A0A3Q0KTX1_SCHMA Loading...

BZIP domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KTX1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 845 aa.

						>A0A3Q0KTX1_SCHMA|A0A3Q0KTX1
MHTAQKRYCTQNQPTTVTTDSSINQMENEDWNRFLENDFTKLMGITSQKNYPFNDQSTICIPNDTSTTSTIINNNNIPITYKMNDNKNGSVIKNILGHVKELQKNYSNDNNREITPNCDCSDNDLSWTKDVFNSNHYATGSLALTSVFINDTKMQNNHPVSNEFIFGEEYQQSNYLYDQHFNSSPVQLCSQTDYSVMRTLDYPYIVNNEHPHYLSEHIQSSDTEYLNYHNNLHMDLRSNVSDFTDTSIASNPDNQNRSESKAKSSIMFLNDHLCEAQAPTIENLKSCNRLSHPDSFEDGWLDGQNSIHHCANWSVDWTNNTESSSRSNYHSSNSKHIPINFDSFRCLGATSYIGARSPNCKKDCLATKNSESVDHSYKGVPNLSSNHQFDSGPKLCNEFGSSLSPQSESTKLCNVISNTVSEVPIPNAFNLSSGAYFWLYNSQCKGPKASPLISLTNTMILNNSGEDDQSSLTENCPSNVYQDDFVSSSASSRAINPIIHYPISPLSLPGYPFVVFEDPVQRRYDLVHCSKLRRGDGNDVTPNLMRLRSMGEELAHLNKNITAQGELIAAGASSVLDQSDNNVDFKIIQDFSGSIFNSKIVEQAKREKNKLASKICRLKKKAFHEANKIKYLGLEIEYNELASVIVKIKELITKALRNNLPPENFRYELASQQHFYMSENQLNKVDLSSSSHAGSISLAQSTVKLFPNISGSVFKQALLFYETTHVTRTAERMDILVDEVIQNYSFPCPLSSSRTDLFERDNQSLTSNRKYYTPLLQALTNSNMYCNNHDGDKSPDSRNSNAIFHEAPEINKANDIQQDTQKQQCPSTSKLNYPRPPPEFKLIYE
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.6	Very low	26.7	Very low	189 Å²	189	153.8 Å²	153.8	93%	0.931	77%	0.772	S	S	*	*				0	155.9	0	-97.7	-55.8	-178.3	0	0	110.5
2	H	26.4	Very low	26.7	Very low	160 Å²	160	152.3 Å²	152.3	74%	0.741	77%	0.768	S	S	*	*			trans	-32.2	128.7	-168.8	-92.4	-84.8	0	0	0	120.9
3	T	24.9	Very low	26.6	Very low	121 Å²	121	152.6 Å²	152.6	74%	0.742	77%	0.765	S	S	*	*				29.7	134.2	129.8	52.8	0	0	0	0	120.6
4	A	27.9	Very low	26.3	Very low	91 Å²	91	150.3 Å²	150.3	75%	0.752	77%	0.766	S	S	*	*			cis	-163	145.3	-3.7	0	0	0	0	0	111.9
5	Q	27	Very low	26.4	Very low	171 Å²	171	148.7 Å²	148.7	80%	0.799	77%	0.767	S	S	*	*			trans	-83.9	121.4	161.7	-72.7	-179.1	-16.1	0	0	109.6
6	K	28.6	Very low	26.3	Very low	168 Å²	168	147 Å²	147	73%	0.73	77%	0.766	S	S	*	*			trans	-98.4	88.2	163	-89.5	-172.4	162.9	-156.8	0	110	Y8	K6-Y8 HydrophobicContact CB-CE2 4.44Å; K6-Y8 HydrophobicContact CD-CE2 3.9Å; K6-Y8 HydrophobicContact CG-CE2 4.17Å; K6-Y8 PolarHBondContact NZ-OH 2.93Å
7	R	24.5	Very low	26.3	Very low	209 Å²	209	145.2 Å²	145.2	79%	0.789	76%	0.762	S	S	*	*			trans	-80.9	138.8	151	-67.8	-179.4	179.2	170.8	-0.6	107.5
8	Y	26.2	Very low	26.1	Very low	175 Å²	175	143.8 Å²	143.8	69%	0.686	76%	0.761	S	S	*	*			trans	-123.5	121.5	162.3	-86.5	-85	0	0	0	108.1	K6	K6-Y8 HydrophobicContact CB-CE2 4.44Å; K6-Y8 HydrophobicContact CD-CE2 3.9Å; K6-Y8 HydrophobicContact CG-CE2 4.17Å; K6-Y8 PolarHBondContact NZ-OH 2.93Å
9	C	22.4	Very low	26.1	Very low	116 Å²	116	141.8 Å²	141.8	78%	0.784	76%	0.755	S	S	*	*			trans	-127.1	108.4	171.1	-66.8	0	0	0	0	107.9
10	T	27.7	Very low	26	Very low	120 Å²	120	142.3 Å²	142.3	74%	0.736	76%	0.758	S	S	*	*			trans	-156.1	112.9	172.1	46.1	0	0	0	0	103.7
11	Q	25.1	Very low	25.9	Very low	172 Å²	172	141.6 Å²	141.6	80%	0.804	76%	0.764	S	S	*	*			cis	63.8	137.1	36.5	-154	172.8	9.9	0	0	112.7
12	N	27	Very low	25.5	Very low	135 Å²	135	137.2 Å²	137.2	72%	0.722	75%	0.752	S	S	*	*			trans	77.1	139.5	-169.3	-47	-24.6	0	0	0	113.9
13	Q	25	Very low	25.6	Very low	157 Å²	157	137.7 Å²	137.7	73%	0.734	76%	0.758	S	S	*	*			cis	-161.7	151.4	-20.4	-121.8	171	-4.1	0	0	106.9	T15	Q13-T15 PolarHBondContact O-N 3.29Å
14	P	23.4	Very low	25.7	Very low	120 Å²	120	139.4 Å²	139.4	78%	0.779	76%	0.763	S	S	*	*			trans	-77.4	105.9	179.5	30.1	-32.7	0	0	0	111.3	T16	P14-T16 PolarHBondContact O-N 3.27Å; P14-T16 VanDerWaalsContact O-N 3.17Å
15	T	28.1	Very low	25.7	Very low	127 Å²	127	143.5 Å²	143.5	78%	0.779	77%	0.766	S	S	*	*			trans	-79.2	96	179.1	-36.6	0	0	0	0	111.1	Q13 V17	Q13-T15 PolarHBondContact O-N 3.29Å; T15-V17 HydrophobicContact CG2-CG2 4.48Å; T15-V17 PolarHBondContact O-N 3.39Å
16	T	24.6	Very low	25.7	Very low	121 Å²	121	142 Å²	142	74%	0.742	76%	0.761	S	S	*	*			trans	-70.9	99.4	175.3	-40.4	0	0	0	0	110.6	P14 T18	P14-T16 PolarHBondContact O-N 3.27Å; P14-T16 VanDerWaalsContact O-N 3.17Å; T16-T18 PolarHBondContact O-N 3.35Å
17	V	26.3	Very low	25.9	Very low	116 Å²	116	140.6 Å²	140.6	70%	0.703	76%	0.757	S	S	*	*			trans	-89.6	101	171.6	179.1	0	0	0	0	109.2	T15	T15-V17 HydrophobicContact CG2-CG2 4.48Å; T15-V17 PolarHBondContact O-N 3.39Å
18	T	23.2	Very low	26.4	Very low	121 Å²	121	137 Å²	137	74%	0.742	75%	0.754	S	S	*	*			trans	-102.2	89.1	178	-45.1	0	0	0	0	110.3	T16	T16-T18 PolarHBondContact O-N 3.35Å
19	T	25.5	Very low	26.8	Very low	105 Å²	105	136.3 Å²	136.3	64%	0.644	76%	0.756	S	S	*	*			trans	-145.7	105.6	169	46.7	0	0	0	0	112.3
20	D	24.1	Very low	27.7	Very low	152 Å²	152	133.8 Å²	133.8	81%	0.813	74%	0.735	S	S	*	*			trans	61.8	138.4	138.2	-54.2	-30.6	0	0	0	123	S22	D20-S22 PolarHBondContact O-N 3.15Å
21	S	23.3	Very low	27.9	Very low	127 Å²	127	135 Å²	135	89%	0.888	73%	0.726	S	S	*	*			trans	-87.8	84.1	-172.8	55.9	0	0	0	0	113
22	S	25	Very low	28.5	Very low	97 Å²	97	131.8 Å²	131.8	68%	0.678	72%	0.715	S	S	*	*			trans	-159.5	81.3	167.3	60.6	0	0	0	0	115	D20	D20-S22 PolarHBondContact O-N 3.15Å
23	I	28.7	Very low	29.1	Very low	171 Å²	171	131.8 Å²	131.8	88%	0.877	71%	0.705	S	S	*	*			trans	-146.3	108.6	140.6	-84.8	119	0	0	0	107.1
24	N	26.2	Very low	29.6	Very low	156 Å²	156	130.4 Å²	130.4	83%	0.834	70%	0.696	S	S	*	*			trans	-135.6	157.6	164.1	-102.2	-48.1	0	0	0	105.3
25	Q	27.6	Very low	30.3	Very low	178 Å²	178	128.5 Å²	128.5	83%	0.832	68%	0.679	S	S	*	*			trans	75.7	91.3	-172.3	-50	168.6	-0	0	0	113.7
26	M	28.4	Very low	30.8	Very low	140 Å²	140	129.2 Å²	129.2	69%	0.69	67%	0.674	S	S	*	*			trans	-114.9	126.9	143.3	-172.9	170.8	69.4	0	0	105.5	D30	M26-D30 HydrophobicContact CG-CB 4.39Å
27	E	32.7	Very low	31.4	Very low	137 Å²	137	128 Å²	128	64%	0.64	66%	0.663	S	S	*	*			trans	-86.8	157.9	-161.8	-60.8	-168.9	120.9	0	0	113.1	E29 D30	E27-E29 PolarHBondContact O-N 3.48Å; E27-D30 PolarHBondContact O-N 3.25Å
28	N	34.9	Very low	32.1	Very low	134 Å²	134	125.4 Å²	125.4	72%	0.717	65%	0.645	S	S	*	*	H	α-helix	trans	-60.1	-19.1	-174.7	-79.9	-44	0	0	0	114.1	N32	N28-N32 PolarHBondContact O-N 3.07Å; N28-N32 PolarHBondContact O-ND2 3.27Å
29	E	34.9	Very low	32.8	Very low	160 Å²	160	123.1 Å²	123.1	75%	0.748	63%	0.625	S	S	*	*	H	α-helix	trans	-75.4	-31.9	-179.4	-57.5	-164	167.9	0	0	112.5	E27 R33	E27-E29 PolarHBondContact O-N 3.48Å; E29-R33 WeakPolarHBondContact O-CB 3.42Å; E29-R33 PolarHBondContact O-N 3.28Å
30	D	39.7	Very low	33.3	Very low	63 Å²	63	121.8 Å²	121.8	34%	0.337	62%	0.617	S	S	.	*	H	α-helix	trans	-65.2	-42	173.4	-79	-42.6	0	0	0	111.8	M26 E27 N32 R33 F34	M26-D30 HydrophobicContact CG-CB 4.39Å; E27-D30 PolarHBondContact O-N 3.25Å; D30-N32 PolarHBondContact O-N 3.43Å; D30-R33 PolarHBondContact O-N 3.47Å; D30-R33 IonicContact OD1-CZ 3.15Å; D30-R33 IonicContact OD1-NH1 2.76Å; D30-R33 PolarHBondContact OD1-NH1 3.34Å; D30-R33 IonicContact OD1-NH2 2.69Å; D30-R33 PolarHBondContact OD1-NH2 3.17Å; D30-F34 VanDerWaalsContact O-CB 3.31Å; D30-F34 WeakPolarHBondContact O-CB 3.45Å; D30-F34 PolarHBondContact O-N 3.21Å
31	W	33.2	Very low	34.2	Very low	146 Å²	146	121.5 Å²	121.5	55%	0.553	61%	0.608	S	S	*	*	H	α-helix	trans	-61.9	-41.2	178.7	-107.9	102.1	0	0	0	112.8	L35	W31-L35 HydrophobicContact CE3-CD1 4.06Å; W31-L35 HydrophobicContact CE3-CG 4.17Å; W31-L35 HydrophobicContact CZ3-CD1 4.47Å; W31-L35 HydrophobicContact CZ3-CD2 4.46Å; W31-L35 HydrophobicContact CZ3-CG 4.41Å; W31-L35 VanDerWaalsContact O-CG 3.32Å; W31-L35 WeakPolarHBondContact O-CG 3.46Å; W31-L35 PolarHBondContact O-N 3.46Å; W31-L35 VanDerWaalsContact O-N 3.12Å
32	N	35.9	Very low	34.8	Very low	104 Å²	104	120 Å²	120	56%	0.556	59%	0.59	S	S	*	*	H	α-helix	trans	-70.1	-43.4	176.7	-74.2	-76.5	0	0	0	111.4	N28 D30 F34 L35 E36	N28-N32 PolarHBondContact O-N 3.07Å; N28-N32 PolarHBondContact O-ND2 3.27Å; D30-N32 PolarHBondContact O-N 3.43Å; N32-F34 VanDerWaalsContact C-N 3.31Å; N32-F34 PolarHBondContact O-N 3.29Å; N32-L35 PolarHBondContact O-N 3.24Å; N32-E36 WeakPolarHBondContact O-CB 3.04Å; N32-E36 PolarHBondContact O-N 2.72Å
33	R	40.9	Very low	35.1	Very low	136 Å²	136	120.9 Å²	120.9	51%	0.513	59%	0.585	S	S	.	*	H	α-helix	trans	-65.4	-32.9	178	-165.6	178.6	74.1	-96.5	-4.5	112.7	E29 D30 N37	E29-R33 WeakPolarHBondContact O-CB 3.42Å; E29-R33 PolarHBondContact O-N 3.28Å; D30-R33 PolarHBondContact O-N 3.47Å; D30-R33 IonicContact OD1-CZ 3.15Å; D30-R33 IonicContact OD1-NH1 2.76Å; D30-R33 PolarHBondContact OD1-NH1 3.34Å; D30-R33 IonicContact OD1-NH2 2.69Å; D30-R33 PolarHBondContact OD1-NH2 3.17Å; R33-N37 WeakPolarHBondContact CG-ND2 3.38Å; R33-N37 WeakPolarHBondContact O-CB 3.28Å; R33-N37 PolarHBondContact O-N 2.83Å; R33-N37 PolarHBondContact O-ND2 3.29Å
34	F	34.6	Very low	35	Very low	127 Å²	127	114.5 Å²	114.5	56%	0.557	56%	0.561	S	S	*	*	H	α-helix	trans	-64.8	-54	171.8	179.1	-105.3	0	0	0	111.1	D30 N32 E36 N37 D38	D30-F34 VanDerWaalsContact O-CB 3.31Å; D30-F34 WeakPolarHBondContact O-CB 3.45Å; D30-F34 PolarHBondContact O-N 3.21Å; N32-F34 VanDerWaalsContact C-N 3.31Å; N32-F34 PolarHBondContact O-N 3.29Å; F34-E36 VanDerWaalsContact C-N 3.31Å; F34-E36 PolarHBondContact O-N 2.93Å; F34-N37 PolarHBondContact O-N 3.27Å; F34-D38 PolarHBondContact O-N 3.09Å
35	L	37.9	Very low	35.2	Very low	81 Å²	81	113.7 Å²	113.7	42%	0.424	56%	0.555	S	S	.	*	H	α-helix	trans	-56.8	-41.9	178.6	-75.3	169.9	0	0	0	112.7	W31 N32 F39	W31-L35 HydrophobicContact CE3-CD1 4.06Å; W31-L35 HydrophobicContact CE3-CG 4.17Å; W31-L35 HydrophobicContact CZ3-CD1 4.47Å; W31-L35 HydrophobicContact CZ3-CD2 4.46Å; W31-L35 HydrophobicContact CZ3-CG 4.41Å; W31-L35 VanDerWaalsContact O-CG 3.32Å; W31-L35 WeakPolarHBondContact O-CG 3.46Å; W31-L35 PolarHBondContact O-N 3.46Å; W31-L35 VanDerWaalsContact O-N 3.12Å; N32-L35 PolarHBondContact O-N 3.24Å; L35-F39 VanDerWaalsContact O-CB 3.28Å; L35-F39 WeakPolarHBondContact O-CB 3.38Å; L35-F39 WeakPolarHBondContact O-CD2 3.35Å; L35-F39 PolarHBondContact O-N 3.02Å
36	E	38.5	Very low	35.2	Very low	142 Å²	142	110 Å²	110	66%	0.664	55%	0.545	S	S	*	.	H	α-helix	trans	-75.5	-39.4	-174.5	-167.3	159.2	-124.7	0	0	113.3	N32 F34 T40	N32-E36 WeakPolarHBondContact O-CB 3.04Å; N32-E36 PolarHBondContact O-N 2.72Å; F34-E36 VanDerWaalsContact C-N 3.31Å; F34-E36 PolarHBondContact O-N 2.93Å; E36-T40 WeakPolarHBondContact O-CB 3.38Å; E36-T40 PolarHBondContact O-N 3.36Å; E36-T40 VanDerWaalsContact O-N 3.12Å; E36-T40 PolarHBondContact O-OG1 3.18Å
37	N	38.7	Very low	35	Very low	95 Å²	95	108.8 Å²	108.8	51%	0.508	55%	0.55	S	S	.	*	H	α-helix	trans	-66.4	-45	177.5	-81.7	-60.5	0	0	0	112.4	R33 F34 T40 K41	R33-N37 WeakPolarHBondContact CG-ND2 3.38Å; R33-N37 WeakPolarHBondContact O-CB 3.28Å; R33-N37 PolarHBondContact O-N 2.83Å; R33-N37 PolarHBondContact O-ND2 3.29Å; F34-N37 PolarHBondContact O-N 3.27Å; N37-T40 PolarHBondContact O-N 3.4Å; N37-K41 PolarHBondContact O-N 3.04Å
38	D	41.1	Very low	34.8	Very low	61 Å²	61	110.5 Å²	110.5	33%	0.326	56%	0.558	S	S	.	*	H	α-helix	trans	-78.9	-28.4	-178.9	-73.6	-21.4	0	0	0	112.6	F34 T40 K41 L42	F34-D38 PolarHBondContact O-N 3.09Å; D38-T40 VanDerWaalsContact C-N 3.26Å; D38-T40 PolarHBondContact O-N 2.71Å; D38-K41 PolarHBondContact O-N 2.81Å; D38-K41 WeakPolarHBondContact OD1-CD 3.43Å; D38-K41 WeakPolarHBondContact OD1-CE 3.31Å; D38-K41 IonicContact OD1-NZ 2.71Å; D38-K41 PolarHBondContact OD1-NZ 3.12Å; D38-L42 VanDerWaalsContact O-CB 3.31Å; D38-L42 WeakPolarHBondContact O-CB 3.35Å; D38-L42 PolarHBondContact O-N 2.83Å
39	F	37	Very low	34.4	Very low	73 Å²	73	112.4 Å²	112.4	32%	0.32	56%	0.56	S	S	.	*	H	α-helix	trans	-59.5	-37.1	164.8	-109.1	-92.4	0	0	0	112.4	L35 L42 M43 K649	L35-F39 VanDerWaalsContact O-CB 3.28Å; L35-F39 WeakPolarHBondContact O-CB 3.38Å; L35-F39 WeakPolarHBondContact O-CD2 3.35Å; L35-F39 PolarHBondContact O-N 3.02Å; F39-L42 PolarHBondContact O-N 3.33Å; F39-M43 HydrophobicContact CD1-CG 4.39Å; F39-M43 WeakPolarHBondContact O-CB 3.46Å; F39-M43 WeakPolarHBondContact O-CG 3.32Å; F39-M43 PolarHBondContact O-N 2.69Å; F39-K649 HydrophobicContact CE1-CD 4.36Å; F39-K649 VanDerWaalsContact CE1-NZ 3.26Å; F39-K649 HydrophobicContact CZ-CD 4.13Å; F39-K649 VanDerWaalsContact CZ-NZ 3.34Å
40	T	36.5	Very low	33.9	Very low	77 Å²	77	111.3 Å²	111.3	47%	0.472	56%	0.559	S	S	.	*	H	α-helix	trans	-71.9	-31.3	-177.3	-57.4	0	0	0	0	111.7	E36 N37 D38 T46	E36-T40 WeakPolarHBondContact O-CB 3.38Å; E36-T40 PolarHBondContact O-N 3.36Å; E36-T40 VanDerWaalsContact O-N 3.12Å; E36-T40 PolarHBondContact O-OG1 3.18Å; N37-T40 PolarHBondContact O-N 3.4Å; D38-T40 VanDerWaalsContact C-N 3.26Å; D38-T40 PolarHBondContact O-N 2.71Å; T40-T46 HydrophobicContact CG2-CG2 3.97Å
41	K	42	Very low	33.2	Very low	146 Å²	146	118 Å²	118	64%	0.635	58%	0.581	S	S	*	*	H	α-helix	trans	-65.6	-54.5	165.5	-64	174.3	-168.8	157.8	0	110.9	N37 D38 M43 G44	N37-K41 PolarHBondContact O-N 3.04Å; D38-K41 PolarHBondContact O-N 2.81Å; D38-K41 WeakPolarHBondContact OD1-CD 3.43Å; D38-K41 WeakPolarHBondContact OD1-CE 3.31Å; D38-K41 IonicContact OD1-NZ 2.71Å; D38-K41 PolarHBondContact OD1-NZ 3.12Å; K41-M43 VanDerWaalsContact C-N 3.26Å; K41-M43 PolarHBondContact O-N 3.42Å; K41-G44 PolarHBondContact O-N 3.48Å; K41-G44 VanDerWaalsContact O-N 3.08Å
42	L	35.4	Very low	32.9	Very low	96 Å²	96	116.7 Å²	116.7	50%	0.503	59%	0.592	S	S	.	*	H	α-helix	trans	-53.6	-39.7	-174.7	-168.7	77.1	0	0	0	113	D38 F39	D38-L42 VanDerWaalsContact O-CB 3.31Å; D38-L42 WeakPolarHBondContact O-CB 3.35Å; D38-L42 PolarHBondContact O-N 2.83Å; F39-L42 PolarHBondContact O-N 3.33Å
43	M	32.5	Very low	32.3	Very low	116 Å²	116	120.9 Å²	120.9	57%	0.571	61%	0.605	S	S	*	*	H	α-helix	trans	-78.8	-18.1	-176.9	-73.1	-59.9	-55.8	0	0	114.5	F39 K41 I45	F39-M43 HydrophobicContact CD1-CG 4.39Å; F39-M43 WeakPolarHBondContact O-CB 3.46Å; F39-M43 WeakPolarHBondContact O-CG 3.32Å; F39-M43 PolarHBondContact O-N 2.69Å; K41-M43 VanDerWaalsContact C-N 3.26Å; K41-M43 PolarHBondContact O-N 3.42Å; M43-I45 WeakPolarHBondContact O-CG1 3.49Å; M43-I45 PolarHBondContact O-N 3.22Å
44	G	27.1	Very low	31.6	Very low	36 Å²	36	122 Å²	122	37%	0.371	62%	0.621	S	S	.	*			trans	57.4	17	171	0	0	0	0	0	117.3	K41	K41-G44 PolarHBondContact O-N 3.48Å; K41-G44 VanDerWaalsContact O-N 3.08Å
45	I	29.1	Very low	31	Very low	139 Å²	139	121.9 Å²	121.9	71%	0.713	63%	0.626	S	S	*	*			trans	-125.2	87.9	-176.8	-61.6	161.4	0	0	0	109.1	M43	M43-I45 WeakPolarHBondContact O-CG1 3.49Å; M43-I45 PolarHBondContact O-N 3.22Å
46	T	27.9	Very low	30.4	Very low	102 Å²	102	127 Å²	127	63%	0.626	65%	0.648	S	S	*	*			trans	-126	85.5	170.2	57.6	0	0	0	0	109.9	T40	T40-T46 HydrophobicContact CG2-CG2 3.97Å
47	S	25.5	Very low	29.8	Very low	114 Å²	114	125 Å²	125	80%	0.797	65%	0.65	S	S	*	*			trans	-114.4	54.9	166	-162.5	0	0	0	0	109.6	K49	S47-K49 VanDerWaalsContact C-N 3.35Å; S47-K49 PolarHBondContact O-N 3.02Å
48	Q	27.2	Very low	29.2	Very low	172 Å²	172	125.8 Å²	125.8	80%	0.804	66%	0.658	S	S	*	*			trans	-70.7	92.8	169.8	-81.3	-176.2	-20.5	0	0	109.1	N50	Q48-N50 PolarHBondContact O-N 2.87Å
49	K	27.4	Very low	28.3	Very low	175 Å²	175	130.2 Å²	130.2	76%	0.761	68%	0.68	S	S	*	*			trans	-74.9	101.4	153.2	-84.4	-169.2	173.2	-176.2	0	107.9	S47 Y51	S47-K49 VanDerWaalsContact C-N 3.35Å; S47-K49 PolarHBondContact O-N 3.02Å; K49-Y51 PolarHBondContact O-N 3.29Å
50	N	24.3	Very low	27.7	Very low	137 Å²	137	133 Å²	133	73%	0.733	71%	0.707	S	S	*	*			trans	-56.5	126.1	173.6	-65.9	-23.1	0	0	0	110.5	Q48	Q48-N50 PolarHBondContact O-N 2.87Å
51	Y	24.5	Very low	27.1	Very low	203 Å²	203	136.4 Å²	136.4	80%	0.796	72%	0.721	S	S	*	*			trans	-127.8	133	155.2	-82	-80.5	0	0	0	107.2	K49	K49-Y51 PolarHBondContact O-N 3.29Å
52	P	27.4	Very low	26.5	Very low	119 Å²	119	134.6 Å²	134.6	77%	0.773	72%	0.724	S	S	*	*			trans	-74	147.4	-170.1	30	-35.3	0	0	0	111.9
53	F	22.3	Very low	26	Very low	192 Å²	192	136.2 Å²	136.2	84%	0.842	73%	0.733	S	S	*	*			trans	-58.4	148	157.1	-101.6	-113.4	0	0	0	109.8
54	N	27	Very low	25.8	Very low	160 Å²	160	136.9 Å²	136.9	86%	0.856	74%	0.739	S	S	*	*			trans	-139.1	127.4	158.1	-162.4	35.8	0	0	0	107.6
55	D	22.7	Very low	25.7	Very low	123 Å²	123	140.2 Å²	140.2	66%	0.658	75%	0.752	S	S	*	*			trans	-79.4	-179.8	-172.9	-76.4	-59.2	0	0	0	113.1
56	Q	25.3	Very low	25.4	Very low	189 Å²	189	138 Å²	138	88%	0.883	75%	0.749	S	S	*	*			trans	82.4	131.7	178.7	-47.4	169.5	31	0	0	112.6
57	S	25.4	Very low	25.3	Very low	99 Å²	99	138.9 Å²	138.9	69%	0.692	76%	0.755	S	S	*	*			cis	-154.4	164	17.9	51.5	0	0	0	0	114.2
58	T	25.4	Very low	25.2	Very low	113 Å²	113	140 Å²	140	69%	0.693	76%	0.757	S	S	*	*			trans	48.5	101.3	155.3	42.4	0	0	0	0	118.5
59	I	22.5	Very low	25	Very low	154 Å²	154	137.1 Å²	137.1	79%	0.79	76%	0.756	S	S	*	*				63	105.1	79.8	-59.8	166.1	0	0	0	113.6
60	C	24.1	Very low	24.8	Very low	130 Å²	130	135.3 Å²	135.3	88%	0.878	76%	0.76	S	S	*	*				-168.5	133.2	128.8	-107	0	0	0	0	111.6
61	I	25.3	Very low	24.8	Very low	149 Å²	149	136.3 Å²	136.3	76%	0.764	76%	0.763	S	S	*	*			trans	-116.6	146.4	-178.9	-49	162.2	0	0	0	103.9
62	P	28.3	Very low	24.7	Very low	109 Å²	109	133.3 Å²	133.3	71%	0.708	76%	0.76	S	S	*	*				-157.8	172.4	57.8	43	-19.7	0	0	0	120.7
63	N	24.9	Very low	24.7	Very low	129 Å²	129	134.5 Å²	134.5	69%	0.69	76%	0.76	S	S	*	*			trans	26.9	150.7	133.2	-44.2	4.2	0	0	0	120.4
64	D	27.6	Very low	24.8	Very low	131 Å²	131	131.6 Å²	131.6	70%	0.701	75%	0.753	S	S	*	*			cis	-163	152.3	30.9	-122.1	-34.7	0	0	0	114.8
65	T	25.1	Very low	25	Very low	105 Å²	105	130.3 Å²	130.3	64%	0.644	75%	0.746	S	S	*	*			trans	38.8	137.1	153.7	60	0	0	0	0	126.3
66	S	24.2	Very low	25.2	Very low	92 Å²	92	132.6 Å²	132.6	64%	0.643	76%	0.758	S	S	*	*				104.5	109.5	127.9	69.9	0	0	0	0	123.9
67	T	24.6	Very low	25.2	Very low	122 Å²	122	129.9 Å²	129.9	75%	0.748	75%	0.748	S	S	*	*			trans	44.3	110	137	50.2	0	0	0	0	123.5
