3	I843	I843-S845 PolarHBondContact O-N 3.38Å
846	K	36.9	Very low	35.5	Very low	280 Å²	280	154.1 Å²	154.1	100%	1.217	84%	0.837	S	S	*	*			trans	-77.7	0	163.6	-135.1	179.5	-171.2	176.7	0	110.4

Retrieved 846 of 846 residues in 455.4 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).