68	T	23	Very low	25.2	Very low	136 Å²	136	130.3 Å²	130.3	83%	0.834	75%	0.749	S	S	*	*				20.3	127.8	124.1	53.3	0	0	0	0	121.2
69	S	23.7	Very low	25.2	Very low	112 Å²	112	131.3 Å²	131.3	78%	0.783	75%	0.749	S	S	*	*			trans	-146.3	140.2	132.3	60.2	0	0	0	0	110.9
70	T	22.5	Very low	25.3	Very low	138 Å²	138	129 Å²	129	85%	0.847	74%	0.742	S	S	*	*			trans	-88.4	126.3	177.9	44.6	0	0	0	0	110.9
71	I	24.3	Very low	25.3	Very low	157 Å²	157	132.7 Å²	132.7	81%	0.805	74%	0.739	S	S	*	*			trans	-118.1	116.2	161.1	-64.2	-178.2	0	0	0	108.4
72	I	23.9	Very low	25.2	Very low	141 Å²	141	133.9 Å²	133.9	72%	0.723	74%	0.738	S	S	*	*			trans	-68.6	128.9	168.8	-61.4	163.6	0	0	0	107.5	N74	I72-N74 WeakPolarHBondContact CG2-OD1 3.27Å
73	N	27.6	Very low	25.1	Very low	144 Å²	144	137.6 Å²	137.6	77%	0.77	75%	0.749	S	S	*	*			trans	-124.9	119.8	159.1	-161.9	4.1	0	0	0	109.8
74	N	24.4	Very low	25.2	Very low	131 Å²	131	138.3 Å²	138.3	70%	0.701	75%	0.752	S	S	*	*			trans	-82.9	120.8	-174	-63.8	-45.7	0	0	0	110.1	I72	I72-N74 WeakPolarHBondContact CG2-OD1 3.27Å
75	N	30	Very low	25.1	Very low	133 Å²	133	139.4 Å²	139.4	71%	0.711	76%	0.758	S	S	*	*			trans	-149.5	92.3	160.8	-94	-42.5	0	0	0	110.8	I77	N75-I77 PolarHBondContact O-N 2.78Å
76	N	26.3	Very low	25.2	Very low	171 Å²	171	142.2 Å²	142.2	91%	0.914	77%	0.769	S	S	*	*			trans	-72.7	102.9	167.6	-77.5	-21.4	0	0	0	109.3
77	I	27.1	Very low	25.3	Very low	131 Å²	131	146.5 Å²	146.5	67%	0.672	78%	0.776	S	S	*	*			trans	-129.7	108.5	167.4	-56.9	-179	0	0	0	109	N75 I79	N75-I77 PolarHBondContact O-N 2.78Å; I77-I79 PolarHBondContact O-N 3.18Å
78	P	24.4	Very low	25.4	Very low	108 Å²	108	148.4 Å²	148.4	70%	0.701	78%	0.782	S	S	*	*			trans	-79.6	106.5	174	31	-31.1	0	0	0	110	T80	P78-T80 VanDerWaalsContact C-N 3.34Å; P78-T80 PolarHBondContact O-N 3.03Å; P78-T80 PolarHBondContact O-OG1 2.78Å
79	I	25.9	Very low	25.4	Very low	135 Å²	135	145.4 Å²	145.4	69%	0.692	78%	0.778	S	S	*	*			trans	-67.6	93.7	176.4	-56.9	-179.8	0	0	0	109.2	I77 Y81	I77-I79 PolarHBondContact O-N 3.18Å; I79-Y81 HydrophobicContact CG2-CD2 3.93Å; I79-Y81 HydrophobicContact CG2-CE2 3.52Å
80	T	25.1	Very low	25.4	Very low	106 Å²	106	145.9 Å²	145.9	65%	0.65	78%	0.781	S	S	*	*			trans	-97.6	102.6	177.1	-53	0	0	0	0	108.3	P78 K82	P78-T80 VanDerWaalsContact C-N 3.34Å; P78-T80 PolarHBondContact O-N 3.03Å; P78-T80 PolarHBondContact O-OG1 2.78Å; T80-K82 VanDerWaalsContact C-N 3.3Å; T80-K82 HydrophobicContact CG2-CG 4.48Å; T80-K82 PolarHBondContact O-N 3.32Å
81	Y	23.3	Very low	25.5	Very low	207 Å²	207	145.2 Å²	145.2	81%	0.812	78%	0.777	S	S	*	*			trans	-71.9	86.3	173.5	-77	-81.1	0	0	0	110.8	I79	I79-Y81 HydrophobicContact CG2-CD2 3.93Å; I79-Y81 HydrophobicContact CG2-CE2 3.52Å
82	K	23.9	Very low	25.6	Very low	174 Å²	174	144.3 Å²	144.3	76%	0.757	77%	0.772	S	S	*	*			trans	-110.6	102.6	156.3	-80.9	-166.7	172	-168.6	0	108.8	T80	T80-K82 VanDerWaalsContact C-N 3.3Å; T80-K82 HydrophobicContact CG2-CG 4.48Å; T80-K82 PolarHBondContact O-N 3.32Å
83	M	26.1	Very low	25.6	Very low	187 Å²	187	146.4 Å²	146.4	92%	0.921	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-83.3	125.9	154.3	-77.4	-175.1	163.7	0	0	107.4
84	N	26.6	Very low	25.5	Very low	144 Å²	144	145.2 Å²	145.2	77%	0.77	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-72.7	153.2	-178.9	-78.4	-17.7	0	0	0	111.6
85	D	24.6	Very low	25.8	Very low	154 Å²	154	147 Å²	147	82%	0.824	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-52.7	138.8	165.3	-52.6	-88.1	0	0	0	111.5
86	N	28.4	Very low	25.6	Very low	163 Å²	163	147.4 Å²	147.4	87%	0.872	78%	0.779	S	S	*	*			trans	-145.3	136.2	152	-121.2	-33.3	0	0	0	111.9
87	K	25.4	Very low	25.6	Very low	183 Å²	183	142.2 Å²	142.2	80%	0.796	77%	0.766	S	S	*	*			trans	-74.1	136.2	-170.2	-55.5	158.5	-177.3	171.9	0	110.3
88	N	26.3	Very low	25.7	Very low	161 Å²	161	144.3 Å²	144.3	86%	0.861	77%	0.772	S	S	*	*				161.1	158	117.1	-84.1	-22.6	0	0	0	112.7
89	G	24.1	Very low	25.8	Very low	73 Å²	73	144.4 Å²	144.4	75%	0.753	77%	0.771	S	S	*	*			trans	85.3	92.1	136.9	0	0	0	0	0	117.3	V91	G89-V91 PolarHBondContact O-N 2.71Å
90	S	23.9	Very low	25.9	Very low	123 Å²	123	145.3 Å²	145.3	86%	0.86	77%	0.769	S	S	*	*			trans	-44.6	129.5	143.4	168.6	0	0	0	0	111.2
91	V	24.1	Very low	26	Very low	123 Å²	123	147.3 Å²	147.3	75%	0.745	77%	0.771	S	S	*	*			trans	-165.5	119.8	150.8	127.7	0	0	0	0	113	G89	G89-V91 PolarHBondContact O-N 2.71Å
92	I	25.9	Very low	26.3	Very low	139 Å²	139	143.9 Å²	143.9	71%	0.713	77%	0.766	S	S	*	*			trans	63	106.3	141	-60.6	171.6	0	0	0	121.3
93	K	25.4	Very low	26.4	Very low	184 Å²	184	142.5 Å²	142.5	80%	0.8	76%	0.763	S	S	*	*			trans	-6.7	162.8	132.1	-57.9	175.7	176.8	179	0	119.9
94	N	25.1	Very low	26.5	Very low	119 Å²	119	141.3 Å²	141.3	64%	0.636	75%	0.752	S	S	*	*			trans	76.1	142.6	175.3	-41.7	-36.2	0	0	0	111.2	L96	N94-L96 HydrophobicContact CB-CB 4.17Å
95	I	30.3	Very low	26.5	Very low	168 Å²	168	139.2 Å²	139.2	86%	0.862	74%	0.741	S	S	*	*			cis	-111.2	132.6	30.8	-59.5	111.1	0	0	0	110.6
96	L	25.9	Very low	26.7	Very low	142 Å²	142	141.4 Å²	141.4	74%	0.743	74%	0.739	S	S	*	*			cis	83.3	110.4	18.3	-169.2	63.6	0	0	0	117.5	N94	N94-L96 HydrophobicContact CB-CB 4.17Å
97	G	27	Very low	26.7	Very low	62 Å²	62	137.4 Å²	137.4	64%	0.639	72%	0.724	S	S	*	*			trans	92.1	138.7	170.6	0	0	0	0	0	112.8
98	H	27.7	Very low	26.8	Very low	176 Å²	176	134.6 Å²	134.6	82%	0.815	72%	0.718	S	S	*	*			cis	-143.4	135.2	27.9	-108	-118	0	0	0	110.6
99	V	27.4	Very low	27	Very low	109 Å²	109	132 Å²	132	66%	0.661	70%	0.704	S	S	*	*				71.7	128.1	104.6	168.6	0	0	0	0	114.3
100	K	27.8	Very low	27.2	Very low	154 Å²	154	134 Å²	134	67%	0.67	70%	0.697	S	S	*	*			cis	-179.5	175.2	-12.7	-114.3	-166.9	-167.6	-178.8	0	107.2
101	E	27.6	Very low	27.4	Very low	148 Å²	148	133.4 Å²	133.4	69%	0.692	69%	0.685	S	S	*	*			trans	67.4	141.4	145.5	-83.3	161.7	147.3	0	0	118.4
102	L	28.5	Very low	27.5	Very low	135 Å²	135	136.8 Å²	136.8	71%	0.707	68%	0.684	S	S	*	*			cis	-130	123.1	1.2	-88.5	167.5	0	0	0	111.7
103	Q	26.7	Very low	27.5	Very low	145 Å²	145	137.4 Å²	137.4	68%	0.678	68%	0.684	S	S	*	*				48.5	141.2	108.4	-143.6	-167.5	38.5	0	0	120.9
104	K	28.1	Very low	27.6	Very low	162 Å²	162	136.8 Å²	136.8	70%	0.704	69%	0.688	S	S	*	*			trans	90.2	135.1	159.1	-58	-170.2	178.7	164.5	0	117.4
105	N	26.9	Very low	27.6	Very low	100 Å²	100	137.2 Å²	137.2	54%	0.535	70%	0.695	S	S	.	*			cis	-163.5	160.1	-12.8	-120.7	9.7	0	0	0	112.3
106	Y	29	Very low	27.5	Very low	200 Å²	200	134.6 Å²	134.6	78%	0.784	69%	0.689	S	S	*	*			trans	65.1	141.3	159.6	-60.7	-56	0	0	0	118.7
107	S	28	Very low	27.6	Very low	80 Å²	80	135.9 Å²	135.9	56%	0.559	70%	0.696	S	S	*	*			cis	-178	150.9	-30.4	-117.8	0	0	0	0	110.9
108	N	27.9	Very low	27.5	Very low	123 Å²	123	137.8 Å²	137.8	66%	0.658	70%	0.699	S	S	*	*			trans	62.2	143.8	138.1	-65.7	48.5	0	0	0	118.5
109	D	28.7	Very low	27.5	Very low	108 Å²	108	137.3 Å²	137.3	58%	0.578	70%	0.702	S	S	*	*			cis	-168.8	163.9	-0.3	-119.3	2.7	0	0	0	113.1
110	N	28.5	Very low	27.4	Very low	113 Å²	113	137.7 Å²	137.7	60%	0.604	71%	0.708	S	S	*	*			trans	57.5	140.4	138.2	-60	-21.7	0	0	0	120.8
111	N	28.2	Very low	27.3	Very low	111 Å²	111	135.9 Å²	135.9	59%	0.594	72%	0.715	S	S	*	*			cis	-175.3	168	-12.1	-114.3	-23.3	0	0	0	110
112	R	27.2	Very low	27.2	Very low	194 Å²	194	135.8 Å²	135.8	73%	0.732	72%	0.719	S	S	*	*			trans	71.6	112.1	148.2	-78.7	155.2	-177	-167.3	-0.5	117.7
113	E	24.9	Very low	27.3	Very low	152 Å²	152	137.1 Å²	137.1	71%	0.71	73%	0.727	S	S	*	*				68.6	118.5	62.1	-62.8	174	119.2	0	0	112.8
114	I	27.6	Very low	27.2	Very low	172 Å²	172	137.2 Å²	137.2	88%	0.882	73%	0.732	S	S	*	*				-161.9	155.3	100.6	-93.8	157.9	0	0	0	109.1
115	T	25.5	Very low	27.2	Very low	128 Å²	128	136.3 Å²	136.3	79%	0.785	73%	0.734	S	S	*	*			trans	-93.3	166	-161.1	24.3	0	0	0	0	115.3
116	P	27.9	Very low	27	Very low	113 Å²	113	135.5 Å²	135.5	73%	0.734	74%	0.737	S	S	*	*			trans	-86	-178.7	-176.1	37.9	-38.4	0	0	0	112.9
117	N	28.7	Very low	26.9	Very low	169 Å²	169	137.1 Å²	137.1	90%	0.904	74%	0.741	S	S	*	*			trans	-135.8	147.3	160	-131.9	12.7	0	0	0	110
118	C	24.7	Very low	26.7	Very low	102 Å²	102	139.4 Å²	139.4	69%	0.689	75%	0.752	S	S	*	*			trans	-91.1	166.3	-177	-54.7	0	0	0	0	111.8
119	D	28.6	Very low	26.5	Very low	166 Å²	166	142.1 Å²	142.1	89%	0.888	76%	0.758	S	S	*	*				-169.7	159.7	104.6	-94	-17.9	0	0	0	112.3
120	C	24.6	Very low	26.4	Very low	116 Å²	116	145 Å²	145	78%	0.784	77%	0.773	S	S	*	*			trans	-97.4	154	-170.9	-53.7	0	0	0	0	112.4
121	S	25.7	Very low	26.3	Very low	117 Å²	117	144.5 Å²	144.5	82%	0.818	77%	0.774	S	S	*	*				178.2	161.9	115.9	37.7	0	0	0	0	112.6
122	D	25.4	Very low	26.2	Very low	145 Å²	145	149 Å²	149	78%	0.775	79%	0.789	S	S	*	*			trans	-61.8	158.9	-173.4	-46	-83.2	0	0	0	114.6
123	N	30.3	Very low	26.2	Very low	163 Å²	163	147.3 Å²	147.3	87%	0.872	80%	0.795	S	S	*	*				-169.2	154.7	123.6	-104.1	-71	0	0	0	111.5
124	D	24.8	Very low	26.3	Very low	148 Å²	148	144 Å²	144	79%	0.791	79%	0.788	S	S	*	*			trans	-62.6	134.6	164.8	-77.3	-64.4	0	0	0	110.7
125	L	27.8	Very low	26.4	Very low	142 Å²	142	142.2 Å²	142.2	74%	0.743	78%	0.78	S	S	*	*				-167.5	156.8	121.7	-125.9	66.4	0	0	0	112.8	W127	L125-W127 HydrophobicContact CD2-CZ2 4.15Å
126	S	22.5	Very low	26.5	Very low	84 Å²	84	142.4 Å²	142.4	59%	0.587	77%	0.772	S	S	*	*			trans	-59.6	158.3	162.6	58.7	0	0	0	0	112.4
127	W	27	Very low	26.5	Very low	233 Å²	233	146.9 Å²	146.9	88%	0.883	78%	0.776	S	S	*	*				-167.1	174.4	115.7	-80.5	-25.9	0	0	0	112	L125	L125-W127 HydrophobicContact CD2-CZ2 4.15Å
128	T	24.3	Very low	26.4	Very low	128 Å²	128	142.3 Å²	142.3	79%	0.785	76%	0.762	S	S	*	*			trans	-99.2	139.2	-170.2	51.7	0	0	0	0	113.8
129	K	24	Very low	26.5	Very low	180 Å²	180	144.4 Å²	144.4	78%	0.783	77%	0.771	S	S	*	*			trans	62.5	97.3	134.6	-173.8	-165	-179.5	-172.8	0	116.7	V131	K129-V131 HydrophobicContact CG-CG2 4.1Å
130	D	27.1	Very low	26.5	Very low	168 Å²	168	140 Å²	140	90%	0.898	77%	0.765	S	S	*	*			trans	-105.5	148	145.9	-101.8	-51	0	0	0	111
131	V	25.6	Very low	26.5	Very low	103 Å²	103	139.9 Å²	139.9	62%	0.624	77%	0.766	S	S	*	*			trans	-136.7	116.8	-178.5	173.5	0	0	0	0	109	K129	K129-V131 HydrophobicContact CG-CG2 4.1Å
132	F	25.5	Very low	26.7	Very low	206 Å²	206	142.2 Å²	142.2	90%	0.904	77%	0.768	S	S	*	*			trans	-148.1	113	156.5	-99.3	-73.6	0	0	0	111.2
133	N	26.9	Very low	26.6	Very low	159 Å²	159	139.5 Å²	139.5	85%	0.85	77%	0.766	S	S	*	*			trans	-149	111.5	139.4	-145.5	-9.1	0	0	0	111
134	S	27.4	Very low	26.4	Very low	81 Å²	81	140 Å²	140	57%	0.566	77%	0.767	S	S	*	*			trans	4.3	122.2	165	-142.5	0	0	0	0	120.1
135	N	29.2	Very low	26.3	Very low	135 Å²	135	139.1 Å²	139.1	72%	0.722	77%	0.768	S	S	*	*				-178.6	120.9	94.9	-90.6	-28.1	0	0	0	115.4
136	H	28.5	Very low	26.4	Very low	132 Å²	132	138 Å²	138	61%	0.611	77%	0.772	S	S	*	*			trans	59.3	127.4	135.8	-85	-77.4	0	0	0	125
137	Y	27.5	Very low	26.6	Very low	207 Å²	207	140.9 Å²	140.9	81%	0.812	79%	0.785	S	S	*	*			trans	65.6	144	150.7	-59.2	-52.4	0	0	0	119.1
138	A	27.4	Very low	26.6	Very low	74 Å²	74	138.6 Å²	138.6	61%	0.612	78%	0.782	S	S	*	*			cis	-162.1	163.7	-18.7	0	0	0	0	0	109.8
139	T	27.4	Very low	26.7	Very low	145 Å²	145	139.4 Å²	139.4	89%	0.89	78%	0.78	S	S	*	*			trans	32.2	128.1	153.7	51.7	0	0	0	0	120.4
140	G	27.7	Very low	26.8	Very low	73 Å²	73	136.9 Å²	136.9	75%	0.753	78%	0.775	S	S	*	*			cis	168.6	-179	4.6	0	0	0	0	0	113.3
141	S	24.8	Very low	26.8	Very low	114 Å²	114	134.1 Å²	134.1	80%	0.797	76%	0.76	S	S	*	*			trans	-35.7	134.1	-179.1	-169.4	0	0	0	0	116.8
142	L	28.7	Very low	26.9	Very low	167 Å²	167	134 Å²	134	87%	0.874	76%	0.76	S	S	*	*				-164.4	151.2	105.4	-99.4	166.9	0	0	0	111.5
143	A	23.5	Very low	27	Very low	88 Å²	88	132.1 Å²	132.1	73%	0.727	75%	0.751	S	S	*	*			trans	-97.2	152.2	174.7	0	0	0	0	0	110.7
144	L	27.1	Very low	27.1	Very low	172 Å²	172	131.4 Å²	131.4	90%	0.901	75%	0.745	S	S	*	*			trans	-159.8	149.8	148.4	-110.7	172	0	0	0	110.9
145	T	23.5	Very low	27.3	Very low	130 Å²	130	134.3 Å²	134.3	80%	0.798	75%	0.75	S	S	*	*			trans	-93.8	143.5	179	50.6	0	0	0	0	111.6
146	S	28.5	Very low	27.2	Very low	120 Å²	120	134 Å²	134	84%	0.839	75%	0.748	S	S	*	*			trans	-141.9	138.7	164	58.5	0	0	0	0	111.3
147	V	27.8	Very low	27.3	Very low	143 Å²	143	134.2 Å²	134.2	87%	0.867	75%	0.754	S	S	*	*			trans	-101.1	158.3	-177.6	174.4	0	0	0	0	110.2
148	F	25.6	Very low	27.3	Very low	185 Å²	185	133.1 Å²	133.1	81%	0.811	76%	0.755	S	S	*	*			trans	-55.1	150.6	174.5	-83.7	-90.4	0	0	0	114.4
149	I	27.1	Very low	27.7	Very low	146 Å²	146	134.5 Å²	134.5	75%	0.749	76%	0.758	S	S	*	*			trans	69.4	122.4	152	-66.2	161.6	0	0	0	113.4
150	N	26.4	Very low	27.7	Very low	126 Å²	126	133.8 Å²	133.8	67%	0.674	75%	0.753	S	S	*	*				-150.5	175.6	52.7	-150.1	15.9	0	0	0	115.7
151	D	27	Very low	27.7	Very low	110 Å²	110	134.7 Å²	134.7	59%	0.588	75%	0.748	S	S	*	*			trans	74.1	90.5	148.8	-67.7	-39	0	0	0	122.6
152	T	28.3	Very low	27.9	Very low	100 Å²	100	135.6 Å²	135.6	61%	0.613	74%	0.744	S	S	*	*				87.2	123.7	115.8	59.6	0	0	0	0	123.4
153	K	27.9	Very low	27.8	Very low	167 Å²	167	135.8 Å²	135.8	73%	0.726	74%	0.74	S	S	*	*				82.7	121.5	120.7	-77.8	174.2	-172.5	169.5	0	121.7
154	M	28.2	Very low	28	Very low	144 Å²	144	140.2 Å²	140.2	71%	0.709	74%	0.743	S	S	*	*			trans	69.1	156.3	135.5	-53.8	-59.4	-178	0	0	116.8
155	Q	30.9	Very low	28.1	Very low	143 Å²	143	137.7 Å²	137.7	67%	0.668	73%	0.73	S	S	*	*			cis	-155.8	147.5	-18.5	-119.5	162.7	-29.4	0	0	110.1
156	N	27.6	Very low	28.4	Very low	128 Å²	128	141 Å²	141	68%	0.684	73%	0.734	S	S	*	*			trans	36.3	140.6	136.6	-61.1	7.2	0	0	0	123.2
157	N	30.5	Very low	28.4	Very low	137 Å²	137	138.4 Å²	138.4	73%	0.733	73%	0.725	S	S	*	*			trans	92	97	142.7	-63.6	-10.4	0	0	0	122
158	H	28.1	Very low	28.4	Very low	183 Å²	183	139.2 Å²	139.2	85%	0.847	72%	0.72	S	S	*	*				66.3	162.6	123.6	-87.1	-68.3	0	0	0	121.4
159	P	35.2	Very low	28.6	Very low	104 Å²	104	138.7 Å²	138.7	68%	0.675	72%	0.719	S	S	*	*			trans	-115.7	-171.6	-157	44.6	-36.6	0	0	0	113.5
160	V	28.4	Very low	28.6	Very low	130 Å²	130	139.5 Å²	139.5	79%	0.788	71%	0.714	S	S	*	*			trans	-171.3	129.5	140.4	129.6	0	0	0	0	115.3
161	S	26.6	Very low	28.7	Very low	91 Å²	91	140.5 Å²	140.5	64%	0.636	72%	0.715	S	S	*	*			trans	71.6	158.4	146.9	74.4	0	0	0	0	125.4
162	N	29.8	Very low	28.9	Very low	133 Å²	133	141.1 Å²	141.1	71%	0.711	71%	0.714	S	S	*	*			trans	75.5	94.5	161.7	-53.4	-17.4	0	0	0	116.7
163	E	25.7	Very low	28.8	Very low	171 Å²	171	140.3 Å²	140.3	80%	0.799	71%	0.712	S	S	*	*				80.8	130.5	60.2	-69.9	-164.8	141.8	0	0	115.4
164	F	28.5	Very low	29	Very low	181 Å²	181	138.6 Å²	138.6	79%	0.794	71%	0.711	S	S	*	*				-176.2	96.6	121.9	-116.2	-101.2	0	0	0	114.4
165	I	28.1	Very low	28.9	Very low	119 Å²	119	141.3 Å²	141.3	61%	0.61	72%	0.715	S	S	*	*			trans	54.6	143.7	140.8	-26.4	-177.8	0	0	0	123.9
166	F	29.5	Very low	28.8	Very low	201 Å²	201	141.3 Å²	141.3	88%	0.882	72%	0.719	S	S	*	*			trans	87.8	122.9	161.3	-63.7	-69.3	0	0	0	119.1
167	G	29.6	Very low	28.7	Very low	64 Å²	64	143.6 Å²	143.6	66%	0.66	72%	0.719	S	S	*	*			cis	-174.4	138.7	-8.8	0	0	0	0	0	115.5
168	E	27.8	Very low	28.6	Very low	161 Å²	161	144 Å²	144	75%	0.752	72%	0.722	S	S	*	*			trans	32.9	145.3	143	-49.5	-174.6	140.4	0	0	121.6	Y170	E168-Y170 HydrophobicContact CB-CD2 4.38Å; E168-Y170 HydrophobicContact CG-CD2 4.22Å; E168-Y170 HydrophobicContact CG-CE2 3.88Å
169	E	29.3	Very low	28.6	Very low	173 Å²	173	141.5 Å²	141.5	81%	0.808	71%	0.71	S	S	*	*			cis	-105.6	178	11.3	-74.2	-160.5	77.5	0	0	114.2
170	Y	28.1	Very low	28.2	Very low	164 Å²	164	143.4 Å²	143.4	64%	0.643	71%	0.71	S	S	*	*			cis	83	154.4	15.2	-55	-35.1	0	0	0	116.6	E168	E168-Y170 HydrophobicContact CB-CD2 4.38Å; E168-Y170 HydrophobicContact CG-CD2 4.22Å; E168-Y170 HydrophobicContact CG-CE2 3.88Å
171	Q	27.6	Very low	28.2	Very low	146 Å²	146	146.2 Å²	146.2	68%	0.682	71%	0.712	S	S	*	*			cis	-152.3	135.8	-19	-128	-172.4	56.1	0	0	114.8
172	Q	30.4	Very low	28.2	Very low	124 Å²	124	149.2 Å²	149.2	58%	0.579	72%	0.721	S	S	*	*			trans	178	106.2	133.5	-121.6	127.1	60.3	0	0	109.1
173	S	26.5	Very low	28.1	Very low	82 Å²	82	148.7 Å²	148.7	57%	0.573	73%	0.728	S	S	*	*				65.5	125.5	86.3	87	0	0	0	0	113.7
174	N	31.6	Very low	28	Very low	131 Å²	131	146.2 Å²	146.2	70%	0.701	73%	0.729	S	S	*	*			cis	-149.3	163	25	-82.2	-55.9	0	0	0	114.6
175	Y	27.5	Very low	28.2	Very low	201 Å²	201	143.2 Å²	143.2	79%	0.788	73%	0.728	S	S	*	*			trans	-8.5	159.2	147.3	-48.9	-72.2	0	0	0	120.4
176	L	28.8	Very low	28.2	Very low	144 Å²	144	144 Å²	144	75%	0.754	74%	0.738	S	S	*	*			cis	-153.7	-176.1	8.4	-152.9	61.6	0	0	0	112
177	Y	25.2	Very low	27.9	Very low	176 Å²	176	143 Å²	143	69%	0.69	74%	0.736	S	S	*	*			trans	-33.6	160.2	161.9	-85.5	-113.8	0	0	0	116.1	Q179	Y177-Q179 HydrophobicContact CD1-CG 4.29Å; Y177-Q179 HydrophobicContact CE1-CG 4.3Å
178	D	28.9	Very low	27.7	Very low	146 Å²	146	147.6 Å²	147.6	78%	0.781	74%	0.744	S	S	*	*			cis	-149.5	178.3	47.7	-143.2	-18.8	0	0	0	117.1
179	Q	27.6	Very low	27.4	Very low	129 Å²	129	145.9 Å²	145.9	60%	0.603	75%	0.749	S	S	*	*			trans	-104.2	173.1	-168.3	-58.2	-179.4	-94.9	0	0	114.3	Y177	Y177-Q179 HydrophobicContact CD1-CG 4.29Å; Y177-Q179 HydrophobicContact CE1-CG 4.3Å
180	H	27.4	Very low	27.3	Very low	145 Å²	145	142.2 Å²	142.2	67%	0.671	74%	0.742	S	S	*	*			trans	97.7	145	145.8	-73.4	-66.9	0	0	0	122.8
181	F	28.3	Very low	27	Very low	188 Å²	188	142.8 Å²	142.8	83%	0.825	75%	0.751	S	S	*	*			trans	72	119.4	161.9	-71.4	-65.9	0	0	0	122.5
182	N	25.4	Very low	26.9	Very low	154 Å²	154	141.8 Å²	141.8	82%	0.824	76%	0.755	S	S	*	*			trans	-57.2	139.5	153.5	-53.9	-36.6	0	0	0	110.4
183	S	28	Very low	26.6	Very low	123 Å²	123	141.7 Å²	141.7	86%	0.86	76%	0.758	S	S	*	*			trans	-170.1	124	143	-102.9	0	0	0	0	111.2
184	S	23.5	Very low	26.6	Very low	118 Å²	118	149 Å²	149	83%	0.825	78%	0.775	S	S	*	*			trans	-99.5	168	157.9	-58.7	0	0	0	0	108.5
185	P	33.1	Very low	26.1	Very low	118 Å²	118	148 Å²	148	77%	0.766	78%	0.778	S	S	*	*			cis	-116.6	-167.8	-41.8	38.9	-26	0	0	0	109.1
186	V	27.3	Very low	26.1	Very low	136 Å²	136	145 Å²	145	82%	0.824	78%	0.781	S	S	*	*			trans	178.8	150.1	135.9	141.5	0	0	0	0	110.2
187	Q	24.1	Very low	25.8	Very low	180 Å²	180	145.1 Å²	145.1	84%	0.841	78%	0.779	S	S	*	*			trans	-73.4	144.1	176	-59.1	147.5	-81.2	0	0	111.7
188	L	25.6	Very low	25.7	Very low	160 Å²	160	146.1 Å²	146.1	84%	0.838	78%	0.781	S	S	*	*			trans	-146.9	110.6	149.8	-117.1	163.2	0	0	0	109.7
189	C	21.7	Very low	25.7	Very low	126 Å²	126	145.7 Å²	145.7	85%	0.851	78%	0.784	S	S	*	*			trans	-90.3	120.4	171.5	-176.9	0	0	0	0	108.4
190	S	26.4	Very low	25.5	Very low	95 Å²	95	145.3 Å²	145.3	66%	0.664	79%	0.786	S	S	*	*			trans	-151.7	94.9	168.6	58.1	0	0	0	0	110.2
191	Q	22.6	Very low	25.5	Very low	176 Å²	176	146.1 Å²	146.1	82%	0.822	80%	0.795	S	S	*	*			trans	-59.6	126.4	159.9	172.4	-176.3	4.3	0	0	109.9
192	T	25.8	Very low	25.4	Very low	126 Å²	126	146.6 Å²	146.6	77%	0.773	79%	0.793	S	S	*	*			trans	-155.8	136	161	9.4	0	0	0	0	111.7
193	D	22.7	Very low	25.5	Very low	121 Å²	121	144.5 Å²	144.5	65%	0.647	79%	0.787	S	S	*	*			trans	-74.1	156.2	-175.1	-43.5	-92.5	0	0	0	113.2
194	Y	26.3	Very low	25.3	Very low	237 Å²	237	147.9 Å²	147.9	93%	0.929	78%	0.783	S	S	*	*			trans	-142.9	118.7	147.5	-102.1	-73.3	0	0	0	111.9
195	S	22.5	Very low	25.4	Very low	108 Å²	108	149.8 Å²	149.8	76%	0.755	78%	0.782	S	S	*	*			trans	-98	121.9	-168.2	-48	0	0	0	0	112.8
196	V	27.3	Very low	25	Very low	140 Å²	140	149.9 Å²	149.9	85%	0.848	78%	0.78	S	S	*	*			trans	-147.9	142.3	164	-171.9	0	0	0	0	109.3
197	M	23.2	Very low	24.9	Very low	146 Å²	146	150 Å²	150	72%	0.719	78%	0.777	S	S	*	*			cis	-175.9	132.1	-47.4	165.8	162.4	57.6	0	0	107.3
198	R	22.6	Very low	25.1	Very low	196 Å²	196	148.7 Å²	148.7	74%	0.74	78%	0.775	S	S	*	*			trans	5.7	121.2	164.6	-67.9	-178.8	-75.5	-152.7	-5.8	120.4	L200	R198-L200 HydrophobicContact CG-CD1 4.2Å
199	T	28.1	Very low	25	Very low	137 Å²	137	148.7 Å²	148.7	84%	0.84	77%	0.771	S	S	*	*				-152.4	116.2	120.6	41.4	0	0	0	0	105.2
200	L	24.2	Very low	25.4	Very low	122 Å²	122	151 Å²	151	64%	0.639	77%	0.769	S	S	*	*			cis	51.7	103.3	30.1	-85.4	177.1	0	0	0	113.1	R198	R198-L200 HydrophobicContact CG-CD1 4.2Å
201	D	27.9	Very low	25.4	Very low	162 Å²	162	151.4 Å²	151.4	87%	0.866	77%	0.769	S	S	*	*				-157.9	101.6	126.3	-92.4	-27.4	0	0	0	110.4
202	Y	25.5	Very low	25.7	Very low	197 Å²	197	150.8 Å²	150.8	77%	0.773	77%	0.766	S	S	*	*			trans	-89	141.4	151.7	-99.5	-93.3	0	0	0	106.1	Y204	Y202-Y204 HydrophobicContact CD1-CD2 4.24Å
203	P	27.3	Very low	25.6	Very low	110 Å²	110	154.4 Å²	154.4	71%	0.714	77%	0.767	S	S	*	*				-139.6	147.2	91	31	-12.6	0	0	0	112.6
204	Y	23.3	Very low	25.8	Very low	195 Å²	195	156.3 Å²	156.3	77%	0.765	78%	0.776	S	S	*	*				42.1	117.6	85.4	-82.6	-93.1	0	0	0	114.3	Y202	Y202-Y204 HydrophobicContact CD1-CD2 4.24Å
205	I	25.3	Very low	25.6	Very low	157 Å²	157	149.4 Å²	149.4	81%	0.805	76%	0.763	S	S	*	*				-169.9	122.9	117.1	-97.4	155.1	0	0	0	110.7
206	V	26.1	Very low	25.9	Very low	121 Å²	121	152.7 Å²	152.7	73%	0.733	77%	0.766	S	S	*	*			trans	31	133.8	142.5	-160.3	0	0	0	0	120.2
207	N	24.3	Very low	25.9	Very low	139 Å²	139	154.3 Å²	154.3	74%	0.743	76%	0.764	S	S	*	*			trans	-38.4	138.8	162	-42.8	-22.1	0	0	0	113.4
208	N	27.8	Very low	26.1	Very low	152 Å²	152	153.7 Å²	153.7	81%	0.813	76%	0.762	S	S	*	*				-173.3	169.4	113.3	-93.7	-3.8	0	0	0	113
209	E	24.7	Very low	26.4	Very low	160 Å²	160	152.6 Å²	152.6	75%	0.748	77%	0.765	S	S	*	*			trans	-69.7	166.6	-166.4	-59.1	157.1	134.1	0	0	115.6
210	H	28.8	Very low	26.3	Very low	175 Å²	175	151.1 Å²	151.1	81%	0.81	76%	0.761	S	S	*	*			trans	89.9	138.9	163	-64.2	-68.7	0	0	0	120.5
211	P	28.4	Very low	26.4	Very low	102 Å²	102	150.3 Å²	150.3	66%	0.662	77%	0.765	S	S	*	*			trans	-95.9	167.3	176.8	39.7	-36	0	0	0	112.6
212	H	28.9	Very low	26.4	Very low	164 Å²	164	149.6 Å²	149.6	76%	0.759	76%	0.762	S	S	*	*			trans	-179.8	117.9	131.7	-102.8	-75.7	0	0	0	113.4
213	Y	23.5	Very low	26.5	Very low	202 Å²	202	146.2 Å²	146.2	79%	0.792	76%	0.762	S	S	*	*			trans	59.5	156.8	132.1	-90	-103.3	0	0	0	124.3
214	L	26.2	Very low	26.6	Very low	160 Å²	160	148.4 Å²	148.4	84%	0.838	76%	0.762	S	S	*	*			trans	73.6	144	171.6	-59.4	165.3	0	0	0	116.8
215	S	23	Very low	26.9	Very low	93 Å²	93	148.5 Å²	148.5	65%	0.65	76%	0.763	S	S	*	*			cis	154.6	164.1	-29.7	177.1	0	0	0	0	107.8
216	E	28.7	Very low	27.3	Very low	177 Å²	177	147.2 Å²	147.2	83%	0.827	76%	0.756	S	S	*	*			trans	78.9	151	175.5	-57.2	178.5	-166.7	0	0	116.7
217	H	25.9	Very low	27.3	Very low	173 Å²	173	148 Å²	148	80%	0.801	76%	0.757	S	S	*	*			cis	176.1	179.6	-38.3	-128.8	-84.1	0	0	0	106.4
218	I	28.9	Very low	27.6	Very low	133 Å²	133	151.7 Å²	151.7	68%	0.682	76%	0.762	S	S	*	*			trans	105.2	112.2	154.4	-54.2	-165.6	0	0	0	118
219	Q	28.7	Very low	27.8	Very low	173 Å²	173	152.2 Å²	152.2	81%	0.808	76%	0.759	S	S	*	*			trans	50.1	134.8	149.4	-63.2	158.3	-10.3	0	0	121
220	S	24.5	Very low	27.8	Very low	107 Å²	107	151.4 Å²	151.4	75%	0.748	76%	0.76	S	S	*	*			cis	84.3	97.9	9.7	93.4	0	0	0	0	119.5
221	S	25.9	Very low	27.9	Very low	105 Å²	105	150.9 Å²	150.9	73%	0.734	76%	0.763	S	S	*	*				-171.2	148.5	126.7	64.3	0	0	0	0	112.3
222	D	29.2	Very low	27.8	Very low	147 Å²	147	153.2 Å²	153.2	79%	0.786	77%	0.769	S	S	*	*				159.3	147.3	126.9	-81.2	8.9	0	0	0	111.2
223	T	26.7	Very low	27.9	Very low	126 Å²	126	154 Å²	154	77%	0.773	77%	0.773	S	S	*	*			trans	-140.8	-173.3	-157.1	43.6	0	0	0	0	113.7
224	E	29.9	Very low	28	Very low	156 Å²	156	150.3 Å²	150.3	73%	0.729	76%	0.764	S	S	*	*			trans	80.5	148.3	173.5	-42.1	-178.6	167.4	0	0	114
225	Y	30.5	Very low	28.2	Very low	197 Å²	197	149.7 Å²	149.7	77%	0.773	76%	0.762	S	S	*	*			cis	-135.8	163.5	21.2	-120.3	-91.6	0	0	0	115.2
226	L	31.8	Very low	28.5	Very low	129 Å²	129	151.3 Å²	151.3	68%	0.675	76%	0.763	S	S	*	*			trans	-45.4	149.4	-171	-85.9	56.4	0	0	0	123.2
227	N	27.2	Very low	28.5	Very low	138 Å²	138	154.1 Å²	154.1	74%	0.738	77%	0.766	S	S	*	*			trans	33.8	141.3	130.9	-67.2	-30.1	0	0	0	123.2
228	Y	30.3	Very low	28.7	Very low	216 Å²	216	150.9 Å²	150.9	85%	0.847	76%	0.762	S	S	*	*				-156.6	118.2	113.1	-123.9	-85.8	0	0	0	114.4
229	H	31.4	Very low	28.5	Very low	164 Å²	164	151.6 Å²	151.6	76%	0.759	77%	0.768	S	S	*	*			trans	46.3	128.5	158.5	-88.4	-94.1	0	0	0	125
230	N	25.8	Very low	28.5	Very low	142 Å²	142	149.5 Å²	149.5	76%	0.759	77%	0.766	S	S	*	*			trans	-72.1	160.3	154.4	-61.1	-58.6	0	0	0	112.2
231	N	30.8	Very low	28.7	Very low	165 Å²	165	148.6 Å²	148.6	88%	0.882	76%	0.76	S	S	*	*			trans	-150.9	126.7	137.9	-102.3	-26.5	0	0	0	110.9
232	L	25.7	Very low	28.9	Very low	151 Å²	151	150.1 Å²	150.1	79%	0.791	76%	0.76	S	S	*	*			trans	-95.1	149.9	169	-85	139.6	0	0	0	109.3
233	H	30.8	Very low	28.8	Very low	179 Å²	179	151.9 Å²	151.9	83%	0.829	76%	0.761	S	S	*	*			trans	-138.7	144.3	145.1	-149.7	-82.2	0	0	0	110.3
234	M	25.5	Very low	29	Very low	126 Å²	126	151.4 Å²	151.4	62%	0.621	76%	0.758	S	S	*	*			trans	-97.4	155.9	179.3	-76.9	-81.8	-172.2	0	0	111.1	L236	M234-L236 HydrophobicContact CB-CD1 4.18Å; M234-L236 HydrophobicContact CB-CG 4.48Å
235	D	30.6	Very low	28.8	Very low	147 Å²	147	150.6 Å²	150.6	79%	0.786	76%	0.758	S	S	*	*			trans	-163.5	119.6	134.2	-87.9	-34.4	0	0	0	105.4
236	L	28.8	Very low	28.6	Very low	127 Å²	127	147 Å²	147	67%	0.665	76%	0.757	S	S	*	*			cis	57.5	124.6	46.7	-56.3	168.2	0	0	0	110.4	M234	M234-L236 HydrophobicContact CB-CD1 4.18Å; M234-L236 HydrophobicContact CB-CG 4.48Å
237	R	29	Very low	28.4	Very low	236 Å²	236	145.7 Å²	145.7	89%	0.891	76%	0.759	S	S	*	*			cis	-160.9	171.6	15.3	-110.2	174.3	-177.9	-175.5	0.5	107.6
238	S	30.9	Very low	28.5	Very low	105 Å²	105	146.6 Å²	146.6	73%	0.734	76%	0.762	S	S	*	*			cis	-160.2	169.9	-1	178.1	0	0	0	0	109
239	N	24.6	Very low	28.3	Very low	148 Å²	148	140.5 Å²	140.5	79%	0.791	76%	0.756	S	S	*	*			trans	-80.3	174.5	165.2	-60.2	-32.9	0	0	0	112.7
240	V	29.5	Very low	28.3	Very low	129 Å²	129	138.6 Å²	138.6	78%	0.782	76%	0.762	S	S	*	*			trans	128.9	128.7	134.1	-177.6	0	0	0	0	117
241	S	28.9	Very low	28.4	Very low	87 Å²	87	139.2 Å²	139.2	61%	0.608	77%	0.765	S	S	*	*			trans	64.9	113.7	150.9	73	0	0	0	0	124.6
242	D	29.3	Very low	28.7	Very low	138 Å²	138	135.8 Å²	135.8	74%	0.738	75%	0.752	S	S	*	*				75.7	118.7	105.8	-53.3	-23.7	0	0	0	125.5
243	F	26.8	Very low	29.1	Very low	184 Å²	184	134.8 Å²	134.8	81%	0.807	75%	0.747	S	S	*	*				75.9	151.3	127.8	-86.5	-93	0	0	0	125.2
244	T	31.4	Very low	29.1	Very low	115 Å²	115	132.2 Å²	132.2	71%	0.706	74%	0.739	S	S	*	*			trans	68.4	90.7	158.8	46.1	0	0	0	0	121.5
245	D	24.8	Very low	29.4	Very low	139 Å²	139	133.2 Å²	133.2	74%	0.743	74%	0.742	S	S	*	*				52.8	142.9	108.1	-67.4	-53	0	0	0	124.9
246	T	26.6	Very low	29.4	Very low	123 Å²	123	132.5 Å²	132.5	76%	0.755	74%	0.739	S	S	*	*			trans	74.3	99.4	146.2	46.1	0	0	0	0	122.7
247	S	27.3	Very low	29.4	Very low	100 Å²	100	137 Å²	137	70%	0.699	75%	0.747	S	S	*	*				105.2	150	105.4	80.8	0	0	0	0	122.3
248	I	29.1	Very low	29.4	Very low	158 Å²	158	129.8 Å²	129.8	81%	0.81	73%	0.733	S	S	*	*			trans	73.9	95.9	155.2	-62.7	156.6	0	0	0	119.8
249	A	25.9	Very low	29.3	Very low	88 Å²	88	134 Å²	134	73%	0.727	74%	0.741	S	S	*	*			trans	12.3	139.4	139.5	0	0	0	0	0	123
250	S	31.5	Very low	29.4	Very low	124 Å²	124	131.6 Å²	131.6	87%	0.867	74%	0.735	S	S	*	*				-167.7	154.3	112	-80.3	0	0	0	0	113.3
251	N	28.3	Very low	29.3	Very low	154 Å²	154	134.4 Å²	134.4	82%	0.824	74%	0.737	S	S	*	*			trans	-105.7	-171.5	177.4	-141.3	17.2	0	0	0	108.2
252	P	37.2	Very low	29.2	Very low	94 Å²	94	135 Å²	135	61%	0.61	75%	0.747	S	S	*	*			cis	-144.9	-172.7	10.7	42.5	-20.4	0	0	0	118.4
253	D	34	Very low	29.1	Very low	130 Å²	130	137.3 Å²	137.3	70%	0.695	75%	0.751	S	S	*	*			trans	108.5	121.5	130	-92.5	-1.5	0	0	0	123.7
254	N	31.5	Very low	29	Very low	125 Å²	125	133 Å²	133	67%	0.668	74%	0.744	S	S	*	*			trans	68.4	142.3	148.6	-67.7	-57.9	0	0	0	119.5
255	Q	32.1	Very low	28.6	Very low	146 Å²	146	132.2 Å²	132.2	68%	0.682	74%	0.743	S	S	*	*			cis	-157.2	154.8	8.4	-140.5	175.1	61.9	0	0	112.7
256	N	29.7	Very low	28.5	Very low	132 Å²	132	132.8 Å²	132.8	71%	0.706	74%	0.744	S	S	*	*			trans	67.4	139.5	160.9	-56.8	-45.1	0	0	0	119.1
257	R	29.1	Very low	28.3	Very low	221 Å²	221	134.8 Å²	134.8	83%	0.834	75%	0.747	S	S	*	*			cis	-164	141	-19.7	-161.3	-174.4	171.8	160.9	-2.1	109.2
258	S	29.1	Very low	28.1	Very low	86 Å²	86	138 Å²	138	60%	0.601	75%	0.749	S	S	*	*			trans	22.3	133.3	157.8	63.1	0	0	0	0	121.1
259	E	29.3	Very low	27.9	Very low	193 Å²	193	138 Å²	138	90%	0.902	75%	0.749	S	S	*	*			cis	-161.9	148.5	0.5	-134.3	160.3	-131	0	0	112.1
260	S	25.8	Very low	27.7	Very low	97 Å²	97	140.2 Å²	140.2	68%	0.678	75%	0.749	S	S	*	*			trans	-146.7	153.1	170.3	59.7	0	0	0	0	108.9
261	K	26.8	Very low	27.5	Very low	189 Å²	189	141 Å²	141	82%	0.822	74%	0.743	S	S	*	*			trans	165.7	146.4	133.2	-93	156.9	-174.1	175.8	0	113.5
262	A	27.6	Very low	27.4	Very low	99 Å²	99	140.7 Å²	140.7	82%	0.818	74%	0.737	S	S	*	*			trans	-72.3	145.9	152.5	0	0	0	0	0	110.3
263	K	27.2	Very low	26.7	Very low	186 Å²	186	143.4 Å²	143.4	81%	0.809	75%	0.745	S	S	*	*			trans	-133.1	128.3	162.3	-67.6	179.7	-178.2	174.7	0	106.9
264	S	24.1	Very low	26.3	Very low	94 Å²	94	143 Å²	143	66%	0.657	75%	0.752	S	S	*	*			cis	83.6	114.9	34.7	84.3	0	0	0	0	114.5
265	S	23.2	Very low	26	Very low	99 Å²	99	144.4 Å²	144.4	69%	0.692	75%	0.754	S	S	*	*			trans	67.6	125.5	143.6	-58.3	0	0	0	0	120.6
266	I	22.2	Very low	25.7	Very low	151 Å²	151	142.2 Å²	142.2	77%	0.774	76%	0.761	S	S	*	*			trans	58	115.8	131.4	-53.9	165.4	0	0	0	117
267	M	23.3	Very low	25.5	Very low	165 Å²	165	143.3 Å²	143.3	81%	0.813	76%	0.762	S	S	*	*				-169.7	154.9	116.3	-99	-163.2	175.9	0	0	112.2
268	F	22.6	Very low	25.3	Very low	168 Å²	168	137 Å²	137	74%	0.737	76%	0.757	S	S	*	*			trans	-15.2	155.7	164.5	-52.3	-86.6	0	0	0	118.7
269	L	25.2	Very low	25.3	Very low	156 Å²	156	138.9 Å²	138.9	82%	0.817	77%	0.767	S	S	*	*			cis	-141.1	174.9	36.7	-79.9	162.2	0	0	0	114.1
270	N	21.8	Very low	25	Very low	136 Å²	136	135.8 Å²	135.8	73%	0.727	76%	0.761	S	S	*	*			trans	-67.4	163.4	167.9	-48.8	-53.6	0	0	0	111.3
271	D	26.4	Very low	25.1	Very low	139 Å²	139	139 Å²	139	74%	0.743	77%	0.769	S	S	*	*				-166	127	109.1	-94.6	-10.5	0	0	0	114.2
272	H	26.3	Very low	25.1	Very low	148 Å²	148	137.2 Å²	137.2	69%	0.685	76%	0.764	S	S	*	*			trans	37.2	120.9	145.3	-64.5	-67.1	0	0	0	124.2
273	L	24	Very low	25	Very low	151 Å²	151	138.5 Å²	138.5	79%	0.791	76%	0.757	S	S	*	*			trans	59.2	142.2	136.1	-77.4	78.5	0	0	0	118.7
274	C	25.5	Very low	25	Very low	123 Å²	123	136.8 Å²	136.8	83%	0.831	76%	0.756	S	S	*	*			cis	-148.6	167.6	43.7	-96.4	0	0	0	0	113.8
275	E	23.7	Very low	25.1	Very low	153 Å²	153	140.7 Å²	140.7	72%	0.715	76%	0.761	S	S	*	*			trans	-86.8	161.6	172.2	-57	165.9	64.2	0	0	114.2	Q277	E275-Q277 HydrophobicContact CB-CG 4.02Å; E275-Q277 WeakPolarHBondContact OE1-CG 3.3Å; E275-Q277 PolarHBondContact OE1-NE2 3.33Å
276	A	27.6	Very low	25.2	Very low	100 Å²	100	141.2 Å²	141.2	83%	0.826	76%	0.764	S	S	*	*			trans	-157.2	85.6	138.8	0	0	0	0	0	107.2
277	Q	24.4	Very low	25.4	Very low	156 Å²	156	138.8 Å²	138.8	73%	0.729	76%	0.76	S	S	*	*				59.7	128.3	86	-64.2	-166.2	-0.8	0	0	114.9	E275	E275-Q277 HydrophobicContact CB-CG 4.02Å; E275-Q277 WeakPolarHBondContact OE1-CG 3.3Å; E275-Q277 PolarHBondContact OE1-NE2 3.33Å
278	A	25.9	Very low	25.5	Very low	87 Å²	87	136.5 Å²	136.5	72%	0.719	75%	0.751	S	S	*	*			trans	-94	-171.4	178.6	0	0	0	0	0	111.4
279	P	27.8	Very low	25.6	Very low	127 Å²	127	137.7 Å²	137.7	83%	0.825	75%	0.751	S	S	*	*			trans	-125.2	123.6	138.3	34.2	-26.8	0	0	0	112.6
280	T	23.6	Very low	25.6	Very low	127 Å²	127	137.4 Å²	137.4	78%	0.779	75%	0.749	S	S	*	*			trans	-95.4	131.4	165.7	45.5	0	0	0	0	110.8
281	I	28.4	Very low	25.9	Very low	165 Å²	165	136.1 Å²	136.1	85%	0.846	75%	0.751	S	S	*	*			trans	-147.6	139.1	161.7	-57.7	-179.3	0	0	0	106.2
282	E	26.2	Very low	25.9	Very low	151 Å²	151	138 Å²	138	71%	0.706	76%	0.755	S	S	*	*			cis	176.2	135.9	-33.9	-117.2	-159.3	-154.4	0	0	104.4
283	N	25.2	Very low	26.2	Very low	126 Å²	126	135.7 Å²	135.7	67%	0.674	75%	0.753	S	S	*	*			trans	60.4	147.8	141.5	-66.1	-41.3	0	0	0	124.1
284	L	27.6	Very low	26.4	Very low	150 Å²	150	135.9 Å²	135.9	79%	0.785	76%	0.755	S	S	*	*			trans	85.7	125.9	166.8	-51.3	178.1	0	0	0	117.1
285	K	26.9	Very low	26.4	Very low	177 Å²	177	134.8 Å²	134.8	77%	0.77	75%	0.748	S	S	*	*			cis	161.9	126.9	-21.9	-110.5	-174.9	-175.7	178.4	0	105
286	S	25	Very low	26.6	Very low	109 Å²	109	137.4 Å²	137.4	76%	0.762	76%	0.758	S	S	*	*			trans	52.2	140	151.1	62	0	0	0	0	119.9
287	C	25.4	Very low	26.5	Very low	101 Å²	101	140.8 Å²	140.8	68%	0.682	76%	0.756	S	S	*	*			cis	-171.2	145.5	45.5	-131.7	0	0	0	0	111.6
288	N	26.9	Very low	26.8	Very low	117 Å²	117	141.2 Å²	141.2	63%	0.626	76%	0.764	S	S	*	*				38.5	147.7	126.9	-77.6	-50.2	0	0	0	121.9
289	R	23.9	Very low	26.7	Very low	192 Å²	192	140.1 Å²	140.1	73%	0.725	76%	0.761	S	S	*	*			cis	-179.4	170.8	-10.7	-142	-177	-146.8	-140.4	4.8	108.4
290	L	24.9	Very low	26.8	Very low	150 Å²	150	146.5 Å²	146.5	79%	0.785	77%	0.769	S	S	*	*			trans	68.6	152.2	160.6	-65.9	151.6	0	0	0	116.1
291	S	28	Very low	26.8	Very low	109 Å²	109	148.2 Å²	148.2	76%	0.762	77%	0.773	S	S	*	*			cis	-155.3	160.4	-5.8	39.3	0	0	0	0	113.1
292	H	27	Very low	26.7	Very low	179 Å²	179	147.1 Å²	147.1	83%	0.829	77%	0.768	S	S	*	*			trans	-59.2	177.5	163.3	-74.4	-85.9	0	0	0	114.1
293	P	32.6	Very low	26.8	Very low	99 Å²	99	143.4 Å²	143.4	64%	0.643	77%	0.771	S	S	*	*			cis	-132.7	-165.9	-39	34.1	-13.8	0	0	0	110.7
294	D	28.5	Very low	26.8	Very low	155 Å²	155	145.3 Å²	145.3	83%	0.829	78%	0.776	S	S	*	*				179.5	163.8	116.9	-94.9	-19.1	0	0	0	113
295	S	24.8	Very low	26.8	Very low	100 Å²	100	146.1 Å²	146.1	70%	0.699	78%	0.781	S	S	*	*			trans	-91.7	156.1	-175.6	54.5	0	0	0	0	114
296	F	28.2	Very low	26.8	Very low	209 Å²	209	141.9 Å²	141.9	92%	0.917	77%	0.773	S	S	*	*			trans	-154.5	145.6	134.9	-115.7	-75.9	0	0	0	111.5
297	E	25.9	Very low	26.9	Very low	170 Å²	170	144.4 Å²	144.4	79%	0.794	78%	0.777	S	S	*	*			trans	-85.7	148.9	168.8	-62.8	-178.1	110	0	0	110.3
298	D	30.4	Very low	27	Very low	165 Å²	165	147.3 Å²	147.3	88%	0.882	78%	0.78	S	S	*	*				178.4	142.8	115.3	-97.5	-32.3	0	0	0	110.5
299	G	24.7	Very low	26.8	Very low	65 Å²	65	150.5 Å²	150.5	67%	0.67	79%	0.791	S	S	*	*			trans	-104.1	155.2	-172.9	0	0	0	0	0	114.4
300	W	28.3	Very low	26.8	Very low	260 Å²	260	147.3 Å²	147.3	99%	0.985	80%	0.797	S	S	*	*			trans	-133.9	156.4	163.2	-89.8	86.3	0	0	0	111.3
301	L	25.1	Very low	26.9	Very low	163 Å²	163	144.8 Å²	144.8	85%	0.853	80%	0.797	S	S	*	*			trans	-104.2	161.8	-157.8	-80.8	163.9	0	0	0	115.3
302	D	25.7	Very low	26.8	Very low	142 Å²	142	147.6 Å²	147.6	76%	0.759	80%	0.804	S	S	*	*			trans	74.3	147.4	156.4	-136.7	-23.1	0	0	0	118.3
303	G	27.8	Very low	26.6	Very low	73 Å²	73	151 Å²	151	75%	0.753	81%	0.809	S	S	*	*			trans	158.5	64.5	-165.8	0	0	0	0	0	112.8
304	Q	26.2	Very low	26.2	Very low	166 Å²	166	151.7 Å²	151.7	78%	0.776	82%	0.816	S	S	*	*			trans	-60.7	140.3	-175.7	-60.1	166.4	13.8	0	0	113.3
305	N	27.8	Very low	26	Very low	167 Å²	167	149.3 Å²	149.3	89%	0.893	81%	0.807	S	S	*	*			trans	-155.8	127.5	145.5	-115.8	-39.9	0	0	0	111.2
306	S	25.1	Very low	26	Very low	88 Å²	88	152 Å²	152	62%	0.615	81%	0.814	S	S	*	*			trans	-130.8	125.3	-175.5	148.4	0	0	0	0	109.5
307	I	28.3	Very low	25.8	Very low	162 Å²	162	151.1 Å²	151.1	83%	0.831	80%	0.804	S	S	*	*			trans	-124.8	106.4	165.3	-60.9	-178.7	0	0	0	107.4
308	H	26.7	Very low	25.9	Very low	163 Å²	163	149.6 Å²	149.6	76%	0.755	81%	0.807	S	S	*	*			trans	-74.9	132.6	177.8	-98.8	-104.4	0	0	0	111.2
309	H	22.7	Very low	25.6	Very low	184 Å²	184	148.5 Å²	148.5	85%	0.852	80%	0.801	S	S	*	*			trans	-80.2	128.4	157.8	-79.9	-76.4	0	0	0	109.9
310	C	23.9	Very low	25.7	Very low	125 Å²	125	152.6 Å²	152.6	85%	0.845	81%	0.807	S	S	*	*			trans	-152.7	113.8	162.1	-108.2	0	0	0	0	110.1
311	A	27.1	Very low	25.7	Very low	96 Å²	96	146.2 Å²	146.2	79%	0.793	80%	0.797	S	S	*	*			trans	-147.2	72.6	168.7	0	0	0	0	0	108.3
312	N	25.6	Very low	25.6	Very low	169 Å²	169	148 Å²	148	90%	0.904	80%	0.802	S	S	*	*			trans	-69.7	133.3	-179.9	-126.2	3.5	0	0	0	109.8
313	W	23	Very low	25.7	Very low	251 Å²	251	147.2 Å²	147.2	95%	0.951	81%	0.807	S	S	*	*			trans	-75.7	130.9	172.3	-64.4	-34	0	0	0	110.8
314	S	24.5	Very low	25.4	Very low	112 Å²	112	149.6 Å²	149.6	78%	0.783	81%	0.812	S	S	*	*			trans	-124.4	144.8	149.5	-167.5	0	0	0	0	108.4
315	V	24.7	Very low	25.5	Very low	105 Å²	105	147.5 Å²	147.5	64%	0.636	82%	0.816	S	S	*	*			trans	-130.4	114.5	-172.3	171.1	0	0	0	0	108.6
316	D	25.2	Very low	25.4	Very low	157 Å²	157	151.2 Å²	151.2	84%	0.84	82%	0.817	S	S	*	*			trans	-111.8	137.7	167.9	-86.4	-58.3	0	0	0	110.9
317	W	22.7	Very low	25.5	Very low	190 Å²	190	150.8 Å²	150.8	72%	0.72	81%	0.814	S	S	*	*			trans	-112.1	119.2	177.4	-77.7	37.8	0	0	0	109.7
318	T	28.4	Very low	25.3	Very low	138 Å²	138	148.9 Å²	148.9	85%	0.847	81%	0.806	S	S	*	*			trans	-131.2	135.2	157.8	50.4	0	0	0	0	110.4
319	N	24	Very low	25.3	Very low	143 Å²	143	150.9 Å²	150.9	77%	0.765	81%	0.808	S	S	*	*			trans	-78.8	141.8	173.5	-54.9	-69.5	0	0	0	109.4
320	N	27.4	Very low	25.5	Very low	150 Å²	150	149.5 Å²	149.5	80%	0.802	80%	0.802	S	S	*	*			trans	-154	115.3	144	-86.7	-46.8	0	0	0	106
321	T	27.8	Very low	25.5	Very low	126 Å²	126	148.4 Å²	148.4	77%	0.773	80%	0.796	S	S	*	*				53.6	134.2	63.1	50.1	0	0	0	0	115
322	E	22.7	Very low	25.3	Very low	202 Å²	202	148.4 Å²	148.4	94%	0.944	79%	0.79	S	S	*	*			trans	-84.6	137.3	-162.9	-57.2	164.5	131.9	0	0	112.4
323	S	27.5	Very low	25.2	Very low	124 Å²	124	147.2 Å²	147.2	87%	0.867	78%	0.783	S	S	*	*			trans	-153.8	137	153.9	62	0	0	0	0	110.2
324	S	23.1	Very low	25.3	Very low	123 Å²	123	139.5 Å²	139.5	86%	0.86	77%	0.768	S	S	*	*			trans	-118.2	130.3	-173.1	59.1	0	0	0	0	112
325	S	28.5	Very low	25.2	Very low	123 Å²	123	143.5 Å²	143.5	86%	0.86	77%	0.771	S	S	*	*			trans	-146.5	122.5	166.1	55.8	0	0	0	0	112.9
326	R	24.8	Very low	25.3	Very low	244 Å²	244	146.5 Å²	146.5	92%	0.921	78%	0.778	S	S	*	*			trans	-68.6	165.4	166.4	-93.3	-174.3	165.2	163.4	-6.2	110.9
327	S	26.3	Very low	25.2	Very low	79 Å²	79	145.1 Å²	145.1	55%	0.552	77%	0.769	S	S	*	*			cis	179.3	172	-6.2	48.5	0	0	0	0	113.1
328	N	24.7	Very low	25.3	Very low	122 Å²	122	142.1 Å²	142.1	65%	0.652	77%	0.774	S	S	*	*			trans	101.4	154	143.8	-64.9	-21.8	0	0	0	120.9
329	Y	26.9	Very low	25.1	Very low	205 Å²	205	141.8 Å²	141.8	80%	0.804	77%	0.766	S	S	*	*			trans	75.1	140.3	166.3	-56.1	-76.9	0	0	0	118.7
330	H	26.2	Very low	25.1	Very low	155 Å²	155	142.3 Å²	142.3	72%	0.718	77%	0.768	S	S	*	*			cis	-170.4	144.2	-33.8	-137	-89.5	0	0	0	110.3
331	S	24.3	Very low	24.9	Very low	103 Å²	103	142.9 Å²	142.9	72%	0.72	76%	0.764	S	S	*	*			trans	59.2	162.6	158.9	-72.6	0	0	0	0	119.9
332	S	23.4	Very low	24.7	Very low	95 Å²	95	144 Å²	144	66%	0.664	77%	0.765	S	S	*	*			cis	-171.4	148.8	-31.1	55	0	0	0	0	112.5
333	N	24.1	Very low	24.8	Very low	144 Å²	144	138.5 Å²	138.5	77%	0.77	75%	0.75	S	S	*	*			trans	67.7	90.9	149.2	-65.7	-5.3	0	0	0	123.6
334	S	23.9	Very low	24.7	Very low	89 Å²	89	141.5 Å²	141.5	62%	0.622	75%	0.747	S	S	*	*				62.6	134.4	106.9	78.2	0	0	0	0	124.6
335	K	23.7	Very low	24.8	Very low	196 Å²	196	146.1 Å²	146.1	85%	0.852	75%	0.746	S	S	*	*			trans	71.5	149.3	152.9	-63.1	165.6	-177.4	178.6	0	116
336	H	25.6	Very low	24.6	Very low	169 Å²	169	144.4 Å²	144.4	78%	0.782	73%	0.733	S	S	*	*			cis	-147.9	159.5	7.8	-152.9	-86.9	0	0	0	111.5
337	I	24.4	Very low	24.7	Very low	127 Å²	127	141 Å²	141	65%	0.651	73%	0.732	S	S	*	*			trans	-82.9	155.3	172.5	-19.4	178.6	0	0	0	110.6	I339	I337-I339 HydrophobicContact CG2-CG1 4.23Å
338	P	24.9	Very low	24.6	Very low	128 Å²	128	140.9 Å²	140.9	83%	0.831	74%	0.743	S	S	*	*				-141.4	165	97	39.4	-26.2	0	0	0	115.8
339	I	22.4	Very low	24.8	Very low	131 Å²	131	139.4 Å²	139.4	67%	0.672	75%	0.748	S	S	*	*			trans	-100.8	155.1	178.2	-60.4	157	0	0	0	109.2	I337 F341	I337-I339 HydrophobicContact CG2-CG1 4.23Å; I339-F341 HydrophobicContact CG2-CD2 4.19Å; I339-F341 HydrophobicContact CG2-CE2 4.21Å
340	N	25.4	Very low	24.7	Very low	153 Å²	153	135.7 Å²	135.7	82%	0.818	75%	0.747	S	S	*	*			trans	-145	154.6	139.5	-152.9	12.3	0	0	0	113.6
341	F	22.2	Very low	24.6	Very low	162 Å²	162	133.5 Å²	133.5	71%	0.711	75%	0.749	S	S	*	*			trans	-82.4	159.3	176.5	-78.3	-111.5	0	0	0	110.3	I339	I339-F341 HydrophobicContact CG2-CD2 4.19Å; I339-F341 HydrophobicContact CG2-CE2 4.21Å
342	D	23.8	Very low	24.7	Very low	150 Å²	150	139.5 Å²	139.5	80%	0.802	76%	0.757	S	S	*	*				-171.3	146	80.5	-116.1	-35.9	0	0	0	113.2
343	S	25.6	Very low	24.7	Very low	87 Å²	87	142 Å²	142	61%	0.608	76%	0.762	S	S	*	*				170.1	148.1	104.9	55.9	0	0	0	0	114.2
344	F	25.1	Very low	24.8	Very low	186 Å²	186	138.3 Å²	138.3	82%	0.816	76%	0.758	S	S	*	*			trans	59.6	115.7	171.6	-51.7	-70.3	0	0	0	117.8
345	R	24.8	Very low	24.8	Very low	220 Å²	220	139 Å²	139	83%	0.83	77%	0.769	S	S	*	*			cis	66.8	137	46.7	-65.2	-166.8	161.3	-128.5	2.3	113.8
346	C	23.7	Very low	24.9	Very low	88 Å²	88	141.1 Å²	141.1	60%	0.595	77%	0.772	S	S	*	*			cis	-163.1	-176.4	1.4	-119.6	0	0	0	0	111.9
347	L	27.1	Very low	24.9	Very low	171 Å²	171	138.4 Å²	138.4	90%	0.895	77%	0.772	S	S	*	*			trans	78.3	119.3	166.1	-44.8	-178.1	0	0	0	116.3
348	G	24.6	Very low	25	Very low	77 Å²	77	137.5 Å²	137.5	79%	0.794	77%	0.774	S	S	*	*			cis	124.1	116.4	-19.6	0	0	0	0	0	116.4
349	A	28.7	Very low	25.2	Very low	92 Å²	92	138.8 Å²	138.8	76%	0.76	77%	0.774	S	S	*	*			trans	-175.5	101.3	152.9	0	0	0	0	0	107.7
350	T	25	Very low	25.5	Very low	127 Å²	127	138 Å²	138	78%	0.779	78%	0.778	S	S	*	*				61.4	103.6	66.3	73.6	0	0	0	0	115.4
351	S	24.3	Very low	25.6	Very low	108 Å²	108	139.7 Å²	139.7	76%	0.755	78%	0.778	S	S	*	*			trans	46.2	134.4	132.5	-48.4	0	0	0	0	121.1
352	Y	25.4	Very low	26	Very low	229 Å²	229	139.7 Å²	139.7	90%	0.898	78%	0.778	S	S	*	*				-155.1	151.7	113	-128	-88.5	0	0	0	113.5
353	I	24.9	Very low	26.2	Very low	148 Å²	148	138.3 Å²	138.3	76%	0.759	77%	0.771	S	S	*	*			trans	-111.3	132.6	176.9	-66.8	170.8	0	0	0	109.2
354	G	24.6	Very low	26.2	Very low	67 Å²	67	139.1 Å²	139.1	69%	0.691	78%	0.776	S	S	*	*			trans	76.7	110.9	141.2	0	0	0	0	0	120.4
355	A	24.5	Very low	26.3	Very low	102 Å²	102	138.3 Å²	138.3	84%	0.843	78%	0.779	S	S	*	*			trans	78.9	151.4	136	0	0	0	0	0	121.6
356	R	25.3	Very low	26.5	Very low	242 Å²	242	131.3 Å²	131.3	91%	0.913	77%	0.768	S	S	*	*			trans	71	94.6	167.4	-66.4	-173.5	171.3	-173.6	-2.9	118.7
357	S	25.7	Very low	26.6	Very low	112 Å²	112	133.1 Å²	133.1	78%	0.783	78%	0.776	S	S	*	*				26.5	130	128.5	-165.7	0	0	0	0	119.5
358	P	27.7	Very low	26.8	Very low	107 Å²	107	133.2 Å²	133.2	70%	0.695	77%	0.769	S	S	*	*			trans	-75.2	153.8	177.9	33.6	-37.1	0	0	0	113.5
359	N	29.1	Very low	27	Very low	155 Å²	155	136.3 Å²	136.3	83%	0.829	77%	0.768	S	S	*	*				-175.4	160.7	126.9	-101.1	-44.3	0	0	0	113.6
360	C	27.9	Very low	27.2	Very low	114 Å²	114	135.9 Å²	135.9	77%	0.77	76%	0.76	S	S	*	*			trans	58	93.5	165	-75.8	0	0	0	0	120.8
361	K	28	Very low	27.4	Very low	189 Å²	189	138.4 Å²	138.4	82%	0.822	76%	0.762	S	S	*	*				39.3	126.2	116.1	-75.4	177.7	176.4	172.2	0	120.6
362	K	29.5	Very low	27.7	Very low	163 Å²	163	138 Å²	138	71%	0.709	76%	0.759	S	S	*	*				97.3	129.8	129	-84	177.3	143.2	-87.7	0	121.2
363	D	29.5	Very low	28	Very low	121 Å²	121	132.8 Å²	132.8	65%	0.647	75%	0.751	S	S	*	*			trans	61.1	138.4	143	-44.4	-19	0	0	0	118.2
364	C	25.6	Very low	28.4	Very low	104 Å²	104	131.9 Å²	131.9	70%	0.703	75%	0.748	S	S	*	*			cis	-172.5	145.1	-12.9	-114.1	0	0	0	0	111.3
365	L	26.5	Very low	28.7	Very low	169 Å²	169	136.8 Å²	136.8	89%	0.885	75%	0.753	S	S	*	*			trans	64.7	161.7	158.1	-56.3	166.9	0	0	0	119
366	A	28	Very low	29	Very low	73 Å²	73	136 Å²	136	60%	0.603	74%	0.741	S	S	*	*			cis	-172.2	149.8	-32	0	0	0	0	0	113.1
367	T	26.8	Very low	29.2	Very low	125 Å²	125	133.6 Å²	133.6	77%	0.767	73%	0.733	S	S	*	*			trans	65.5	159.4	155.9	52.5	0	0	0	0	120.4
368	K	31.2	Very low	29.5	Very low	173 Å²	173	137 Å²	137	75%	0.752	73%	0.734	S	S	*	*			cis	-168.3	157.2	0.6	-116.6	168.6	-178.4	179.9	0	112.5
369	N	29.7	Very low	29.6	Very low	142 Å²	142	135.1 Å²	135.1	76%	0.759	73%	0.734	S	S	*	*			trans	62.5	160.3	146.3	-67.2	21	0	0	0	121.9
370	S	30.8	Very low	29.7	Very low	84 Å²	84	135 Å²	135	59%	0.587	74%	0.738	S	S	*	*			cis	-176.5	142	-16.8	49.8	0	0	0	0	114.9
371	E	29.7	Very low	30.1	Very low	180 Å²	180	134.4 Å²	134.4	84%	0.841	73%	0.734	S	S	*	*			trans	64.3	164.6	143.4	-70.8	164.3	69.4	0	0	123.2
372	S	31.1	Very low	30.2	Very low	98 Å²	98	132.2 Å²	132.2	69%	0.685	73%	0.731	S	S	*	*			cis	-172.4	-172.6	-23.7	58.8	0	0	0	0	113.7
373	V	32.7	Very low	30.2	Very low	121 Å²	121	131.1 Å²	131.1	73%	0.733	73%	0.732	S	S	*	*			trans	100.5	106.5	159.8	-170.1	0	0	0	0	124.7
374	D	31.5	Very low	30.1	Very low	129 Å²	129	130.4 Å²	130.4	69%	0.69	74%	0.737	S	S	*	*			trans	53	132	130.7	-55.9	-6.7	0	0	0	132.4
375	H	31.8	Very low	30.2	Very low	170 Å²	170	129.7 Å²	129.7	79%	0.787	73%	0.732	S	S	*	*			trans	56.1	159.9	130	-66.9	-21.5	0	0	0	126.8
376	S	30.6	Very low	30.4	Very low	85 Å²	85	129.4 Å²	129.4	59%	0.594	73%	0.732	S	S	*	*			cis	-177.2	163.5	-29.7	-164	0	0	0	0	115.8
377	Y	30.4	Very low	30.5	Very low	191 Å²	191	135.1 Å²	135.1	75%	0.749	75%	0.746	S	S	*	*			trans	82.7	127.8	148.8	-79.8	-52.8	0	0	0	129
378	K	31.1	Very low	30.6	Very low	183 Å²	183	136.6 Å²	136.6	80%	0.796	74%	0.744	S	S	*	*			trans	56.7	152.7	138.8	-77.1	159.7	-179.1	169.3	0	123
379	G	29.9	Very low	30.3	Very low	69 Å²	69	136.7 Å²	136.7	71%	0.711	75%	0.745	S	S	*	*			cis	161.5	177.8	-8.8	0	0	0	0	0	116
380	V	32.4	Very low	30.2	Very low	151 Å²	151	136.3 Å²	136.3	92%	0.915	74%	0.742	S	S	*	*			trans	95.7	145.2	160.2	-177.7	0	0	0	0	120.6
381	P	35.8	Very low	30.2	Very low	103 Å²	103	137.5 Å²	137.5	67%	0.669	75%	0.751	S	S	*	*			trans	-139.9	-156.3	-156.4	45	-23.8	0	0	0	118.8
382	N	29.7	Very low	30	Very low	142 Å²	142	132.4 Å²	132.4	76%	0.759	75%	0.747	S	S	*	*			trans	92.1	157.5	163.7	-65.2	-20.3	0	0	0	119.4
383	L	29	Very low	30	Very low	141 Å²	141	133.9 Å²	133.9	74%	0.738	75%	0.754	S	S	*	*			cis	-159.3	143.7	7.9	-155.5	83.8	0	0	0	115.6
384	S	27	Very low	30	Very low	106 Å²	106	138 Å²	138	74%	0.741	76%	0.762	S	S	*	*			trans	65.1	167.4	150.1	85.8	0	0	0	0	121.1
385	S	29.3	Very low	29.6	Very low	88 Å²	88	139.7 Å²	139.7	62%	0.615	77%	0.77	S	S	*	*			cis	-159.1	162.1	2.7	74.6	0	0	0	0	115.3
386	N	30.7	Very low	29.5	Very low	164 Å²	164	137.9 Å²	137.9	88%	0.877	78%	0.775	S	S	*	*			trans	75.9	151.9	145.6	-63	-14.5	0	0	0	124.8
387	H	29.5	Very low	29.2	Very low	192 Å²	192	140.2 Å²	140.2	89%	0.889	78%	0.781	S	S	*	*			trans	-163.1	135.9	-165.3	-144.4	-38.5	0	0	0	109.5
388	Q	28.5	Very low	29	Very low	157 Å²	157	137.9 Å²	137.9	73%	0.734	78%	0.777	S	S	*	*			trans	-163.9	133.7	170	-158.3	134	45.8	0	0	116.5
389	F	25.7	Very low	28.9	Very low	175 Å²	175	138.3 Å²	138.3	77%	0.768	78%	0.779	S	S	*	*			trans	37.3	162.5	156.6	-56.9	-41.4	0	0	0	122
390	D	26.7	Very low	28.7	Very low	133 Å²	133	137.9 Å²	137.9	71%	0.711	77%	0.774	S	S	*	*			cis	-155.2	167.5	8.1	-146.2	-45.2	0	0	0	113.2
391	S	31.4	Very low	28.4	Very low	109 Å²	109	136.7 Å²	136.7	76%	0.762	77%	0.773	S	S	*	*			trans	65.6	124.4	141.3	-77	0	0	0	0	125.1
392	G	25.5	Very low	27.9	Very low	74 Å²	74	136.6 Å²	136.6	76%	0.763	78%	0.775	S	S	*	*				102.3	116.7	125.2	0	0	0	0	0	119.8
393	P	30.4	Very low	27.8	Very low	129 Å²	129	137.4 Å²	137.4	84%	0.838	78%	0.778	S	S	*	*			trans	-101.3	147.8	177.4	37.2	-32.7	0	0	0	114.8
394	K	32.2	Very low	27.6	Very low	208 Å²	208	136 Å²	136	90%	0.904	78%	0.78	S	S	*	*			trans	-146.5	151.5	160.9	-79.9	-167.1	176.9	177.1	0	112.2
395	L	24.8	Very low	27.9	Very low	163 Å²	163	136 Å²	136	85%	0.853	78%	0.778	S	S	*	*			trans	-79.3	153.2	169.9	-60.9	106.7	0	0	0	111.6
396	C	29.2	Very low	27.8	Very low	132 Å²	132	140.5 Å²	140.5	89%	0.892	79%	0.789	S	S	*	*				-170.5	169.7	128.1	-104.1	0	0	0	0	110.9
397	N	24.6	Very low	27.8	Very low	134 Å²	134	138 Å²	138	72%	0.717	78%	0.784	S	S	*	*			trans	-95.9	177.5	-168	-62.4	-11.5	0	0	0	114.3
398	E	26.1	Very low	27.6	Very low	143 Å²	143	137.4 Å²	137.4	67%	0.668	78%	0.782	S	S	*	*			trans	90.3	130.8	133.3	-96.2	163.8	-147.3	0	0	122.1
399	F	27.8	Very low	27.5	Very low	192 Å²	192	134.1 Å²	134.1	84%	0.842	78%	0.776	S	S	*	*			trans	55.2	150.4	164.9	-49.2	-64.6	0	0	0	118.5
400	G	25.6	Very low	27.5	Very low	59 Å²	59	130.7 Å²	130.7	61%	0.608	77%	0.77	S	S	*	*			cis	145	136.6	-3.7	0	0	0	0	0	111.4
401	S	26.3	Very low	27.5	Very low	127 Å²	127	132.5 Å²	132.5	89%	0.888	77%	0.771	S	S	*	*			trans	77.8	156	-176.4	-35.4	0	0	0	0	114.6
402	S	26.5	Very low	27.2	Very low	100 Å²	100	134.4 Å²	134.4	70%	0.699	77%	0.772	S	S	*	*			cis	-165.7	145.3	-2.8	27	0	0	0	0	113.8
403	L	26.6	Very low	27.2	Very low	160 Å²	160	135.8 Å²	135.8	84%	0.838	77%	0.769	S	S	*	*			trans	50.2	114.5	147.7	-75.3	79.2	0	0	0	123.1
404	S	25.8	Very low	27	Very low	111 Å²	111	137 Å²	137	78%	0.776	77%	0.768	S	S	*	*				37.1	165.1	100.3	-66.1	0	0	0	0	123.1
405	P	32.5	Very low	26.7	Very low	107 Å²	107	132.9 Å²	132.9	70%	0.695	76%	0.76	S	S	*	*			cis	-142.5	-159	-20.1	31.2	-5.5	0	0	0	115.3
406	Q	27	Very low	26.7	Very low	182 Å²	182	132.5 Å²	132.5	85%	0.85	76%	0.758	S	S	*	*			trans	89	149.4	161.7	-56.5	-164.3	12.4	0	0	118.2
407	S	30.2	Very low	26.6	Very low	111 Å²	111	131.2 Å²	131.2	78%	0.776	75%	0.75	S	S	*	*			cis	-150.5	-174.9	0.4	34.9	0	0	0	0	113.6
408	E	26.5	Very low	26.6	Very low	180 Å²	180	132.4 Å²	132.4	84%	0.841	76%	0.757	S	S	*	*			trans	-86.5	-172.6	-167.4	-49.3	167.3	124.1	0	0	113.6
409	S	26.3	Very low	26.6	Very low	88 Å²	88	132.8 Å²	132.8	62%	0.615	77%	0.769	S	S	*	*			cis	-172.4	152.3	27.9	-143.5	0	0	0	0	117.5
410	T	25.1	Very low	26.6	Very low	102 Å²	102	130.1 Å²	130.1	63%	0.626	77%	0.768	S	S	*	*			trans	68.2	123.7	143	49.6	0	0	0	0	126.9
411	K	27.5	Very low	26.6	Very low	172 Å²	172	132.7 Å²	132.7	75%	0.748	78%	0.777	S	S	*	*				105.9	121	117.7	-82.6	166.5	-171.4	167.2	0	123.3
412	L	25.4	Very low	26.6	Very low	148 Å²	148	136 Å²	136	78%	0.775	78%	0.778	S	S	*	*			trans	60.5	115.7	137.2	-60.6	164.5	0	0	0	118.9
413	C	24.3	Very low	26.6	Very low	104 Å²	104	137.7 Å²	137.7	70%	0.703	78%	0.784	S	S	*	*			cis	94.7	112.3	47.7	-74.5	0	0	0	0	114.5
414	N	27	Very low	26.6	Very low	153 Å²	153	135.7 Å²	135.7	82%	0.818	78%	0.78	S	S	*	*				178.2	130.3	116.1	-89	-18.3	0	0	0	115.4
415	V	24.8	Very low	26.6	Very low	122 Å²	122	137.8 Å²	137.8	74%	0.739	78%	0.781	S	S	*	*			trans	26.2	128.8	134.2	-147.5	0	0	0	0	118.2
416	I	26.3	Very low	26.4	Very low	156 Å²	156	138.1 Å²	138.1	80%	0.8	78%	0.784	S	S	*	*				-169.9	137.5	91.2	-90	168.2	0	0	0	114.6
417	S	25.7	Very low	26.4	Very low	105 Å²	105	136.6 Å²	136.6	73%	0.734	78%	0.781	S	S	*	*			trans	45.6	107.7	152.7	-60.2	0	0	0	0	125.2
418	N	24.7	Very low	26.4	Very low	159 Å²	159	135 Å²	135	85%	0.85	78%	0.775	S	S	*	*				10.6	134.1	128.9	-53.1	-3.7	0	0	0	122.1
419	T	27.4	Very low	26.4	Very low	151 Å²	151	134.5 Å²	134.5	93%	0.926	77%	0.77	S	S	*	*				-146.7	167.7	127.2	21.6	0	0	0	0	110.2
420	V	26.5	Very low	26.6	Very low	135 Å²	135	138.1 Å²	138.1	82%	0.818	78%	0.783	S	S	*	*			trans	-99.3	139.4	-164.4	177.3	0	0	0	0	113.1
421	S	26.3	Very low	27.1	Very low	113 Å²	113	137.8 Å²	137.8	79%	0.79	78%	0.776	S	S	*	*			trans	-154.8	167.3	155.7	-89.7	0	0	0	0	111.1
422	E	25.7	Very low	27.4	Very low	197 Å²	197	133.3 Å²	133.3	92%	0.921	77%	0.767	S	S	*	*			trans	-79.3	155.9	-163.8	-61.4	159.2	141.1	0	0	114.6
423	V	26.6	Very low	27.8	Very low	136 Å²	136	132.6 Å²	132.6	82%	0.824	77%	0.774	S	S	*	*			trans	-133.9	139.1	179.1	179.7	0	0	0	0	110.4
424	P	27.2	Very low	28.2	Very low	117 Å²	117	129.9 Å²	129.9	76%	0.76	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-84.7	166	-162.9	-12.3	30.9	0	0	0	116.2	P426	P424-P426 WeakPolarHBondContact O-CD 3.37Å
425	I	25.6	Very low	28.7	Very low	155 Å²	155	123.5 Å²	123.5	80%	0.795	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-71.8	124.9	173.6	-58.3	169.8	0	0	0	110.3
426	P	28.8	Very low	29.3	Very low	115 Å²	115	120.8 Å²	120.8	75%	0.747	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-76.5	136.4	172.3	-15.6	31.5	0	0	0	112.5	P424 A428	P424-P426 WeakPolarHBondContact O-CD 3.37Å; P426-A428 PolarHBondContact O-N 2.67Å
427	N	26.9	Very low	29.8	Very low	149 Å²	149	115 Å²	115	80%	0.797	68%	0.678	S	S	*	*			trans	-70	115.6	-178.8	-71	-33.4	0	0	0	112.7	F429	N427-F429 VanDerWaalsContact C-N 3.29Å; N427-F429 PolarHBondContact O-N 3.37Å
428	A	28.9	Very low	30.8	Very low	78 Å²	78	113 Å²	113	65%	0.645	65%	0.654	S	S	*	*			trans	-84.6	57.1	178.8	0	0	0	0	0	113.2	P426	P426-A428 PolarHBondContact O-N 2.67Å
429	F	27.9	Very low	31.7	Very low	170 Å²	170	110.2 Å²	110.2	75%	0.746	64%	0.639	S	S	*	*			trans	-129.4	83.4	-178.8	-72.8	-74.4	0	0	0	112.8	N427	N427-F429 VanDerWaalsContact C-N 3.29Å; N427-F429 PolarHBondContact O-N 3.37Å
430	N	29.7	Very low	32.2	Very low	164 Å²	164	108.9 Å²	108.9	88%	0.877	62%	0.618	S	S	*	*			trans	-165.9	73.5	161.1	-100	-43.9	0	0	0	110.2	S432	N430-S432 PolarHBondContact O-N 2.97Å
431	L	35	Very low	32.8	Very low	94 Å²	94	105.6 Å²	105.6	49%	0.492	60%	0.596	S	S	.	*			trans	-72.7	124.5	168.3	-89.2	74.6	0	0	0	109.3	Q742	L431-Q742 HydrophobicContact CD1-CG 4.17Å
432	S	34	Very low	33.5	Very low	79 Å²	79	104.6 Å²	104.6	55%	0.552	59%	0.589	S	S	*	*			trans	-67.5	144.3	174.3	-172.3	0	0	0	0	111.6	N430 G434	N430-S432 PolarHBondContact O-N 2.97Å; S432-G434 VanDerWaalsContact C-N 3.26Å; S432-G434 PolarHBondContact O-N 3.27Å
433	S	34	Very low	34.3	Very low	133 Å²	133	101.3 Å²	101.3	93%	0.93	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	70.5	-176	177.3	0	0	0	0	112.8
434	G	34.3	Very low	34.5	Very low	46 Å²	46	101.1 Å²	101.1	47%	0.474	58%	0.577	S	S	.	*	T	Hydrogen-bonded Turn	trans	-162.6	9.4	179.8	0	0	0	0	0	115.9	S432 Y436	S432-G434 VanDerWaalsContact C-N 3.26Å; S432-G434 PolarHBondContact O-N 3.27Å; G434-Y436 VanDerWaalsContact O-CD2 3.31Å; G434-Y436 WeakPolarHBondContact O-CD2 3.19Å; G434-Y436 VanDerWaalsContact O-CE2 3.31Å; G434-Y436 WeakPolarHBondContact O-CE2 3.23Å
435	A	36.1	Very low	35.1	Very low	19 Å²	19	102.4 Å²	102.4	16%	0.157	57%	0.57	C	S	.	*			trans	-75.4	124.2	-179.5	0	0	0	0	0	112.2	L452 I741	A435-L452 HydrophobicContact CB-CD1 3.97Å; A435-L452 PolarHBondContact O-N 3.43Å; A435-I741 HydrophobicContact CB-CD1 4.3Å; A435-I741 HydrophobicContact CB-CG2 3.91Å
436	Y	38.1	Very low	35.5	Very low	66 Å²	66	96.2 Å²	96.2	26%	0.259	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	121.4	174.8	-65.6	-80.6	0	0	0	110.7	G434 E552 A555	G434-Y436 VanDerWaalsContact O-CD2 3.31Å; G434-Y436 WeakPolarHBondContact O-CD2 3.19Å; G434-Y436 VanDerWaalsContact O-CE2 3.31Å; G434-Y436 WeakPolarHBondContact O-CE2 3.23Å; Y436-E552 HydrophobicContact CE2-CG 4.28Å; Y436-A555 HydrophobicContact CE1-CB 4.05Å; Y436-A555 WeakPolarHBondContact OH-CB 3.47Å
437	F	37.5	Very low	36	Very low	34 Å²	34	92.5 Å²	92.5	15%	0.149	52%	0.521	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	138	170.9	-172.6	-94.3	0	0	0	110.1	L439 A449 S450 L452 D734	F437-L439 HydrophobicContact CD1-CB 4.16Å; F437-L439 HydrophobicContact CE1-CB 3.82Å; F437-L439 HydrophobicContact CE1-CD1 3.82Å; F437-L439 HydrophobicContact CE1-CG 4.44Å; F437-A449 WeakPolarHBondContact O-CA 3.38Å; F437-S450 PolarHBondContact N-O 3.3Å; F437-S450 PolarHBondContact O-N 3.32Å; F437-L452 HydrophobicContact CB-CG 4.37Å; F437-D734 HydrophobicContact CE2-CB 4.26Å; F437-D734 HydrophobicContact CZ-CB 4.37Å; F437-D734 WeakPolarHBondContact CZ-OD1 3.35Å
438	W	46.4	Very low	36.7	Very low	62 Å²	62	93.4 Å²	93.4	24%	0.235	52%	0.517	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	83.7	-179.6	-69.2	107.1	0	0	0	110.2	Y440 P447 A449 L547 L554 A622	W438-Y440 PolarHBondContact O-N 3.46Å; W438-Y440 VanDerWaalsContact O-N 3.09Å; W438-P447 HydrophobicContact CB-CB 4.36Å; W438-P447 HydrophobicContact CE3-CB 3.79Å; W438-P447 HydrophobicContact CE3-CG 3.95Å; W438-P447 HydrophobicContact CZ3-CB 4.47Å; W438-P447 HydrophobicContact CZ3-CG 4.21Å; W438-A449 HydrophobicContact CD2-CB 4.36Å; W438-A449 HydrophobicContact CE3-CB 3.79Å; W438-A449 HydrophobicContact CH2-CB 4.01Å; W438-A449 HydrophobicContact CZ2-CB 4.5Å; W438-A449 HydrophobicContact CZ3-CB 3.62Å; W438-L547 HydrophobicContact CZ2-CD1 4.13Å; W438-L554 HydrophobicContact CH2-CD1 4.3Å; W438-A622 HydrophobicContact CH2-CB 4.28Å
439	L	43.4	Very low	37.5	Very low	101 Å²	101	92.1 Å²	92.1	53%	0.529	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	115.7	179.7	-173.9	70.9	0	0	0	110.4	F437 N441 K448	F437-L439 HydrophobicContact CD1-CB 4.16Å; F437-L439 HydrophobicContact CE1-CB 3.82Å; F437-L439 HydrophobicContact CE1-CD1 3.82Å; F437-L439 HydrophobicContact CE1-CG 4.44Å; L439-N441 PolarHBondContact O-N 3.41Å; L439-K448 PolarHBondContact N-O 3.33Å
440	Y	36.5	Very low	38.2	Very low	124 Å²	124	86.4 Å²	86.4	49%	0.486	49%	0.488	S	S	.	.			trans	-81.5	107.7	-179.4	-176.5	-90.8	0	0	0	110.8	W438 K630	W438-Y440 PolarHBondContact O-N 3.46Å; W438-Y440 VanDerWaalsContact O-N 3.09Å; Y440-K630 HydrophobicContact CE2-CD 4.09Å; Y440-K630 PolarHBondContact OH-NZ 2.89Å
441	N	39.5	Very low	38.7	Very low	66 Å²	66	82.9 Å²	82.9	35%	0.353	47%	0.474	S	S	.	.			trans	-87.8	115.9	169.7	-170.1	-22.8	0	0	0	110	L439 Q443	L439-N441 PolarHBondContact O-N 3.41Å; N441-Q443 PolarHBondContact O-N 3.4Å; N441-Q443 WeakPolarHBondContact OD1-CA 3.33Å; N441-Q443 VanDerWaalsContact OD1-CB 3.29Å; N441-Q443 WeakPolarHBondContact OD1-CB 3.43Å; N441-Q443 PolarHBondContact OD1-N 2.81Å
442	S	42.5	Very low	38.9	Very low	92 Å²	92	82.2 Å²	82.2	64%	0.643	47%	0.471	S	S	*	.	S	Bend	trans	-59.5	-27.9	175.6	53.5	0	0	0	0	113.4	C444	S442-C444 VanDerWaalsContact C-N 3.26Å; S442-C444 PolarHBondContact O-N 2.85Å
443	Q	41.2	Very low	39	Very low	128 Å²	128	85.4 Å²	85.4	60%	0.598	48%	0.48	S	S	*	.	S	Bend	trans	-82.7	55.4	-179.7	-53.7	178.3	-3.9	0	0	112.8	N441 K445	N441-Q443 PolarHBondContact O-N 3.4Å; N441-Q443 WeakPolarHBondContact OD1-CA 3.33Å; N441-Q443 VanDerWaalsContact OD1-CB 3.29Å; N441-Q443 WeakPolarHBondContact OD1-CB 3.43Å; N441-Q443 PolarHBondContact OD1-N 2.81Å; Q443-K445 WeakPolarHBondContact O-CG 3.28Å; Q443-K445 PolarHBondContact O-N 3.23Å
444	C	30.9	Very low	38.7	Very low	131 Å²	131	83.5 Å²	83.5	89%	0.885	47%	0.467	S	S	*	.	S	Bend	trans	55.8	-2.2	163.8	-56.1	0	0	0	0	119.6	S442 G446	S442-C444 VanDerWaalsContact C-N 3.26Å; S442-C444 PolarHBondContact O-N 2.85Å; C444-G446 VanDerWaalsContact C-N 3.31Å; C444-G446 PolarHBondContact O-N 3.44Å
445	K	39.3	Very low	38.5	Very low	145 Å²	145	89.2 Å²	89.2	63%	0.63	49%	0.485	S	S	*	.	S	Bend	trans	-83.3	3.3	-170.6	-77.6	171.8	-179.4	172.6	0	115.5	Q443	Q443-K445 WeakPolarHBondContact O-CG 3.28Å; Q443-K445 PolarHBondContact O-N 3.23Å
446	G	35.6	Very low	38.1	Very low	25 Å²	25	93 Å²	93	26%	0.258	51%	0.507	S	S	.	.			trans	75.5	164.9	-179	0	0	0	0	0	113.6	C444	C444-G446 VanDerWaalsContact C-N 3.31Å; C444-G446 PolarHBondContact O-N 3.44Å
447	P	37.6	Very low	37.6	Very low	37 Å²	37	96.9 Å²	96.9	24%	0.24	53%	0.532	C	S	.	.			trans	-78	128.9	-175	33.4	-36	0	0	0	110.6	W438 F623	W438-P447 HydrophobicContact CB-CB 4.36Å; W438-P447 HydrophobicContact CE3-CB 3.79Å; W438-P447 HydrophobicContact CE3-CG 3.95Å; W438-P447 HydrophobicContact CZ3-CB 4.47Å; W438-P447 HydrophobicContact CZ3-CG 4.21Å; P447-F623 HydrophobicContact CG-CD2 4.22Å
448	K	42.9	Very low	37.1	Very low	167 Å²	167	101.6 Å²	101.6	73%	0.726	56%	0.564	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-84.3	120.3	168.2	-72.5	-176.7	177.8	-178.2	0	108.1	L439 S450	L439-K448 PolarHBondContact N-O 3.33Å; K448-S450 PolarHBondContact O-N 3.12Å
449	A	44.7	Very low	36.2	Very low	52 Å²	52	107.2 Å²	107.2	43%	0.43	60%	0.595	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-73.2	113.4	164.7	0	0	0	0	0	108.7	F437 W438	F437-A449 WeakPolarHBondContact O-CA 3.38Å; W438-A449 HydrophobicContact CD2-CB 4.36Å; W438-A449 HydrophobicContact CE3-CB 3.79Å; W438-A449 HydrophobicContact CH2-CB 4.01Å; W438-A449 HydrophobicContact CZ2-CB 4.5Å; W438-A449 HydrophobicContact CZ3-CB 3.62Å
450	S	43	Very low	35.5	Very low	50 Å²	50	110 Å²	110	35%	0.35	61%	0.609	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.1	127.7	167.2	46.5	0	0	0	0	108.6	F437 K448	F437-S450 PolarHBondContact N-O 3.3Å; F437-S450 PolarHBondContact O-N 3.32Å; K448-S450 PolarHBondContact O-N 3.12Å
451	P	39.4	Very low	35.1	Very low	89 Å²	89	112 Å²	112	58%	0.578	63%	0.627	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-64.5	139.4	165.8	29.9	-32.9	0	0	0	108.4	I453	P451-I453 PolarHBondContact O-N 2.93Å
452	L	39.5	Very low	34.5	Very low	81 Å²	81	116 Å²	116	42%	0.424	65%	0.648	S	S	.	*			trans	-66.7	107.4	169.1	-82.3	163.1	0	0	0	108.6	A435 F437	A435-L452 HydrophobicContact CB-CD1 3.97Å; A435-L452 PolarHBondContact O-N 3.43Å; F437-L452 HydrophobicContact CB-CG 4.37Å
453	I	37.5	Very low	34	Very low	145 Å²	145	118.6 Å²	118.6	74%	0.744	66%	0.655	S	S	*	*			trans	-62.2	138.1	166.7	-63.3	175.4	0	0	0	107	P451 L455	P451-I453 PolarHBondContact O-N 2.93Å; I453-L455 PolarHBondContact O-N 2.92Å
454	S	26.6	Very low	33.5	Very low	93 Å²	93	118.4 Å²	118.4	65%	0.65	67%	0.668	S	S	*	*			trans	-53	111.1	-178.8	-172.1	0	0	0	0	110.7	T456	S454-T456 PolarHBondContact O-N 3.48Å
455	L	30.1	Very low	33.4	Very low	166 Å²	166	115.3 Å²	115.3	87%	0.869	66%	0.658	S	S	*	*			trans	-81.7	57.6	-178.1	-146.4	77.8	0	0	0	110.5	I453 N457	I453-L455 PolarHBondContact O-N 2.92Å; L455-N457 PolarHBondContact O-N 3.41Å
456	T	28.5	Very low	33	Very low	100 Å²	100	117 Å²	117	61%	0.613	67%	0.669	S	S	*	*			trans	-69.7	97.1	173.1	40.2	0	0	0	0	109.9	S454 T458	S454-T456 PolarHBondContact O-N 3.48Å; T456-T458 PolarHBondContact O-N 2.84Å; T456-T458 PolarHBondContact O-OG1 3.21Å
457	N	27.5	Very low	32.8	Very low	146 Å²	146	122.6 Å²	122.6	78%	0.781	69%	0.692	S	S	*	*			trans	-3	80.9	169.4	-64.1	-3.2	0	0	0	115.6	L455	L455-N457 PolarHBondContact O-N 3.41Å
458	T	27.1	Very low	32.4	Very low	134 Å²	134	126.5 Å²	126.5	82%	0.822	71%	0.711	S	S	*	*			trans	-108.9	13.5	175.5	11.1	0	0	0	0	112.3	T456	T456-T458 PolarHBondContact O-N 2.84Å; T456-T458 PolarHBondContact O-OG1 3.21Å
459	M	26.2	Very low	31.8	Very low	180 Å²	180	126 Å²	126	89%	0.887	71%	0.712	S	S	*	*	S	Bend	trans	-148.5	70.6	174.7	-64.8	-175.3	-178	0	0	111.3
460	I	28.9	Very low	30.9	Very low	160 Å²	160	127.9 Å²	127.9	82%	0.821	72%	0.722	S	S	*	*	S	Bend	trans	-172.3	100	140.4	-61.8	-157	0	0	0	106.1
461	L	29	Very low	30	Very low	165 Å²	165	130.5 Å²	130.5	86%	0.864	74%	0.74	S	S	*	*			trans	175.2	65.2	148.3	-100.8	160.8	0	0	0	110.9
462	N	26.5	Very low	29.5	Very low	150 Å²	150	133.3 Å²	133.3	80%	0.802	75%	0.749	S	S	*	*			trans	-84.8	120.7	159.2	-73.2	-3.7	0	0	0	108
463	N	31.4	Very low	28.8	Very low	146 Å²	146	134.7 Å²	134.7	78%	0.781	76%	0.761	S	S	*	*			trans	154	135.2	134.6	-76.3	-11.9	0	0	0	112.1
464	S	30.9	Very low	28.4	Very low	124 Å²	124	135.1 Å²	135.1	87%	0.867	76%	0.76	S	S	*	*			trans	36.9	127.6	151.1	58.7	0	0	0	0	120.2
465	G	30	Very low	28.6	Very low	67 Å²	67	137.1 Å²	137.1	69%	0.691	76%	0.764	S	S	*	*			cis	153	172.8	4.4	0	0	0	0	0	110.6
466	E	30.7	Very low	28.3	Very low	181 Å²	181	135.1 Å²	135.1	85%	0.846	76%	0.762	S	S	*	*			trans	47.7	126.4	152.3	-66.4	157	-155.4	0	0	118.7
467	D	29.9	Very low	28.4	Very low	141 Å²	141	136 Å²	136	75%	0.754	77%	0.769	S	S	*	*			cis	-151.2	-170.6	0.2	-81.4	-40.3	0	0	0	106.5
468	D	31	Very low	28.4	Very low	119 Å²	119	133.6 Å²	133.6	64%	0.636	76%	0.764	S	S	*	*			cis	-163.1	167	19.7	-154.7	-8.5	0	0	0	112
469	Q	28.6	Very low	28.6	Very low	157 Å²	157	134.3 Å²	134.3	73%	0.734	76%	0.763	S	S	*	*			trans	20.3	139.8	149.4	-83.1	166.9	89.6	0	0	121.3
470	S	25.9	Very low	28.8	Very low	92 Å²	92	131 Å²	131	64%	0.643	75%	0.752	S	S	*	*			cis	-175	171.5	16.2	48.1	0	0	0	0	112.8
471	S	25.5	Very low	29	Very low	104 Å²	104	133.9 Å²	133.9	73%	0.727	75%	0.754	S	S	*	*			trans	71	141.4	155.9	73.6	0	0	0	0	118.5
472	L	27.4	Very low	29	Very low	149 Å²	149	133.6 Å²	133.6	78%	0.78	75%	0.749	S	S	*	*			cis	-161.1	153.7	-8.9	-113.4	169.3	0	0	0	108.7
473	T	25.9	Very low	29.3	Very low	110 Å²	110	133.6 Å²	133.6	68%	0.675	75%	0.749	S	S	*	*			trans	61.5	141.4	157.3	56.1	0	0	0	0	119.2
474	E	29.6	Very low	29.3	Very low	153 Å²	153	132.3 Å²	132.3	72%	0.715	74%	0.742	S	S	*	*			cis	-159.8	154.5	2.3	-123.2	172.2	-150.7	0	0	113.8
475	N	29.3	Very low	29.3	Very low	136 Å²	136	134.8 Å²	134.8	73%	0.727	74%	0.737	S	S	*	*			trans	60.9	96.3	149.2	-58.1	-30.1	0	0	0	121.6
476	C	24.2	Very low	29.4	Very low	123 Å²	123	137.2 Å²	137.2	83%	0.831	74%	0.738	S	S	*	*			trans	-74.6	163.7	140.4	-73.9	0	0	0	0	110.8
477	P	30.9	Very low	29.3	Very low	118 Å²	118	133.2 Å²	133.2	77%	0.766	73%	0.731	S	S	*	*				-142.9	165.9	112.4	38.7	-27	0	0	0	112.4
478	S	28.3	Very low	29.2	Very low	97 Å²	97	131.8 Å²	131.8	68%	0.678	73%	0.731	S	S	*	*			cis	168.1	149.7	-17	-83.8	0	0	0	0	105.1
479	N	30.7	Very low	28.9	Very low	149 Å²	149	131.6 Å²	131.6	80%	0.797	74%	0.739	S	S	*	*			trans	135.2	98.9	150.9	-66.4	-12.1	0	0	0	111.3
480	V	30.9	Very low	29	Very low	109 Å²	109	128.7 Å²	128.7	66%	0.661	74%	0.743	S	S	*	*				85.7	102.2	72.6	167.3	0	0	0	0	111.3
481	Y	32.4	Very low	29.2	Very low	221 Å²	221	129.6 Å²	129.6	87%	0.867	75%	0.749	S	S	*	*				-157	144.9	100.6	-102.6	-73.1	0	0	0	110.7
482	Q	29.8	Very low	29.2	Very low	160 Å²	160	130.4 Å²	130.4	75%	0.748	76%	0.755	S	S	*	*			trans	-96.3	162.9	170.9	-69.4	169.2	-110.3	0	0	109.7
483	D	31.8	Very low	29.3	Very low	150 Å²	150	135.1 Å²	135.1	80%	0.802	76%	0.762	S	S	*	*				157.9	150.7	124.6	-77.7	-3.3	0	0	0	111.2
484	D	31.2	Very low	29.4	Very low	118 Å²	118	134.5 Å²	134.5	63%	0.631	77%	0.768	S	S	*	*			cis	-159.6	173.5	-49	-144.9	-14.3	0	0	0	110.3
485	F	30.5	Very low	29.4	Very low	176 Å²	176	134.9 Å²	134.9	77%	0.772	77%	0.773	S	S	*	*			trans	78.8	137.4	150.3	-95	-133.1	0	0	0	124.2
486	V	33	Very low	29.4	Very low	118 Å²	118	135.5 Å²	135.5	72%	0.715	78%	0.776	S	S	*	*			trans	83.9	76.7	149.5	-177.1	0	0	0	0	120
487	S	29.7	Very low	29.6	Very low	98 Å²	98	135 Å²	135	69%	0.685	77%	0.772	S	S	*	*				51.4	112.1	106	-53.2	0	0	0	0	122.5
488	S	26.3	Very low	29.5	Very low	110 Å²	110	137.5 Å²	137.5	77%	0.769	78%	0.777	S	S	*	*				71.8	122.6	114.2	-53.4	0	0	0	0	122.6
489	S	25.4	Very low	29.4	Very low	115 Å²	115	138.3 Å²	138.3	80%	0.804	77%	0.773	S	S	*	*				117.1	156.9	119.1	78.1	0	0	0	0	119.1
490	A	29.7	Very low	29.2	Very low	97 Å²	97	140.2 Å²	140.2	80%	0.802	78%	0.776	S	S	*	*			trans	69.2	151.1	159.4	0	0	0	0	0	118.4
491	S	30.8	Very low	28.9	Very low	110 Å²	110	144.2 Å²	144.2	77%	0.769	78%	0.781	S	S	*	*			cis	-163.3	137.2	-25.6	-179.3	0	0	0	0	109.3	R493	S491-R493 PolarHBondContact O-N 3.4Å
492	S	25.7	Very low	28.7	Very low	122 Å²	122	139 Å²	139	85%	0.853	77%	0.774	S	S	*	*			trans	-75.8	111.7	-178.7	-50.4	0	0	0	0	112.4
493	R	30.4	Very low	28.6	Very low	247 Å²	247	139.4 Å²	139.4	93%	0.932	78%	0.78	S	S	*	*			trans	-141.4	136.6	160.3	-92.4	178.9	-176.2	-173.6	-0.5	110.9	S491	S491-R493 PolarHBondContact O-N 3.4Å
494	A	26.4	Very low	28.3	Very low	97 Å²	97	136.8 Å²	136.8	80%	0.802	77%	0.773	S	S	*	*			trans	-100.8	148.5	-169	0	0	0	0	0	113.1
495	I	30.5	Very low	28.3	Very low	162 Å²	162	136.6 Å²	136.6	83%	0.831	78%	0.779	S	S	*	*			trans	-137.1	104	158.8	-57.9	-177.2	0	0	0	108.7
496	N	28.5	Very low	28.3	Very low	148 Å²	148	136.6 Å²	136.6	79%	0.791	79%	0.786	S	S	*	*			trans	32.2	143.7	155.2	-61.7	-9.5	0	0	0	123.3
497	P	28.5	Very low	28.2	Very low	114 Å²	114	135.1 Å²	135.1	74%	0.74	78%	0.78	S	S	*	*			trans	-85.4	158.7	179.2	36.7	-36.6	0	0	0	113.7
498	I	29.4	Very low	28.2	Very low	169 Å²	169	137.6 Å²	137.6	87%	0.867	79%	0.785	S	S	*	*			trans	-113.3	136.2	161.7	-65.6	179.1	0	0	0	108.5
499	I	25.7	Very low	28.4	Very low	115 Å²	115	137.8 Å²	137.8	59%	0.59	78%	0.784	S	S	*	*			trans	-95.4	136.3	-168.5	-65.6	165.9	0	0	0	110.8	Y501	I499-Y501 HydrophobicContact CG2-CD2 3.32Å; I499-Y501 HydrophobicContact CG2-CE2 3.49Å; I499-Y501 VanDerWaalsContact CG2-CE2 3.49Å; I499-Y501 HydrophobicContact CG2-CG 4.32Å
500	H	26.3	Very low	28.8	Very low	189 Å²	189	135.7 Å²	135.7	88%	0.875	78%	0.78	S	S	*	*			trans	-142.2	98.8	159.3	-108.8	-93	0	0	0	110.5
501	Y	24.8	Very low	28.7	Very low	193 Å²	193	140 Å²	140	76%	0.757	78%	0.777	S	S	*	*			trans	-96.8	-176.8	163.6	-58.4	-77.8	0	0	0	109.4	I499	I499-Y501 HydrophobicContact CG2-CD2 3.32Å; I499-Y501 HydrophobicContact CG2-CE2 3.49Å; I499-Y501 VanDerWaalsContact CG2-CE2 3.49Å; I499-Y501 HydrophobicContact CG2-CG 4.32Å
502	P	27.5	Very low	28.9	Very low	112 Å²	112	138.3 Å²	138.3	73%	0.727	76%	0.763	S	S	*	*				-116.2	161.4	-80.8	36	-22.9	0	0	0	111.5	S504	P502-S504 PolarHBondContact O-N 2.88Å
503	I	27.7	Very low	29.2	Very low	167 Å²	167	141.7 Å²	141.7	86%	0.856	76%	0.763	S	S	*	*			trans	-74.8	101.1	173.5	-58.4	-179.5	0	0	0	109.1
504	S	26.5	Very low	29.4	Very low	95 Å²	95	135 Å²	135	66%	0.664	75%	0.75	S	S	*	*			trans	-78.6	150.2	177.4	-151.6	0	0	0	0	111.2	P502 L506	P502-S504 PolarHBondContact O-N 2.88Å; S504-L506 PolarHBondContact O-N 3.43Å
505	P	30.2	Very low	29.8	Very low	115 Å²	115	134 Å²	134	75%	0.747	73%	0.733	S	S	*	*	S	Bend	trans	-90.3	100	-159.3	33.7	-34.4	0	0	0	113.8
506	L	31.3	Very low	29.9	Very low	176 Å²	176	135.5 Å²	135.5	92%	0.921	73%	0.734	S	S	*	*			trans	-153.6	23.6	162.5	-142.5	79.3	0	0	0	115.4	S504	S504-L506 PolarHBondContact O-N 3.43Å
507	S	31.1	Very low	30.3	Very low	86 Å²	86	133.9 Å²	133.9	60%	0.601	72%	0.722	S	S	*	*			trans	-146	96.9	-173.8	60.3	0	0	0	0	114.1
508	L	29.8	Very low	30.7	Very low	150 Å²	150	132.3 Å²	132.3	79%	0.785	71%	0.707	S	S	*	*			trans	-131.3	67.6	151.5	-120.7	164.8	0	0	0	109.2
509	P	29.9	Very low	31.3	Very low	114 Å²	114	129.7 Å²	129.7	74%	0.74	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	147.7	173.7	-5	23.9	0	0	0	109.7	Y511	P509-Y511 PolarHBondContact O-N 3.4Å
510	G	33.3	Very low	32	Very low	71 Å²	71	129.4 Å²	129.4	73%	0.732	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	80.7	8.1	163.7	0	0	0	0	0	117.7	P512	G510-P512 WeakPolarHBondContact O-CD 3.44Å
511	Y	29	Very low	32.8	Very low	188 Å²	188	126.2 Å²	126.2	74%	0.737	69%	0.69	S	S	*	*			trans	-93.1	106.7	161.5	-129.9	-82.5	0	0	0	109.3	P509 F513	P509-Y511 PolarHBondContact O-N 3.4Å; Y511-F513 PolarHBondContact O-N 3.03Å
512	P	34.4	Very low	33.7	Very low	74 Å²	74	126.5 Å²	126.5	48%	0.481	69%	0.69	S	S	.	*			trans	-64.4	128.9	177	26.4	-33	0	0	0	109.1	G510 V514	G510-P512 WeakPolarHBondContact O-CD 3.44Å; P512-V514 PolarHBondContact O-N 2.95Å
513	F	33.2	Very low	34.1	Very low	193 Å²	193	130.8 Å²	130.8	85%	0.846	69%	0.691	S	S	*	*			trans	-57.9	116.2	169.6	-87.2	-94.7	0	0	0	108.3	Y511 V515	Y511-F513 PolarHBondContact O-N 3.03Å; F513-V515 HydrophobicContact CB-CG2 3.98Å; F513-V515 PolarHBondContact O-N 3.45Å
514	V	32.7	Very low	34.5	Very low	107 Å²	107	132.5 Å²	132.5	65%	0.648	69%	0.689	S	S	*	*			trans	-76.1	74.6	170.4	-174.9	0	0	0	0	107.4	P512 F516	P512-V514 PolarHBondContact O-N 2.95Å; V514-F516 HydrophobicContact CG1-CD2 4.44Å; V514-F516 HydrophobicContact CG1-CE1 4.29Å; V514-F516 HydrophobicContact CG1-CE2 3.95Å; V514-F516 HydrophobicContact CG1-CZ 3.87Å; V514-F516 PolarHBondContact O-N 2.99Å
515	V	35.7	Very low	34.9	Very low	75 Å²	75	134.6 Å²	134.6	46%	0.455	69%	0.692	S	S	.	*			trans	-66.3	113.2	171.6	-167.7	0	0	0	0	106.5	F513 E517	F513-V515 HydrophobicContact CB-CG2 3.98Å; F513-V515 PolarHBondContact O-N 3.45Å; V515-E517 HydrophobicContact CG1-CB 4.1Å; V515-E517 HydrophobicContact CG1-CG 3.66Å; V515-E517 PolarHBondContact O-N 2.92Å
516	F	31.9	Very low	35.5	Very low	195 Å²	195	133.5 Å²	133.5	86%	0.855	68%	0.68	S	S	*	*			trans	-75.9	51.1	168.1	-69.7	-79.7	0	0	0	110.4	V514 D518	V514-F516 HydrophobicContact CG1-CD2 4.44Å; V514-F516 HydrophobicContact CG1-CE1 4.29Å; V514-F516 HydrophobicContact CG1-CE2 3.95Å; V514-F516 HydrophobicContact CG1-CZ 3.87Å; V514-F516 PolarHBondContact O-N 2.99Å; F516-D518 PolarHBondContact O-N 2.67Å; F516-D518 VanDerWaalsContact O-N 3.16Å
517	E	38.2	Very low	36.2	Very low	114 Å²	114	130 Å²	130	53%	0.533	67%	0.666	S	S	.	*			trans	-63.7	109.9	157.7	-92.5	167.8	-171	0	0	106.6	V515 P519	V515-E517 HydrophobicContact CG1-CB 4.1Å; V515-E517 HydrophobicContact CG1-CG 3.66Å; V515-E517 PolarHBondContact O-N 2.92Å; E517-P519 WeakPolarHBondContact O-CD 3.46Å; E517-P519 WeakPolarHBondContact O-CG 3.35Å
518	D	37.2	Very low	36.5	Very low	80 Å²	80	134.4 Å²	134.4	43%	0.428	68%	0.676	S	S	.	*			trans	-78.3	99.6	160.2	-177.4	-21.5	0	0	0	107	F516 V520 Q521	F516-D518 PolarHBondContact O-N 2.67Å; F516-D518 VanDerWaalsContact O-N 3.16Å; D518-V520 PolarHBondContact O-N 3.49Å; D518-V520 PolarHBondContact OD1-N 3.32Å; D518-Q521 WeakPolarHBondContact OD1-CB 3.34Å; D518-Q521 PolarHBondContact OD1-N 3.12Å; D518-Q521 WeakPolarHBondContact OD2-CB 3.32Å; D518-Q521 PolarHBondContact OD2-NE2 3.26Å
519	P	40.4	Very low	37	Very low	115 Å²	115	130.9 Å²	130.9	75%	0.747	66%	0.663	S	S	*	*	S	Bend	trans	-83.8	-6.7	-170.5	-5.8	27.4	0	0	0	111.5	E517	E517-P519 WeakPolarHBondContact O-CD 3.46Å; E517-P519 WeakPolarHBondContact O-CG 3.35Å
520	V	40.2	Very low	37.4	Very low	108 Å²	108	130.2 Å²	130.2	66%	0.655	66%	0.661	S	S	*	*	S	Bend	trans	-108	-40.1	-167	179	0	0	0	0	110.7	D518 R522	D518-V520 PolarHBondContact O-N 3.49Å; D518-V520 PolarHBondContact OD1-N 3.32Å; V520-R522 VanDerWaalsContact C-N 3.29Å; V520-R522 PolarHBondContact O-N 3.06Å
521	Q	44.1	Very low	37.7	Very low	122 Å²	122	136 Å²	136	57%	0.57	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-7.8	-166.2	-164.4	139.5	-107	0	0	115.6	D518 L526	D518-Q521 WeakPolarHBondContact OD1-CB 3.34Å; D518-Q521 PolarHBondContact OD1-N 3.12Å; D518-Q521 WeakPolarHBondContact OD2-CB 3.32Å; D518-Q521 PolarHBondContact OD2-NE2 3.26Å; Q521-L526 HydrophobicContact CG-CD1 3.78Å
522	R	43.4	Very low	38.4	Very low	199 Å²	199	133.1 Å²	133.1	75%	0.751	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	-9.6	179.2	-86.8	-160.4	-82.4	177.8	-6.7	116.2	V520	V520-R522 VanDerWaalsContact C-N 3.29Å; V520-R522 PolarHBondContact O-N 3.06Å
523	R	37.1	Very low	39.1	Very low	203 Å²	203	139.4 Å²	139.4	77%	0.766	68%	0.677	S	S	*	*	S	Bend	trans	-146.6	98.6	-179.9	-62.5	-172.6	-167.2	179.1	7	112.6
524	Y	34.2	Very low	40	Very low	203 Å²	203	142.8 Å²	142.8	80%	0.796	68%	0.684	S	S	*	*	S	Bend	trans	73.2	156.1	170.8	-51.3	-82.3	0	0	0	116.9	L526	Y524-L526 PolarHBondContact O-N 3.31Å
525	D	36.9	Very low	40.9	Very low	138 Å²	138	139.7 Å²	139.7	74%	0.738	67%	0.674	S	S	*	*			trans	67.5	24	162.4	-57.2	-10.4	0	0	0	121.9	V527	D525-V527 PolarHBondContact O-N 2.86Å
526	L	42.4	Very low	41.8	Very low	93 Å²	93	139.1 Å²	139.1	49%	0.487	67%	0.669	S	S	.	*	G	3₁₀ helix	trans	-68.1	15.6	160.2	-116.6	166.4	0	0	0	114.7	Q521 Y524 H528 C529	Q521-L526 HydrophobicContact CG-CD1 3.78Å; Y524-L526 PolarHBondContact O-N 3.31Å; L526-H528 PolarHBondContact O-N 3.45Å; L526-C529 HydrophobicContact CD2-CB 3.77Å; L526-C529 VanDerWaalsContact CD2-SG 3.52Å; L526-C529 PolarHBondContact O-N 3.45Å
527	V	44.6	Very low	43	Very low	103 Å²	103	132.6 Å²	132.6	62%	0.624	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-72.1	-8.3	-172.2	-178.4	0	0	0	0	112.9	D525	D525-V527 PolarHBondContact O-N 2.86Å
528	H	39.1	Very low	43.9	Very low	177 Å²	177	131.2 Å²	131.2	82%	0.819	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-104.2	2.3	178.9	-71.4	-2.2	0	0	0	115.1	L526 S530	L526-H528 PolarHBondContact O-N 3.45Å; H528-S530 PolarHBondContact O-N 3.34Å
529	C	38.7	Very low	45.4	Very low	76 Å²	76	130.1 Å²	130.1	51%	0.514	65%	0.646	S	S	.	*			trans	-80	20.1	167.2	-79.3	0	0	0	0	113.6	L526 K531 L532	L526-C529 HydrophobicContact CD2-CB 3.77Å; L526-C529 VanDerWaalsContact CD2-SG 3.52Å; L526-C529 PolarHBondContact O-N 3.45Å; C529-K531 PolarHBondContact O-N 3.02Å; C529-L532 WeakPolarHBondContact O-CD1 3.15Å; C529-L532 PolarHBondContact O-N 2.94Å
530	S	38.5	Very low	47.1	Very low	101 Å²	101	130.5 Å²	130.5	71%	0.706	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	26.4	-172.8	46.6	0	0	0	0	116	H528	H528-S530 PolarHBondContact O-N 3.34Å
531	K	40	Very low	49.2	Very low	191 Å²	191	127.8 Å²	127.8	83%	0.83	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.9	43.2	164.1	-69.9	-177.1	179.7	170.4	0	112.1	C529 R533	C529-K531 PolarHBondContact O-N 3.02Å; K531-R533 PolarHBondContact O-N 3.45Å
532	L	43	Very low	51.1	Low	128 Å²	128	122.6 Å²	122.6	67%	0.67	61%	0.607	S	S	*	*			trans	-50.6	115	158.9	-87.8	98.9	0	0	0	108.5	C529	C529-L532 WeakPolarHBondContact O-CD1 3.15Å; C529-L532 PolarHBondContact O-N 2.94Å
533	R	50	Low	53.1	Low	207 Å²	207	114.8 Å²	114.8	78%	0.781	58%	0.58	S	S	*	*			trans	-77.3	134.4	176.1	-63.3	-178.6	179.9	-168.9	-1.8	107.8	K531 G535 N538	K531-R533 PolarHBondContact O-N 3.45Å; R533-G535 PolarHBondContact O-N 3.2Å; R533-N538 PolarHBondContact O-ND2 2.97Å
534	R	51.6	Low	55.3	Low	263 Å²	263	107.4 Å²	107.4	99%	0.992	56%	0.556	S	S	*	*	S	Bend	trans	-75.7	64.7	178.2	-69.8	-173.8	177.8	-179.9	-0.7	112
535	G	51.3	Low	57.8	Low	43 Å²	43	101.8 Å²	101.8	44%	0.443	54%	0.538	S	S	.	.	S	Bend	trans	179.1	154.3	170.8	0	0	0	0	0	112.9	R533 G537	R533-G535 PolarHBondContact O-N 3.2Å; G535-G537 VanDerWaalsContact C-N 3.25Å; G535-G537 PolarHBondContact O-N 2.91Å
536	D	55.3	Low	60.2	Low	63 Å²	63	98.1 Å²	98.1	34%	0.337	51%	0.514	S	S	.	.	S	Bend	trans	40	-60.1	158.3	-161.9	20.3	0	0	0	118.2	N538 D539 R546 K621	D536-N538 PolarHBondContact O-N 3.4Å; D536-D539 WeakPolarHBondContact O-CB 3.33Å; D536-D539 PolarHBondContact O-N 2.88Å; D536-R546 VanDerWaalsContact CG-NH2 3.28Å; D536-R546 IonicContact OD1-CZ 3.21Å; D536-R546 IonicContact OD1-NH1 3.29Å; D536-R546 PolarHBondContact OD1-NH1 2.87Å; D536-R546 IonicContact OD1-NH2 3.72Å; D536-R546 PolarHBondContact OD1-NH2 3.45Å; D536-R546 IonicContact OD2-NH2 2.61Å; D536-R546 PolarHBondContact OD2-NH2 3.27Å; D536-R546 VanDerWaalsContact OD2-NH2 3.07Å; D536-K621 IonicContact OD2-NZ 2.92Å; D536-K621 PolarHBondContact OD2-NZ 2.82Å
537	G	57.2	Low	62.3	Low	57 Å²	57	94.3 Å²	94.3	59%	0.588	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	4.8	-179	0	0	0	0	0	116.5	G535	G535-G537 VanDerWaalsContact C-N 3.25Å; G535-G537 PolarHBondContact O-N 2.91Å
538	N	56.9	Low	64.2	Low	85 Å²	85	93.3 Å²	93.3	46%	0.455	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104	-11.6	166.9	-49.5	-28.7	0	0	0	112.2	R533 D536 V540	R533-N538 PolarHBondContact O-ND2 2.97Å; D536-N538 PolarHBondContact O-N 3.4Å; N538-V540 PolarHBondContact O-N 3.34Å
539	D	69.4	Low	66.5	Low	57 Å²	57	88 Å²	88	31%	0.305	46%	0.461	S	S	.	.			trans	-78.2	111.5	175.5	166	46.5	0	0	0	109	D536 T541 K628	D536-D539 WeakPolarHBondContact O-CB 3.33Å; D536-D539 PolarHBondContact O-N 2.88Å; D539-T541 VanDerWaalsContact C-N 3.34Å; D539-T541 WeakPolarHBondContact OD1-CB 3.36Å; D539-T541 PolarHBondContact OD1-N 3.26Å; D539-T541 PolarHBondContact OD1-OG1 2.91Å; D539-K628 WeakPolarHBondContact O-CE 3.48Å; D539-K628 PolarHBondContact O-NZ 2.84Å; D539-K628 IonicContact OD2-NZ 3.13Å; D539-K628 PolarHBondContact OD2-NZ 3.1Å
540	V	76.4	Confident	68.8	Low	123 Å²	123	85 Å²	85	75%	0.745	44%	0.44	S	S	*	.			trans	-87.9	-2.8	175.5	-64.3	0	0	0	0	112.9	N538 P542	N538-V540 PolarHBondContact O-N 3.34Å; V540-P542 WeakPolarHBondContact O-CD 3.19Å
541	T	83.4	Confident	71.2	Confident	51 Å²	51	80.4 Å²	80.4	31%	0.313	41%	0.409	S	S	.	.			trans	-69.1	122.9	-176.2	-41.6	0	0	0	0	111	D539 K628	D539-T541 VanDerWaalsContact C-N 3.34Å; D539-T541 WeakPolarHBondContact OD1-CB 3.36Å; D539-T541 PolarHBondContact OD1-N 3.26Å; D539-T541 PolarHBondContact OD1-OG1 2.91Å; T541-K628 WeakPolarHBondContact O-CD 3.45Å; T541-K628 PolarHBondContact O-NZ 3.37Å
542	P	84	Confident	73.6	Confident	13 Å²	13	75.8 Å²	75.8	8%	0.084	39%	0.39	C	S	.	.			trans	-78	123.5	178	28.2	-31.4	0	0	0	112	V540 K628 I629 L632 L779 S782	V540-P542 WeakPolarHBondContact O-CD 3.19Å; P542-K628 HydrophobicContact CB-CB 3.87Å; P542-I629 HydrophobicContact CB-CB 4.34Å; P542-I629 HydrophobicContact CB-CG1 3.61Å; P542-L632 HydrophobicContact CG-CB 4Å; P542-L632 HydrophobicContact CG-CD2 3.51Å; P542-L632 HydrophobicContact CG-CG 4.33Å; P542-L779 HydrophobicContact CB-CD2 4.14Å; P542-L779 HydrophobicContact CG-CD2 4.1Å; P542-S782 PolarHBondContact O-OG 3.27Å
543	N	84.2	Confident	75.8	Confident	35 Å²	35	73 Å²	73	19%	0.187	37%	0.374	C	S	.	.			trans	-120	107.6	178.4	-174.9	-36.8	0	0	0	111.4	M545 R546 L547 E625 N783	N543-M545 PolarHBondContact OD1-N 2.74Å; N543-M545 VanDerWaalsContact OD1-N 3.08Å; N543-R546 HydrophobicContact CB-CB 3.82Å; N543-R546 PolarHBondContact O-N 3.38Å; N543-R546 WeakPolarHBondContact OD1-CB 3.28Å; N543-R546 PolarHBondContact OD1-N 2.99Å; N543-L547 PolarHBondContact O-N 2.96Å; N543-L547 VanDerWaalsContact O-N 3.13Å; N543-E625 PolarHBondContact N-OE1 2.9Å; N543-N783 PolarHBondContact OD1-OD1 2.83Å
544	L	84.7	Confident	77.8	Confident	48 Å²	48	63.7 Å²	63.7	25%	0.251	34%	0.339	S	S	.	.	H	α-helix	trans	-69	-35.8	-178.1	-175.4	65.5	0	0	0	112.8	R546 L547 R548 I629 V740	L544-R546 VanDerWaalsContact C-N 3.35Å; L544-L547 PolarHBondContact O-N 3.06Å; L544-R548 PolarHBondContact O-N 3.41Å; L544-I629 HydrophobicContact CD1-CD1 4.14Å; L544-V740 HydrophobicContact CD2-CG1 3.91Å
545	M	86	Confident	79.7	Confident	86 Å²	86	52 Å²	52	42%	0.424	30%	0.299	S	S	.	.	H	α-helix	trans	-67.6	-39.3	178.9	-63.7	-60.6	98.6	0	0	111	N543 R548 S549	N543-M545 PolarHBondContact OD1-N 2.74Å; N543-M545 VanDerWaalsContact OD1-N 3.08Å; M545-R548 PolarHBondContact O-N 3.47Å; M545-S549 WeakPolarHBondContact O-CB 3.31Å; M545-S549 PolarHBondContact O-N 2.89Å
546	R	87	Confident	81.6	Confident	61 Å²	61	55.3 Å²	55.3	23%	0.23	30%	0.303	C	S	.	.	H	α-helix	trans	-62.9	-41.5	172.7	-175.8	-175.1	160.4	163	-2.3	111.6	D536 N543 L544 M550 E625	D536-R546 VanDerWaalsContact CG-NH2 3.28Å; D536-R546 IonicContact OD1-CZ 3.21Å; D536-R546 IonicContact OD1-NH1 3.29Å; D536-R546 PolarHBondContact OD1-NH1 2.87Å; D536-R546 IonicContact OD1-NH2 3.72Å; D536-R546 PolarHBondContact OD1-NH2 3.45Å; D536-R546 IonicContact OD2-NH2 2.61Å; D536-R546 PolarHBondContact OD2-NH2 3.27Å; D536-R546 VanDerWaalsContact OD2-NH2 3.07Å; N543-R546 HydrophobicContact CB-CB 3.82Å; N543-R546 PolarHBondContact O-N 3.38Å; N543-R546 WeakPolarHBondContact OD1-CB 3.28Å; N543-R546 PolarHBondContact OD1-N 2.99Å; L544-R546 VanDerWaalsContact C-N 3.35Å; R546-M550 HydrophobicContact CG-CE 4.2Å; R546-M550 WeakPolarHBondContact O-CG 3.42Å; R546-M550 PolarHBondContact O-N 3.32Å; R546-M550 VanDerWaalsContact O-N 3.07Å; R546-E625 WeakPolarHBondContact CD-OE2 3.24Å; R546-E625 IonicContact CZ-OE2 2.84Å; R546-E625 VanDerWaalsContact CZ-OE2 3.29Å; R546-E625 IonicContact NE-OE2 2.65Å; R546-E625 PolarHBondContact NE-OE2 3.02Å; R546-E625 VanDerWaalsContact NE-OE2 3.13Å; R546-E625 IonicContact NH1-OE2 3.07Å; R546-E625 IonicContact NH2-OE2 2.67Å
547	L	87.2	Confident	83.5	Confident	12 Å²	12	52.5 Å²	52.5	6%	0.063	29%	0.288	C	S	.	.	H	α-helix	trans	-64.5	-42.2	173.5	-178.5	59.7	0	0	0	112.2	W438 N543 L544 M550 G551 A622 E625 A626 I629	W438-L547 HydrophobicContact CZ2-CD1 4.13Å; N543-L547 PolarHBondContact O-N 2.96Å; N543-L547 VanDerWaalsContact O-N 3.13Å; L544-L547 PolarHBondContact O-N 3.06Å; L547-M550 HydrophobicContact CD1-CE 4.39Å; L547-M550 PolarHBondContact O-N 2.98Å; L547-G551 PolarHBondContact O-N 2.86Å; L547-G551 VanDerWaalsContact O-N 3.11Å; L547-A622 HydrophobicContact CD1-CB 4.08Å; L547-E625 HydrophobicContact CB-CG 4.17Å; L547-A626 HydrophobicContact CD1-CB 4.35Å; L547-A626 HydrophobicContact CD2-CB 4.04Å; L547-I629 HydrophobicContact CB-CD1 4.35Å; L547-I629 HydrophobicContact CD2-CD1 3.69Å
548	R	84.6	Confident	85.1	Confident	82 Å²	82	53 Å²	53	31%	0.309	28%	0.277	S	S	.	.	H	α-helix	trans	-57.9	-52.6	174	179.8	-175.9	-76.9	-159.2	-1.2	111.1	L544 M545 M550 G551 E552 Y744	L544-R548 PolarHBondContact O-N 3.41Å; M545-R548 PolarHBondContact O-N 3.47Å; R548-M550 VanDerWaalsContact C-N 3.33Å; R548-M550 PolarHBondContact O-N 3.32Å; R548-G551 WeakPolarHBondContact O-CA 3.5Å; R548-G551 PolarHBondContact O-N 2.92Å; R548-E552 WeakPolarHBondContact CD-OE1 3.44Å; R548-E552 VanDerWaalsContact CG-OE1 3.31Å; R548-E552 WeakPolarHBondContact CG-OE1 3.37Å; R548-E552 PolarHBondContact O-N 2.62Å; R548-Y744 PolarHBondContact NH1-O 2.92Å
549	S	86.6	Confident	86.9	Confident	65 Å²	65	56.4 Å²	56.4	46%	0.455	29%	0.288	S	S	.	.	H	α-helix	trans	-58.5	-40	-179.8	179.8	0	0	0	0	112.8	M545 G551 E552 E553	M545-S549 WeakPolarHBondContact O-CB 3.31Å; M545-S549 PolarHBondContact O-N 2.89Å; S549-G551 VanDerWaalsContact C-N 3.32Å; S549-G551 PolarHBondContact O-N 3.24Å; S549-E552 PolarHBondContact O-N 3.36Å; S549-E553 PolarHBondContact O-N 3.45Å
550	M	88.5	Confident	88	Confident	13 Å²	13	56.3 Å²	56.3	6%	0.064	29%	0.287	C	S	.	.	H	α-helix	trans	-67.4	-29.9	173.5	-68.5	-173.3	-66.1	0	0	113	R546 L547 R548 L554 L618 K621 A622 E625	R546-M550 HydrophobicContact CG-CE 4.2Å; R546-M550 WeakPolarHBondContact O-CG 3.42Å; R546-M550 PolarHBondContact O-N 3.32Å; R546-M550 VanDerWaalsContact O-N 3.07Å; L547-M550 HydrophobicContact CD1-CE 4.39Å; L547-M550 PolarHBondContact O-N 2.98Å; R548-M550 VanDerWaalsContact C-N 3.33Å; R548-M550 PolarHBondContact O-N 3.32Å; M550-L554 VanDerWaalsContact O-CB 3.31Å; M550-L554 WeakPolarHBondContact O-CB 3.35Å; M550-L554 WeakPolarHBondContact O-CG 3.49Å; M550-L554 PolarHBondContact O-N 3.47Å; M550-L618 HydrophobicContact CB-CD1 4Å; M550-L618 HydrophobicContact CG-CD1 3.76Å; M550-L618 HydrophobicContact SD-CD1 4.13Å; M550-K621 HydrophobicContact SD-CB 3.52Å; M550-K621 VanDerWaalsContact SD-CB 3.52Å; M550-K621 HydrophobicContact SD-CD 4.44Å; M550-A622 HydrophobicContact CB-CB 4.32Å; M550-A622 HydrophobicContact CE-CB 4.3Å; M550-E625 HydrophobicContact CE-CB 3.62Å; M550-E625 HydrophobicContact CE-CG 3.94Å
551	G	87.7	Confident	88.8	Confident	5 Å²	5	52.1 Å²	52.1	5%	0.052	26%	0.26	C	S	.	.	H	α-helix	trans	-67.4	-44.5	171.7	0	0	0	0	0	112.6	L547 R548 S549 L554 A555	L547-G551 PolarHBondContact O-N 2.86Å; L547-G551 VanDerWaalsContact O-N 3.11Å; R548-G551 WeakPolarHBondContact O-CA 3.5Å; R548-G551 PolarHBondContact O-N 2.92Å; S549-G551 VanDerWaalsContact C-N 3.32Å; S549-G551 PolarHBondContact O-N 3.24Å; G551-L554 WeakPolarHBondContact O-CB 3.36Å; G551-L554 PolarHBondContact O-N 2.72Å; G551-A555 PolarHBondContact O-N 3.04Å
552	E	90	Very high	89.2	Confident	95 Å²	95	53.6 Å²	53.6	44%	0.444	27%	0.269	S	S	.	.	H	α-helix	trans	-62.2	-46.1	175.3	-67.6	164.8	-178.6	0	0	111.7	Y436 R548 S549 A555 H556	Y436-E552 HydrophobicContact CE2-CG 4.28Å; R548-E552 WeakPolarHBondContact CD-OE1 3.44Å; R548-E552 VanDerWaalsContact CG-OE1 3.31Å; R548-E552 WeakPolarHBondContact CG-OE1 3.37Å; R548-E552 PolarHBondContact O-N 2.62Å; S549-E552 PolarHBondContact O-N 3.36Å; E552-A555 PolarHBondContact O-N 3.38Å; E552-H556 PolarHBondContact O-N 2.86Å
553	E	91	Very high	89.6	Confident	69 Å²	69	54.9 Å²	54.9	32%	0.322	28%	0.281	S	S	.	.	H	α-helix	trans	-63.7	-41.2	174.8	-176.7	-177.7	-153.7	0	0	111.5	S549 A555 H556 L557 K614 L618	S549-E553 PolarHBondContact O-N 3.45Å; E553-A555 VanDerWaalsContact C-N 3.3Å; E553-A555 PolarHBondContact O-N 2.96Å; E553-H556 PolarHBondContact O-N 3.1Å; E553-L557 HydrophobicContact CG-CD1 4Å; E553-L557 HydrophobicContact CG-CG 4.28Å; E553-L557 WeakPolarHBondContact O-CB 3.45Å; E553-L557 VanDerWaalsContact O-CG 3.27Å; E553-L557 WeakPolarHBondContact O-CG 3.46Å; E553-L557 PolarHBondContact O-N 2.83Å; E553-K614 WeakPolarHBondContact OE1-CE 3.02Å; E553-K614 IonicContact OE1-NZ 2.67Å; E553-K614 PolarHBondContact OE1-NZ 3.06Å; E553-L618 HydrophobicContact CB-CD2 3.84Å; E553-L618 HydrophobicContact CG-CD2 3.58Å; E553-L618 VanDerWaalsContact OE2-CD1 3.31Å; E553-L618 WeakPolarHBondContact OE2-CD1 3.5Å; E553-L618 VanDerWaalsContact OE2-CD2 3.23Å; E553-L618 WeakPolarHBondContact OE2-CD2 3.39Å
554	L	91.9	Very high	89.9	Confident	11 Å²	11	55.3 Å²	55.3	6%	0.058	28%	0.282	C	S	.	.	H	α-helix	trans	-58.1	-41.9	173.8	-81.5	170	0	0	0	111.9	W438 M550 G551 L557 N558 I615 L618 K619 A622	W438-L554 HydrophobicContact CH2-CD1 4.3Å; M550-L554 VanDerWaalsContact O-CB 3.31Å; M550-L554 WeakPolarHBondContact O-CB 3.35Å; M550-L554 WeakPolarHBondContact O-CG 3.49Å; M550-L554 PolarHBondContact O-N 3.47Å; G551-L554 WeakPolarHBondContact O-CB 3.36Å; G551-L554 PolarHBondContact O-N 2.72Å; L554-L557 PolarHBondContact O-N 3.48Å; L554-N558 WeakPolarHBondContact O-CB 3.39Å; L554-N558 PolarHBondContact O-N 2.62Å; L554-N558 PolarHBondContact O-ND2 3.08Å; L554-N558 PolarHBondContact O-OD1 3.28Å; L554-I615 HydrophobicContact CD2-CG2 3.98Å; L554-L618 HydrophobicContact CB-CD2 4.42Å; L554-L618 HydrophobicContact CD2-CB 4.01Å; L554-L618 HydrophobicContact CD2-CD2 3.79Å; L554-L618 HydrophobicContact CD2-CG 3.95Å; L554-L618 HydrophobicContact CG-CB 4.47Å; L554-L618 HydrophobicContact CG-CD2 3.64Å; L554-L618 HydrophobicContact CG-CG 3.85Å; L554-K619 HydrophobicContact CD1-CG 4.07Å; L554-K619 HydrophobicContact CD2-CG 3.66Å; L554-A622 HydrophobicContact CD1-CB 4.34Å
555	A	90.1	Very high	90.1	Very high	18 Å²	18	54 Å²	54	15%	0.149	28%	0.279	C	S	.	.	H	α-helix	trans	-68.4	-39.7	178.2	0	0	0	0	0	112.7	Y436 G551 E552 E553 N558 K559	Y436-A555 HydrophobicContact CE1-CB 4.05Å; Y436-A555 WeakPolarHBondContact OH-CB 3.47Å; G551-A555 PolarHBondContact O-N 3.04Å; E552-A555 PolarHBondContact O-N 3.38Å; E553-A555 VanDerWaalsContact C-N 3.3Å; E553-A555 PolarHBondContact O-N 2.96Å; A555-N558 PolarHBondContact O-N 2.88Å; A555-K559 WeakPolarHBondContact O-CG 3.34Å; A555-K559 PolarHBondContact O-N 3.32Å
556	H	92.5	Very high	90.3	Very high	112 Å²	112	55.9 Å²	55.9	52%	0.519	29%	0.287	S	S	.	.	H	α-helix	trans	-62.6	-44.7	172.8	179.3	72.8	0	0	0	111.6	E552 E553 N558 K559 N560	E552-H556 PolarHBondContact O-N 2.86Å; E553-H556 PolarHBondContact O-N 3.1Å; H556-N558 VanDerWaalsContact C-N 3.34Å; H556-N558 PolarHBondContact O-N 2.86Å; H556-K559 PolarHBondContact O-N 3.08Å; H556-N560 PolarHBondContact CD2-ND2 2.87Å; H556-N560 PolarHBondContact NE2-ND2 2.85Å; H556-N560 VanDerWaalsContact O-CG 3.26Å; H556-N560 PolarHBondContact O-N 3.19Å; H556-N560 PolarHBondContact O-OD1 3.29Å
557	L	93.4	Very high	90.3	Very high	5 Å²	5	57.1 Å²	57.1	3%	0.026	30%	0.298	C	S	.	.	H	α-helix	trans	-65.9	-35.2	176.4	-65.5	173.2	0	0	0	112.8	E553 L554 N560 I561 L611 K614 I615 L618	E553-L557 HydrophobicContact CG-CD1 4Å; E553-L557 HydrophobicContact CG-CG 4.28Å; E553-L557 WeakPolarHBondContact O-CB 3.45Å; E553-L557 VanDerWaalsContact O-CG 3.27Å; E553-L557 WeakPolarHBondContact O-CG 3.46Å; E553-L557 PolarHBondContact O-N 2.83Å; L554-L557 PolarHBondContact O-N 3.48Å; L557-N560 PolarHBondContact O-N 3.34Å; L557-I561 WeakPolarHBondContact O-CG2 3.45Å; L557-I561 PolarHBondContact O-N 3.5Å; L557-L611 HydrophobicContact CD2-CD2 3.71Å; L557-K614 HydrophobicContact CD1-CB 4.29Å; L557-K614 HydrophobicContact CD1-CD 3.76Å; L557-K614 HydrophobicContact CD1-CG 3.79Å; L557-K614 HydrophobicContact CD2-CD 3.84Å; L557-K614 HydrophobicContact CG-CD 4.47Å; L557-I615 HydrophobicContact CB-CD1 3.97Å; L557-I615 HydrophobicContact CB-CG1 3.56Å; L557-I615 HydrophobicContact CD1-CG1 4.1Å; L557-I615 HydrophobicContact CG-CG1 4.46Å; L557-L618 HydrophobicContact CD1-CD2 3.82Å
558	N	92.3	Very high	90.3	Very high	68 Å²	68	58.1 Å²	58.1	36%	0.364	30%	0.303	S	S	.	.	H	α-helix	trans	-64.8	-38.2	173.4	-71.7	-21.6	0	0	0	111.8	L554 A555 H556 I561 T562	L554-N558 WeakPolarHBondContact O-CB 3.39Å; L554-N558 PolarHBondContact O-N 2.62Å; L554-N558 PolarHBondContact O-ND2 3.08Å; L554-N558 PolarHBondContact O-OD1 3.28Å; A555-N558 PolarHBondContact O-N 2.88Å; H556-N558 VanDerWaalsContact C-N 3.34Å; H556-N558 PolarHBondContact O-N 2.86Å; N558-I561 WeakPolarHBondContact O-CG2 3.47Å; N558-T562 PolarHBondContact O-N 3.38Å; N558-T562 PolarHBondContact O-OG1 2.98Å; N558-T562 VanDerWaalsContact O-OG1 3.05Å
559	K	93.3	Very high	90.4	Very high	156 Å²	156	57.1 Å²	57.1	68%	0.678	31%	0.313	S	S	*	.	H	α-helix	trans	-63.2	-46.8	171.7	-70.7	174.9	179.9	-178.8	0	111.2	A555 H556 I561 T562 A563	A555-K559 WeakPolarHBondContact O-CG 3.34Å; A555-K559 PolarHBondContact O-N 3.32Å; H556-K559 PolarHBondContact O-N 3.08Å; K559-I561 PolarHBondContact O-N 3.36Å; K559-T562 PolarHBondContact O-N 2.92Å; K559-A563 PolarHBondContact O-N 3.17Å; K559-A563 VanDerWaalsContact O-N 3.09Å
560	N	93.8	Very high	90.3	Very high	55 Å²	55	57.2 Å²	57.2	29%	0.294	32%	0.317	S	S	.	.	H	α-helix	trans	-65.3	-38.9	-177.8	-63.4	-7.1	0	0	0	112.6	H556 L557 A563 Q564 L611	H556-N560 PolarHBondContact CD2-ND2 2.87Å; H556-N560 PolarHBondContact NE2-ND2 2.85Å; H556-N560 VanDerWaalsContact O-CG 3.26Å; H556-N560 PolarHBondContact O-N 3.19Å; H556-N560 PolarHBondContact O-OD1 3.29Å; L557-N560 PolarHBondContact O-N 3.34Å; N560-A563 PolarHBondContact O-N 3.17Å; N560-Q564 WeakPolarHBondContact O-CG 3.1Å; N560-Q564 PolarHBondContact O-N 2.87Å; N560-Q564 VanDerWaalsContact O-N 3.08Å; N560-L611 HydrophobicContact CB-CD1 3.91Å; N560-L611 HydrophobicContact CB-CD2 4.2Å
561	I	92.4	Very high	89.6	Confident	35 Å²	35	57.5 Å²	57.5	18%	0.179	32%	0.324	C	S	.	.	H	α-helix	trans	-71.2	-31.6	179	-161.5	176.9	0	0	0	112.1	L557 N558 K559 Q564 G565 K608 L611 A612 I615	L557-I561 WeakPolarHBondContact O-CG2 3.45Å; L557-I561 PolarHBondContact O-N 3.5Å; N558-I561 WeakPolarHBondContact O-CG2 3.47Å; K559-I561 PolarHBondContact O-N 3.36Å; I561-Q564 PolarHBondContact O-N 3.15Å; I561-G565 PolarHBondContact O-N 3.38Å; I561-K608 HydrophobicContact CD1-CG 4.21Å; I561-K608 HydrophobicContact CG1-CG 3.84Å; I561-L611 HydrophobicContact CB-CB 4.16Å; I561-L611 HydrophobicContact CB-CD1 4.31Å; I561-L611 HydrophobicContact CD1-CB 4.43Å; I561-L611 HydrophobicContact CG1-CB 4.24Å; I561-A612 HydrophobicContact CD1-CB 3.8Å; I561-I615 HydrophobicContact CB-CD1 4.21Å; I561-I615 HydrophobicContact CD1-CD1 4.14Å; I561-I615 HydrophobicContact CG2-CD1 3.91Å
562	T	93.1	Very high	88.5	Confident	81 Å²	81	60.7 Å²	60.7	50%	0.497	35%	0.349	S	S	.	.	H	α-helix	trans	-64.2	-48.1	171	-60.2	0	0	0	0	111	N558 K559 Q564 G565 E566	N558-T562 PolarHBondContact O-N 3.38Å; N558-T562 PolarHBondContact O-OG1 2.98Å; N558-T562 VanDerWaalsContact O-OG1 3.05Å; K559-T562 PolarHBondContact O-N 2.92Å; T562-Q564 VanDerWaalsContact C-N 3.31Å; T562-Q564 PolarHBondContact O-N 3.01Å; T562-G565 CarbonylContact O-C 3.53Å; T562-G565 VanDerWaalsContact O-CA 3.26Å; T562-G565 WeakPolarHBondContact O-CA 3.38Å; T562-G565 PolarHBondContact O-N 2.91Å; T562-E566 PolarHBondContact O-N 2.74Å
563	A	91.5	Very high	87	Confident	40 Å²	40	60.8 Å²	60.8	33%	0.331	36%	0.36	S	S	.	.	H	α-helix	trans	-59.5	-37.5	176.3	0	0	0	0	0	113	K559 N560 G565 E566 L567	K559-A563 PolarHBondContact O-N 3.17Å; K559-A563 VanDerWaalsContact O-N 3.09Å; N560-A563 PolarHBondContact O-N 3.17Å; A563-G565 VanDerWaalsContact C-N 3.31Å; A563-G565 PolarHBondContact O-N 3.39Å; A563-E566 PolarHBondContact O-N 3.18Å; A563-L567 WeakPolarHBondContact O-CG 3.29Å; A563-L567 PolarHBondContact O-N 3.23Å; A563-L567 VanDerWaalsContact O-N 3.09Å
564	Q	89.8	Confident	85.2	Confident	45 Å²	45	61 Å²	61	21%	0.21	37%	0.369	C	S	.	.	H	α-helix	trans	-67.9	-30.3	171.2	-64.3	-57.8	-39.4	0	0	112.5	N560 I561 T562 I568 A604 E607 K608 L611	N560-Q564 WeakPolarHBondContact O-CG 3.1Å; N560-Q564 PolarHBondContact O-N 2.87Å; N560-Q564 VanDerWaalsContact O-N 3.08Å; I561-Q564 PolarHBondContact O-N 3.15Å; T562-Q564 VanDerWaalsContact C-N 3.31Å; T562-Q564 PolarHBondContact O-N 3.01Å; Q564-I568 VanDerWaalsContact O-CD1 3.26Å; Q564-I568 WeakPolarHBondContact O-CD1 3.26Å; Q564-I568 WeakPolarHBondContact O-CG1 3.5Å; Q564-I568 PolarHBondContact O-N 2.99Å; Q564-A604 VanDerWaalsContact OE1-CA 3.27Å; Q564-E607 HydrophobicContact CG-CB 4.34Å; Q564-K608 HydrophobicContact CB-CB 4.08Å; Q564-L611 HydrophobicContact CG-CD1 3.86Å
565	G	90.4	Very high	83.3	Confident	19 Å²	19	66.2 Å²	66.2	20%	0.196	40%	0.401	C	S	.	.	H	α-helix	trans	-64.9	-45.7	170.4	0	0	0	0	0	112.8	I561 T562 A563 I568 A569	I561-G565 PolarHBondContact O-N 3.38Å; T562-G565 CarbonylContact O-C 3.53Å; T562-G565 VanDerWaalsContact O-CA 3.26Å; T562-G565 WeakPolarHBondContact O-CA 3.38Å; T562-G565 PolarHBondContact O-N 2.91Å; A563-G565 VanDerWaalsContact C-N 3.31Å; A563-G565 PolarHBondContact O-N 3.39Å; G565-I568 PolarHBondContact O-N 2.92Å; G565-A569 PolarHBondContact O-N 2.67Å
566	E	89.4	Confident	81	Confident	126 Å²	126	72.4 Å²	72.4	59%	0.589	43%	0.431	S	S	*	.	H	α-helix	trans	-60.4	-43.8	177	-68.6	169.6	177.3	0	0	111.8	T562 A563 I568 A569 A570	T562-E566 PolarHBondContact O-N 2.74Å; A563-E566 PolarHBondContact O-N 3.18Å; E566-I568 VanDerWaalsContact C-N 3.34Å; E566-I568 PolarHBondContact O-N 3.16Å; E566-A569 PolarHBondContact O-N 2.95Å; E566-A570 WeakPolarHBondContact O-CB 3.28Å; E566-A570 PolarHBondContact O-N 2.85Å
567	L	86.9	Confident	78.7	Confident	88 Å²	88	74.5 Å²	74.5	46%	0.461	45%	0.446	S	S	.	.	H	α-helix	trans	-61.5	-38.5	175.2	-71.8	171.9	0	0	0	113	A563 G571 A604	A563-L567 WeakPolarHBondContact O-CG 3.29Å; A563-L567 PolarHBondContact O-N 3.23Å; A563-L567 VanDerWaalsContact O-N 3.09Å; L567-G571 PolarHBondContact O-N 3.4Å; L567-G571 VanDerWaalsContact O-N 3.1Å; L567-A604 HydrophobicContact CB-CB 4.22Å
568	I	88.3	Confident	76.3	Confident	32 Å²	32	83.2 Å²	83.2	16%	0.164	49%	0.487	C	S	.	.	H	α-helix	trans	-68.2	-41.7	176.3	-66.7	162	0	0	0	110.6	Q564 G565 E566 A572 V601 A604 K605 K608	Q564-I568 VanDerWaalsContact O-CD1 3.26Å; Q564-I568 WeakPolarHBondContact O-CD1 3.26Å; Q564-I568 WeakPolarHBondContact O-CG1 3.5Å; Q564-I568 PolarHBondContact O-N 2.99Å; G565-I568 PolarHBondContact O-N 2.92Å; E566-I568 VanDerWaalsContact C-N 3.34Å; E566-I568 PolarHBondContact O-N 3.16Å; I568-A572 WeakPolarHBondContact O-CB 3.38Å; I568-A572 PolarHBondContact O-N 3.01Å; I568-A572 VanDerWaalsContact O-N 3.09Å; I568-V601 HydrophobicContact CG2-CG1 4.48Å; I568-A604 HydrophobicContact CD1-CB 4.32Å; I568-A604 HydrophobicContact CG1-CB 3.74Å; I568-K605 HydrophobicContact CD1-CB 4.43Å; I568-K605 HydrophobicContact CD1-CG 3.82Å; I568-K605 HydrophobicContact CG1-CG 4.12Å; I568-K608 HydrophobicContact CD1-CB 4.28Å; I568-K608 HydrophobicContact CD1-CD 3.68Å
569	A	86.7	Confident	73.9	Confident	62 Å²	62	85 Å²	85	51%	0.512	50%	0.504	S	S	.	.	H	α-helix	trans	-66.1	-46.7	178	0	0	0	0	0	112.1	G565 E566 G571 A572 S573	G565-A569 PolarHBondContact O-N 2.67Å; E566-A569 PolarHBondContact O-N 2.95Å; A569-G571 PolarHBondContact O-N 2.75Å; A569-A572 PolarHBondContact O-N 2.91Å; A569-S573 PolarHBondContact O-N 2.98Å
570	A	83.1	Confident	71.2	Confident	67 Å²	67	84.6 Å²	84.6	55%	0.554	51%	0.51	S	S	*	.	H	α-helix	trans	-60.9	-42.7	177.6	0	0	0	0	0	112.1	E566 A572 S573	E566-A570 WeakPolarHBondContact O-CB 3.28Å; E566-A570 PolarHBondContact O-N 2.85Å; A570-A572 PolarHBondContact O-N 3.38Å; A570-S573 PolarHBondContact O-N 3.2Å
571	G	73.5	Confident	68.9	Low	19 Å²	19	90 Å²	90	20%	0.196	54%	0.539	C	S	.	.	H	α-helix	trans	-64.3	-38.2	175.6	0	0	0	0	0	113.3	L567 A569 S574	L567-G571 PolarHBondContact O-N 3.4Å; L567-G571 VanDerWaalsContact O-N 3.1Å; A569-G571 PolarHBondContact O-N 2.75Å; G571-S574 PolarHBondContact O-OG 3.27Å
572	A	64.4	Low	66.2	Low	71 Å²	71	95.6 Å²	95.6	59%	0.587	57%	0.569	S	S	*	*	H	α-helix	trans	-68.4	-33.5	176.8	0	0	0	0	0	113.3	I568 A569 A570 S574	I568-A572 WeakPolarHBondContact O-CB 3.38Å; I568-A572 PolarHBondContact O-N 3.01Å; I568-A572 VanDerWaalsContact O-N 3.09Å; A569-A572 PolarHBondContact O-N 2.91Å; A570-A572 PolarHBondContact O-N 3.38Å; A572-S574 PolarHBondContact O-N 3.46Å
573	S	59.2	Low	64.2	Low	98 Å²	98	97.1 Å²	97.1	69%	0.685	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	1	-176.4	-163.1	0	0	0	0	114.9	A569 A570 V575	A569-S573 PolarHBondContact O-N 2.98Å; A570-S573 PolarHBondContact O-N 3.2Å; S573-V575 VanDerWaalsContact C-N 3.34Å; S573-V575 PolarHBondContact O-N 3.36Å
574	S	52.9	Low	61.8	Low	72 Å²	72	102.3 Å²	102.3	50%	0.503	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.7	15.9	-172.4	64	0	0	0	0	115.3	G571 A572	G571-S574 PolarHBondContact O-OG 3.27Å; A572-S574 PolarHBondContact O-N 3.46Å
575	V	52.6	Low	59.6	Low	121 Å²	121	107.9 Å²	107.9	73%	0.733	62%	0.624	S	S	*	*	S	Bend	trans	-127.2	-8.6	-165.7	-175.9	0	0	0	0	114.3	S573	S573-V575 VanDerWaalsContact C-N 3.34Å; S573-V575 PolarHBondContact O-N 3.36Å
576	L	42.4	Very low	57.5	Low	149 Å²	149	115.3 Å²	115.3	78%	0.78	65%	0.651	S	S	*	*	S	Bend	trans	-147.8	83.3	-174.2	-164	74.6	0	0	0	113.5
577	D	44.1	Very low	55.5	Low	156 Å²	156	117 Å²	117	83%	0.834	66%	0.662	S	S	*	*				-176.6	160.3	115.7	-98.7	-23.7	0	0	0	112
578	Q	42.6	Very low	53.7	Low	187 Å²	187	120 Å²	120	87%	0.874	68%	0.678	S	S	*	*			trans	-111.7	141.3	-179.5	-62.5	174.6	-12.8	0	0	110.7
579	S	40.8	Very low	51.9	Low	105 Å²	105	126.2 Å²	126.2	73%	0.734	71%	0.706	S	S	*	*				171.4	129.9	121.5	60.8	0	0	0	0	111.8
580	D	38.4	Very low	49.9	Very low	148 Å²	148	129.6 Å²	129.6	79%	0.791	72%	0.715	S	S	*	*			trans	39	93	142.6	-52.1	-22.3	0	0	0	118.8
581	N	45.6	Very low	48.1	Very low	170 Å²	170	135.9 Å²	135.9	91%	0.909	73%	0.73	S	S	*	*			trans	-152.2	143.2	133.8	-106	-66.4	0	0	0	111.4	V583	N581-V583 PolarHBondContact O-N 2.77Å
582	N	35.8	Very low	47.3	Very low	152 Å²	152	137.3 Å²	137.3	81%	0.813	74%	0.737	S	S	*	*			trans	-90.3	106	-164.3	-177.4	19.3	0	0	0	112.6
583	V	49	Very low	46.9	Very low	113 Å²	113	136 Å²	136	69%	0.685	73%	0.73	S	S	*	*			trans	-141.9	126.2	169.1	-173.2	0	0	0	0	110	N581 F585	N581-V583 PolarHBondContact O-N 2.77Å; V583-F585 HydrophobicContact CG1-CD2 4.19Å; V583-F585 PolarHBondContact O-N 3.3Å; V583-F585 VanDerWaalsContact O-N 3.11Å
584	D	41.8	Very low	46.8	Very low	148 Å²	148	136.2 Å²	136.2	79%	0.791	73%	0.732	S	S	*	*			trans	-66.8	104.4	176.8	-89.6	-59	0	0	0	112.3
585	F	44.8	Very low	47.2	Very low	162 Å²	162	137.3 Å²	137.3	71%	0.711	73%	0.731	S	S	*	*			trans	-127.2	28.6	171.9	-111.5	-80.6	0	0	0	113.7	V583 I587	V583-F585 HydrophobicContact CG1-CD2 4.19Å; V583-F585 PolarHBondContact O-N 3.3Å; V583-F585 VanDerWaalsContact O-N 3.11Å; F585-I587 PolarHBondContact O-N 2.78Å
586	K	45.7	Very low	47.7	Very low	175 Å²	175	137.2 Å²	137.2	76%	0.761	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	47.1	-171.1	-159.1	-171.8	177.1	178.5	0	115.1
587	I	47	Very low	49.1	Very low	161 Å²	161	133.6 Å²	133.6	83%	0.826	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.9	-18.8	-178.5	-66.3	-175.1	0	0	0	113.9	F585	F585-I587 PolarHBondContact O-N 2.78Å
588	I	49.7	Very low	50.8	Low	153 Å²	153	129.5 Å²	129.5	79%	0.785	69%	0.686	S	S	*	*	S	Bend	trans	-130.2	34.5	-174.4	-31.3	-179.4	0	0	0	113.6
589	Q	50.8	Low	52.8	Low	161 Å²	161	126.9 Å²	126.9	75%	0.752	67%	0.672	S	S	*	*	S	Bend	trans	-110.6	-24.7	-176.2	-158.2	160.8	11.3	0	0	114.7
590	D	43.3	Very low	54.9	Low	134 Å²	134	126.4 Å²	126.4	72%	0.717	66%	0.66	S	S	*	*	S	Bend	trans	-93.2	-5.9	-158.8	-62.9	-25.3	0	0	0	116.3
591	F	46.7	Very low	57.2	Low	199 Å²	199	120.3 Å²	120.3	87%	0.873	63%	0.628	S	S	*	*	S	Bend	trans	-135.6	121.2	174.4	-83.2	-88	0	0	0	114	G593	F591-G593 PolarHBondContact O-N 2.99Å
592	S	56	Low	59.2	Low	49 Å²	49	115.6 Å²	115.6	34%	0.343	60%	0.601	S	S	.	*	S	Bend	trans	69	1.4	160.6	-163.8	0	0	0	0	119.9	S594 I595 F596	S592-S594 PolarHBondContact O-N 3.47Å; S592-I595 PolarHBondContact O-N 2.88Å; S592-I595 VanDerWaalsContact O-N 3.1Å; S592-F596 VanDerWaalsContact O-CD2 3.24Å; S592-F596 WeakPolarHBondContact O-CD2 3.32Å; S592-F596 PolarHBondContact O-N 2.7Å; S592-F596 WeakPolarHBondContact OG-CD2 3.35Å; S592-F596 VanDerWaalsContact OG-CE2 3.31Å; S592-F596 WeakPolarHBondContact OG-CE2 3.32Å
593	G	56	Low	61.8	Low	42 Å²	42	112.5 Å²	112.5	43%	0.433	58%	0.581	S	S	.	*	H	α-helix	trans	-51.4	-52.4	-178.5	0	0	0	0	0	115	F591 I595 F596 N597	F591-G593 PolarHBondContact O-N 2.99Å; G593-I595 VanDerWaalsContact C-N 3.32Å; G593-I595 PolarHBondContact O-N 3.13Å; G593-F596 PolarHBondContact O-N 2.8Å; G593-N597 PolarHBondContact O-N 3.44Å; G593-N597 VanDerWaalsContact O-N 3.11Å
594	S	57.7	Low	63.8	Low	103 Å²	103	107.3 Å²	107.3	72%	0.72	55%	0.55	S	S	*	*	H	α-helix	trans	-59.2	-38.8	177.2	174.5	0	0	0	0	113.3	S592 N597 S598	S592-S594 PolarHBondContact O-N 3.47Å; S594-N597 PolarHBondContact O-N 2.92Å; S594-S598 PolarHBondContact O-N 2.9Å
595	I	60.3	Low	66.1	Low	95 Å²	95	104.2 Å²	104.2	49%	0.487	53%	0.53	S	S	.	.	H	α-helix	trans	-69.7	-35.3	-179.4	-60.9	174.3	0	0	0	111	S592 G593 K599	S592-I595 PolarHBondContact O-N 2.88Å; S592-I595 VanDerWaalsContact O-N 3.1Å; G593-I595 VanDerWaalsContact C-N 3.32Å; G593-I595 PolarHBondContact O-N 3.13Å; I595-K599 HydrophobicContact CG2-CD 4.37Å; I595-K599 WeakPolarHBondContact O-CG 3.29Å; I595-K599 PolarHBondContact O-N 2.72Å
596	F	64	Low	68.4	Low	119 Å²	119	103.6 Å²	103.6	52%	0.522	52%	0.523	S	S	.	.	H	α-helix	trans	-67.7	-46.9	173.7	-76.2	-62.9	0	0	0	111.7	S592 G593 S598 K599 I600	S592-F596 VanDerWaalsContact O-CD2 3.24Å; S592-F596 WeakPolarHBondContact O-CD2 3.32Å; S592-F596 PolarHBondContact O-N 2.7Å; S592-F596 WeakPolarHBondContact OG-CD2 3.35Å; S592-F596 VanDerWaalsContact OG-CE2 3.31Å; S592-F596 WeakPolarHBondContact OG-CE2 3.32Å; G593-F596 PolarHBondContact O-N 2.8Å; F596-S598 VanDerWaalsContact C-N 3.32Å; F596-S598 PolarHBondContact O-N 3.18Å; F596-K599 PolarHBondContact O-N 3.32Å; F596-I600 VanDerWaalsContact O-CG1 3.3Å; F596-I600 WeakPolarHBondContact O-CG1 3.21Å; F596-I600 PolarHBondContact O-N 2.96Å
597	N	72	Confident	70.7	Confident	73 Å²	73	97.7 Å²	97.7	39%	0.39	50%	0.498	S	S	.	.	H	α-helix	trans	-57	-45.1	177.3	-70.9	0.2	0	0	0	111.7	G593 S594 K599 I600 V601	G593-N597 PolarHBondContact O-N 3.44Å; G593-N597 VanDerWaalsContact O-N 3.11Å; S594-N597 PolarHBondContact O-N 2.92Å; N597-K599 PolarHBondContact O-N 2.88Å; N597-I600 PolarHBondContact O-N 3.3Å; N597-V601 WeakPolarHBondContact O-CG2 3.34Å; N597-V601 PolarHBondContact O-N 2.96Å
598	S	78.3	Confident	72.8	Confident	70 Å²	70	94 Å²	94	49%	0.49	48%	0.476	S	S	.	.	H	α-helix	trans	-58.1	-48.3	175.5	179	0	0	0	0	112.6	S594 F596 I600 V601 E602	S594-S598 PolarHBondContact O-N 2.9Å; F596-S598 VanDerWaalsContact C-N 3.32Å; F596-S598 PolarHBondContact O-N 3.18Å; S598-I600 VanDerWaalsContact C-N 3.35Å; S598-I600 PolarHBondContact O-N 2.85Å; S598-V601 PolarHBondContact O-N 2.88Å; S598-E602 WeakPolarHBondContact O-CG 3.06Å; S598-E602 PolarHBondContact O-N 2.83Å
599	K	85.2	Confident	75	Confident	133 Å²	133	91.9 Å²	91.9	58%	0.578	47%	0.466	S	S	*	.	H	α-helix	trans	-62.4	-38.5	177.6	-73.2	173.3	-179	175.7	0	112.9	I595 F596 N597 Q603	I595-K599 HydrophobicContact CG2-CD 4.37Å; I595-K599 WeakPolarHBondContact O-CG 3.29Å; I595-K599 PolarHBondContact O-N 2.72Å; F596-K599 PolarHBondContact O-N 3.32Å; N597-K599 PolarHBondContact O-N 2.88Å; K599-Q603 WeakPolarHBondContact O-CB 3.36Å; K599-Q603 PolarHBondContact O-N 3.22Å
600	I	84	Confident	77.1	Confident	95 Å²	95	90.1 Å²	90.1	49%	0.487	46%	0.456	S	S	.	.	H	α-helix	trans	-66.6	-47	177.6	-68.1	163.6	0	0	0	110.4	F596 N597 S598 E602 Q603 A604	F596-I600 VanDerWaalsContact O-CG1 3.3Å; F596-I600 WeakPolarHBondContact O-CG1 3.21Å; F596-I600 PolarHBondContact O-N 2.96Å; N597-I600 PolarHBondContact O-N 3.3Å; S598-I600 VanDerWaalsContact C-N 3.35Å; S598-I600 PolarHBondContact O-N 2.85Å; I600-E602 PolarHBondContact O-N 3.36Å; I600-Q603 PolarHBondContact O-N 3.09Å; I600-A604 WeakPolarHBondContact O-CB 3.31Å; I600-A604 PolarHBondContact O-N 2.85Å
601	V	87.6	Confident	79.6	Confident	19 Å²	19	84.8 Å²	84.8	12%	0.115	43%	0.427	C	S	.	.	H	α-helix	trans	-62	-43	177.5	168.6	0	0	0	0	111.7	I568 N597 S598 Q603 A604 K605	I568-V601 HydrophobicContact CG2-CG1 4.48Å; N597-V601 WeakPolarHBondContact O-CG2 3.34Å; N597-V601 PolarHBondContact O-N 2.96Å; S598-V601 PolarHBondContact O-N 2.88Å; V601-Q603 VanDerWaalsContact C-N 3.34Å; V601-Q603 PolarHBondContact O-N 3.35Å; V601-A604 PolarHBondContact O-N 3.31Å; V601-K605 HydrophobicContact CG1-CD 4.34Å; V601-K605 WeakPolarHBondContact O-CG 3.41Å; V601-K605 PolarHBondContact O-N 3.46Å
602	E	88.5	Confident	81.9	Confident	72 Å²	72	77.2 Å²	77.2	34%	0.336	40%	0.401	S	S	.	.	H	α-helix	trans	-65.7	-35.5	175.8	-72.9	-53	126.1	0	0	112.9	S598 I600 K605 R606	S598-E602 WeakPolarHBondContact O-CG 3.06Å; S598-E602 PolarHBondContact O-N 2.83Å; I600-E602 PolarHBondContact O-N 3.36Å; E602-K605 WeakPolarHBondContact OE1-CD 3.43Å; E602-K605 WeakPolarHBondContact OE1-CE 3.48Å; E602-K605 IonicContact OE1-NZ 2.72Å; E602-K605 PolarHBondContact OE1-NZ 2.98Å; E602-R606 WeakPolarHBondContact O-CD 3.38Å; E602-R606 VanDerWaalsContact O-CG 3.28Å; E602-R606 WeakPolarHBondContact O-CG 3.26Å; E602-R606 PolarHBondContact O-N 2.81Å; E602-R606 VanDerWaalsContact O-N 3.16Å
603	Q	89.5	Confident	83.7	Confident	86 Å²	86	78 Å²	78	40%	0.402	41%	0.406	S	S	.	.	H	α-helix	trans	-68.9	-40	173.5	-171.2	58.6	20.4	0	0	111.9	K599 I600 V601 K605 R606 E607	K599-Q603 WeakPolarHBondContact O-CB 3.36Å; K599-Q603 PolarHBondContact O-N 3.22Å; I600-Q603 PolarHBondContact O-N 3.09Å; V601-Q603 VanDerWaalsContact C-N 3.34Å; V601-Q603 PolarHBondContact O-N 3.35Å; Q603-K605 PolarHBondContact O-N 3.15Å; Q603-R606 PolarHBondContact O-N 2.98Å; Q603-E607 PolarHBondContact O-N 2.94Å
604	A	90.2	Very high	85.6	Confident	4 Å²	4	80.6 Å²	80.6	3%	0.033	41%	0.406	C	S	.	.	H	α-helix	trans	-63.6	-39.3	175.1	0	0	0	0	0	112.2	Q564 L567 I568 I600 V601 R606 E607 K608	Q564-A604 VanDerWaalsContact OE1-CA 3.27Å; L567-A604 HydrophobicContact CB-CB 4.22Å; I568-A604 HydrophobicContact CD1-CB 4.32Å; I568-A604 HydrophobicContact CG1-CB 3.74Å; I600-A604 WeakPolarHBondContact O-CB 3.31Å; I600-A604 PolarHBondContact O-N 2.85Å; V601-A604 PolarHBondContact O-N 3.31Å; A604-R606 PolarHBondContact O-N 2.89Å; A604-E607 PolarHBondContact O-N 3.16Å; A604-K608 VanDerWaalsContact O-CB 3.25Å; A604-K608 WeakPolarHBondContact O-CB 3.29Å; A604-K608 PolarHBondContact O-N 3.32Å
605	K	91.2	Very high	87.3	Confident	83 Å²	83	76.3 Å²	76.3	36%	0.361	38%	0.375	S	S	.	.	H	α-helix	trans	-59.5	-42.8	171.9	-73.6	171	-175	171.9	0	112.3	I568 V601 E602 Q603 K608 N609	I568-K605 HydrophobicContact CD1-CB 4.43Å; I568-K605 HydrophobicContact CD1-CG 3.82Å; I568-K605 HydrophobicContact CG1-CG 4.12Å; V601-K605 HydrophobicContact CG1-CD 4.34Å; V601-K605 WeakPolarHBondContact O-CG 3.41Å; V601-K605 PolarHBondContact O-N 3.46Å; E602-K605 WeakPolarHBondContact OE1-CD 3.43Å; E602-K605 WeakPolarHBondContact OE1-CE 3.48Å; E602-K605 IonicContact OE1-NZ 2.72Å; E602-K605 PolarHBondContact OE1-NZ 2.98Å; Q603-K605 PolarHBondContact O-N 3.15Å; K605-K608 PolarHBondContact O-N 3.33Å; K605-N609 PolarHBondContact O-N 2.84Å
606	R	92.9	Very high	89	Confident	149 Å²	149	76 Å²	76	56%	0.562	38%	0.38	S	S	*	.	H	α-helix	trans	-64.6	-47.5	177.7	-68.2	163.7	-169.1	167.9	0.3	111.7	E602 Q603 A604 N609 K610	E602-R606 WeakPolarHBondContact O-CD 3.38Å; E602-R606 VanDerWaalsContact O-CG 3.28Å; E602-R606 WeakPolarHBondContact O-CG 3.26Å; E602-R606 PolarHBondContact O-N 2.81Å; E602-R606 VanDerWaalsContact O-N 3.16Å; Q603-R606 PolarHBondContact O-N 2.98Å; A604-R606 PolarHBondContact O-N 2.89Å; R606-N609 PolarHBondContact O-N 3.19Å; R606-K610 WeakPolarHBondContact O-CB 3.48Å; R606-K610 PolarHBondContact O-N 3.42Å
607	E	93.3	Very high	90.4	Very high	52 Å²	52	79.8 Å²	79.8	24%	0.243	39%	0.391	C	S	.	.	H	α-helix	trans	-66.6	-37.8	177.6	-68.4	-62.1	128.6	0	0	111.7	Q564 Q603 A604 N609 K610 L611	Q564-E607 HydrophobicContact CG-CB 4.34Å; Q603-E607 PolarHBondContact O-N 2.94Å; A604-E607 PolarHBondContact O-N 3.16Å; E607-N609 PolarHBondContact O-N 2.99Å; E607-K610 PolarHBondContact O-N 2.96Å; E607-K610 WeakPolarHBondContact OE1-CD 3.21Å; E607-K610 IonicContact OE1-NZ 2.69Å; E607-K610 PolarHBondContact OE1-NZ 2.85Å; E607-K610 WeakPolarHBondContact OE2-CD 3.5Å; E607-K610 WeakPolarHBondContact OE2-CE 3.5Å; E607-K610 IonicContact OE2-NZ 3.18Å; E607-K610 PolarHBondContact OE2-NZ 3.37Å; E607-L611 WeakPolarHBondContact O-CB 3.11Å; E607-L611 VanDerWaalsContact O-CG 3.25Å; E607-L611 WeakPolarHBondContact O-CG 3.48Å; E607-L611 PolarHBondContact O-N 2.91Å
608	K	92.7	Very high	91.3	Very high	83 Å²	83	76.9 Å²	76.9	36%	0.361	38%	0.375	S	S	.	.	H	α-helix	trans	-55.9	-47	170.7	-178.2	171.2	-179.8	174.5	0	111.9	I561 Q564 I568 A604 K605 L611 A612	I561-K608 HydrophobicContact CD1-CG 4.21Å; I561-K608 HydrophobicContact CG1-CG 3.84Å; Q564-K608 HydrophobicContact CB-CB 4.08Å; I568-K608 HydrophobicContact CD1-CB 4.28Å; I568-K608 HydrophobicContact CD1-CD 3.68Å; A604-K608 VanDerWaalsContact O-CB 3.25Å; A604-K608 WeakPolarHBondContact O-CB 3.29Å; A604-K608 PolarHBondContact O-N 3.32Å; K605-K608 PolarHBondContact O-N 3.33Å; K608-L611 PolarHBondContact O-N 2.91Å; K608-A612 WeakPolarHBondContact O-CB 3.48Å; K608-A612 PolarHBondContact O-N 3.06Å
609	N	94.9	Very high	91.9	Very high	108 Å²	108	79.1 Å²	79.1	58%	0.578	38%	0.376	S	S	*	.	H	α-helix	trans	-67.8	-36.4	178.7	-74	-14.7	0	0	0	113.1	K605 R606 E607 S613	K605-N609 PolarHBondContact O-N 2.84Å; R606-N609 PolarHBondContact O-N 3.19Å; E607-N609 PolarHBondContact O-N 2.99Å; N609-S613 WeakPolarHBondContact O-CB 3.46Å; N609-S613 PolarHBondContact O-N 3.43Å; N609-S613 PolarHBondContact O-OG 3.2Å
610	K	95.5	Very high	92	Very high	124 Å²	124	80.6 Å²	80.6	54%	0.539	38%	0.383	S	S	.	.	H	α-helix	trans	-66.6	-43.6	174.8	178.8	-173.2	171.9	-160.4	0	111.6	R606 E607 S613 K614	R606-K610 WeakPolarHBondContact O-CB 3.48Å; R606-K610 PolarHBondContact O-N 3.42Å; E607-K610 PolarHBondContact O-N 2.96Å; E607-K610 WeakPolarHBondContact OE1-CD 3.21Å; E607-K610 IonicContact OE1-NZ 2.69Å; E607-K610 PolarHBondContact OE1-NZ 2.85Å; E607-K610 WeakPolarHBondContact OE2-CD 3.5Å; E607-K610 WeakPolarHBondContact OE2-CE 3.5Å; E607-K610 IonicContact OE2-NZ 3.18Å; E607-K610 PolarHBondContact OE2-NZ 3.37Å; K610-S613 WeakPolarHBondContact O-CB 3.38Å; K610-S613 PolarHBondContact O-N 3.27Å; K610-K614 PolarHBondContact O-N 2.99Å
611	L	95.4	Very high	92.2	Very high	23 Å²	23	80.7 Å²	80.7	12%	0.12	38%	0.38	C	S	.	.	H	α-helix	trans	-64.1	-46.9	173.2	-70.5	168.9	0	0	0	111.4	L557 N560 I561 Q564 E607 K608 S613 K614 I615	L557-L611 HydrophobicContact CD2-CD2 3.71Å; N560-L611 HydrophobicContact CB-CD1 3.91Å; N560-L611 HydrophobicContact CB-CD2 4.2Å; I561-L611 HydrophobicContact CB-CB 4.16Å; I561-L611 HydrophobicContact CB-CD1 4.31Å; I561-L611 HydrophobicContact CD1-CB 4.43Å; I561-L611 HydrophobicContact CG1-CB 4.24Å; Q564-L611 HydrophobicContact CG-CD1 3.86Å; E607-L611 WeakPolarHBondContact O-CB 3.11Å; E607-L611 VanDerWaalsContact O-CG 3.25Å; E607-L611 WeakPolarHBondContact O-CG 3.48Å; E607-L611 PolarHBondContact O-N 2.91Å; K608-L611 PolarHBondContact O-N 2.91Å; L611-S613 VanDerWaalsContact C-N 3.28Å; L611-S613 PolarHBondContact O-N 3.49Å; L611-K614 PolarHBondContact O-N 3.17Å; L611-K614 VanDerWaalsContact O-N 3.09Å; L611-I615 VanDerWaalsContact O-CG1 3.3Å; L611-I615 WeakPolarHBondContact O-CG1 3.37Å; L611-I615 PolarHBondContact O-N 3.21Å
612	A	94.4	Very high	92.2	Very high	39 Å²	39	79.9 Å²	79.9	32%	0.322	38%	0.375	S	S	.	.	H	α-helix	trans	-56.4	-43	174.8	0	0	0	0	0	112	I561 K608 I615 C616	I561-A612 HydrophobicContact CD1-CB 3.8Å; K608-A612 WeakPolarHBondContact O-CB 3.48Å; K608-A612 PolarHBondContact O-N 3.06Å; A612-I615 PolarHBondContact O-N 2.88Å; A612-C616 WeakPolarHBondContact O-CB 3.2Å; A612-C616 PolarHBondContact O-N 3.47Å
613	S	95.2	Very high	92	Very high	65 Å²	65	81 Å²	81	46%	0.455	38%	0.379	S	S	.	.	H	α-helix	trans	-63.4	-39.8	175.8	-61.5	0	0	0	0	112.4	N609 K610 L611 R617	N609-S613 WeakPolarHBondContact O-CB 3.46Å; N609-S613 PolarHBondContact O-N 3.43Å; N609-S613 PolarHBondContact O-OG 3.2Å; K610-S613 WeakPolarHBondContact O-CB 3.38Å; K610-S613 PolarHBondContact O-N 3.27Å; L611-S613 VanDerWaalsContact C-N 3.28Å; L611-S613 PolarHBondContact O-N 3.49Å; S613-R617 WeakPolarHBondContact O-CG 3.44Å; S613-R617 PolarHBondContact O-N 3.36Å
614	K	95.5	Very high	91.7	Very high	97 Å²	97	80.3 Å²	80.3	42%	0.422	38%	0.375	S	S	.	.	H	α-helix	trans	-67.1	-47.2	175.4	-168.1	178.3	173.4	-168	0	111.3	E553 L557 K610 L611 C616 R617 L618	E553-K614 WeakPolarHBondContact OE1-CE 3.02Å; E553-K614 IonicContact OE1-NZ 2.67Å; E553-K614 PolarHBondContact OE1-NZ 3.06Å; L557-K614 HydrophobicContact CD1-CB 4.29Å; L557-K614 HydrophobicContact CD1-CD 3.76Å; L557-K614 HydrophobicContact CD1-CG 3.79Å; L557-K614 HydrophobicContact CD2-CD 3.84Å; L557-K614 HydrophobicContact CG-CD 4.47Å; K610-K614 PolarHBondContact O-N 2.99Å; L611-K614 PolarHBondContact O-N 3.17Å; L611-K614 VanDerWaalsContact O-N 3.09Å; K614-C616 VanDerWaalsContact C-N 3.33Å; K614-C616 PolarHBondContact O-N 2.79Å; K614-R617 PolarHBondContact O-N 3.02Å; K614-L618 VanDerWaalsContact O-CB 3.31Å; K614-L618 WeakPolarHBondContact O-CB 3.4Å; K614-L618 PolarHBondContact O-N 3.39Å
615	I	93.1	Very high	91.6	Very high	13 Å²	13	80.1 Å²	80.1	7%	0.067	37%	0.374	C	S	.	.	H	α-helix	trans	-56.3	-45.3	175.4	-68	162.9	0	0	0	110.8	L554 L557 I561 L611 A612 L618 K619	L554-I615 HydrophobicContact CD2-CG2 3.98Å; L557-I615 HydrophobicContact CB-CD1 3.97Å; L557-I615 HydrophobicContact CB-CG1 3.56Å; L557-I615 HydrophobicContact CD1-CG1 4.1Å; L557-I615 HydrophobicContact CG-CG1 4.46Å; I561-I615 HydrophobicContact CB-CD1 4.21Å; I561-I615 HydrophobicContact CD1-CD1 4.14Å; I561-I615 HydrophobicContact CG2-CD1 3.91Å; L611-I615 VanDerWaalsContact O-CG1 3.3Å; L611-I615 WeakPolarHBondContact O-CG1 3.37Å; L611-I615 PolarHBondContact O-N 3.21Å; A612-I615 PolarHBondContact O-N 2.88Å; I615-L618 PolarHBondContact O-N 3.5Å; I615-K619 HydrophobicContact CG2-CD 4.05Å; I615-K619 HydrophobicContact CG2-CG 4.32Å; I615-K619 WeakPolarHBondContact O-CB 3.28Å; I615-K619 WeakPolarHBondContact O-CG 3.35Å; I615-K619 PolarHBondContact O-N 2.81Å
616	C	94.9	Very high	91.1	Very high	88 Å²	88	77.4 Å²	77.4	60%	0.595	37%	0.367	S	S	*	.	H	α-helix	trans	-60.8	-46.5	178.4	-177.1	0	0	0	0	112.4	A612 K614 K620	A612-C616 WeakPolarHBondContact O-CB 3.2Å; A612-C616 PolarHBondContact O-N 3.47Å; K614-C616 VanDerWaalsContact C-N 3.33Å; K614-C616 PolarHBondContact O-N 2.79Å; C616-K620 PolarHBondContact O-N 3.35Å
617	R	93.9	Very high	90.7	Very high	199 Å²	199	71.9 Å²	71.9	75%	0.751	35%	0.348	S	S	*	.	H	α-helix	trans	-63.7	-42.1	176.6	-69.9	174.5	-177.3	-165	1.6	111.8	S613 K614 K620 K621	S613-R617 WeakPolarHBondContact O-CG 3.44Å; S613-R617 PolarHBondContact O-N 3.36Å; K614-R617 PolarHBondContact O-N 3.02Å; R617-K620 PolarHBondContact O-N 3.23Å; R617-K621 PolarHBondContact O-N 3.08Å; R617-K621 VanDerWaalsContact O-N 3.15Å
618	L	92	Very high	90.4	Very high	12 Å²	12	70 Å²	70	6%	0.063	34%	0.339	C	S	.	.	H	α-helix	trans	-70	-41.8	-178.3	-172.6	61.6	0	0	0	112.2	M550 E553 L554 L557 K614 I615 K620 K621 A622	M550-L618 HydrophobicContact CB-CD1 4Å; M550-L618 HydrophobicContact CG-CD1 3.76Å; M550-L618 HydrophobicContact SD-CD1 4.13Å; E553-L618 HydrophobicContact CB-CD2 3.84Å; E553-L618 HydrophobicContact CG-CD2 3.58Å; E553-L618 VanDerWaalsContact OE2-CD1 3.31Å; E553-L618 WeakPolarHBondContact OE2-CD1 3.5Å; E553-L618 VanDerWaalsContact OE2-CD2 3.23Å; E553-L618 WeakPolarHBondContact OE2-CD2 3.39Å; L554-L618 HydrophobicContact CB-CD2 4.42Å; L554-L618 HydrophobicContact CD2-CB 4.01Å; L554-L618 HydrophobicContact CD2-CD2 3.79Å; L554-L618 HydrophobicContact CD2-CG 3.95Å; L554-L618 HydrophobicContact CG-CB 4.47Å; L554-L618 HydrophobicContact CG-CD2 3.64Å; L554-L618 HydrophobicContact CG-CG 3.85Å; L557-L618 HydrophobicContact CD1-CD2 3.82Å; K614-L618 VanDerWaalsContact O-CB 3.31Å; K614-L618 WeakPolarHBondContact O-CB 3.4Å; K614-L618 PolarHBondContact O-N 3.39Å; I615-L618 PolarHBondContact O-N 3.5Å; L618-K620 PolarHBondContact O-N 3.44Å; L618-K621 PolarHBondContact O-N 2.89Å; L618-K621 VanDerWaalsContact O-N 3.08Å; L618-A622 PolarHBondContact O-N 2.93Å
619	K	89.8	Confident	89.8	Confident	118 Å²	118	67.3 Å²	67.3	51%	0.513	33%	0.329	S	S	.	.	H	α-helix	trans	-56	-39.2	170.7	-76.4	-177.8	178.6	179.3	0	111.8	L554 I615 A622 F623	L554-K619 HydrophobicContact CD1-CG 4.07Å; L554-K619 HydrophobicContact CD2-CG 3.66Å; I615-K619 HydrophobicContact CG2-CD 4.05Å; I615-K619 HydrophobicContact CG2-CG 4.32Å; I615-K619 WeakPolarHBondContact O-CB 3.28Å; I615-K619 WeakPolarHBondContact O-CG 3.35Å; I615-K619 PolarHBondContact O-N 2.81Å; K619-A622 PolarHBondContact O-N 2.93Å; K619-F623 WeakPolarHBondContact O-CB 3.33Å; K619-F623 PolarHBondContact O-N 3.2Å
620	K	87.9	Confident	89	Confident	164 Å²	164	65.4 Å²	65.4	71%	0.713	32%	0.315	S	S	*	.	H	α-helix	trans	-67.6	-36.3	176	-170.7	169	-177.5	171.2	0	112.9	C616 R617 L618 H624	C616-K620 PolarHBondContact O-N 3.35Å; R617-K620 PolarHBondContact O-N 3.23Å; L618-K620 PolarHBondContact O-N 3.44Å; K620-H624 PolarHBondContact O-N 3.45Å; K620-H624 VanDerWaalsContact O-N 3.14Å
621	K	88.6	Confident	88.3	Confident	97 Å²	97	66.6 Å²	66.6	42%	0.422	32%	0.317	S	S	.	.	H	α-helix	trans	-66.8	-46.6	171.5	-72.9	-163.2	170.5	-135.5	0	112	D536 M550 R617 L618 F623 H624 E625	D536-K621 IonicContact OD2-NZ 2.92Å; D536-K621 PolarHBondContact OD2-NZ 2.82Å; M550-K621 HydrophobicContact SD-CB 3.52Å; M550-K621 VanDerWaalsContact SD-CB 3.52Å; M550-K621 HydrophobicContact SD-CD 4.44Å; R617-K621 PolarHBondContact O-N 3.08Å; R617-K621 VanDerWaalsContact O-N 3.15Å; L618-K621 PolarHBondContact O-N 2.89Å; L618-K621 VanDerWaalsContact O-N 3.08Å; K621-F623 VanDerWaalsContact C-N 3.33Å; K621-F623 PolarHBondContact O-N 2.98Å; K621-H624 PolarHBondContact O-N 2.87Å; K621-E625 PolarHBondContact O-N 2.96Å
622	A	86.3	Confident	87.6	Confident	2 Å²	2	66.9 Å²	66.9	2%	0.017	32%	0.319	C	S	.	.	H	α-helix	trans	-59.8	-41.9	177.4	0	0	0	0	0	112.2	W438 L547 M550 L554 L618 K619 E625 A626	W438-A622 HydrophobicContact CH2-CB 4.28Å; L547-A622 HydrophobicContact CD1-CB 4.08Å; M550-A622 HydrophobicContact CB-CB 4.32Å; M550-A622 HydrophobicContact CE-CB 4.3Å; L554-A622 HydrophobicContact CD1-CB 4.34Å; L618-A622 PolarHBondContact O-N 2.93Å; K619-A622 PolarHBondContact O-N 2.93Å; A622-E625 PolarHBondContact O-N 3.31Å; A622-A626 VanDerWaalsContact O-CB 3.3Å; A622-A626 WeakPolarHBondContact O-CB 3.32Å; A622-A626 PolarHBondContact O-N 3.21Å
623	F	84.1	Confident	86.7	Confident	94 Å²	94	65.4 Å²	65.4	41%	0.412	31%	0.307	S	S	.	.	H	α-helix	trans	-63.6	-41.1	174.2	-178.4	-116.7	0	0	0	112.8	P447 K619 K621 N627	P447-F623 HydrophobicContact CG-CD2 4.22Å; K619-F623 WeakPolarHBondContact O-CB 3.33Å; K619-F623 PolarHBondContact O-N 3.2Å; K621-F623 VanDerWaalsContact C-N 3.33Å; K621-F623 PolarHBondContact O-N 2.98Å; F623-N627 WeakPolarHBondContact CD1-ND2 3.14Å; F623-N627 WeakPolarHBondContact CE1-ND2 3.31Å; F623-N627 WeakPolarHBondContact CZ-ND2 3.24Å; F623-N627 WeakPolarHBondContact O-CB 3.19Å; F623-N627 PolarHBondContact O-N 3.2Å; F623-N627 PolarHBondContact O-ND2 2.75Å
624	H	85	Confident	85.8	Confident	73 Å²	73	66.2 Å²	66.2	34%	0.338	31%	0.306	S	S	.	.	H	α-helix	trans	-62.2	-47	175.3	176.8	55.2	0	0	0	111.7	K620 K621 N627 K628	K620-H624 PolarHBondContact O-N 3.45Å; K620-H624 VanDerWaalsContact O-N 3.14Å; K621-H624 PolarHBondContact O-N 2.87Å; H624-N627 WeakPolarHBondContact O-CB 3.49Å; H624-N627 PolarHBondContact O-N 3.2Å; H624-K628 WeakPolarHBondContact O-CG 3.46Å; H624-K628 PolarHBondContact O-N 3.39Å
625	E	86.9	Confident	85	Confident	0 Å²	0	67 Å²	67	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-65.6	-41.5	179.7	-160.7	63.8	-134.9	0	0	112.5	N543 R546 L547 M550 K621 A622 N627 K628 I629	N543-E625 PolarHBondContact N-OE1 2.9Å; R546-E625 WeakPolarHBondContact CD-OE2 3.24Å; R546-E625 IonicContact CZ-OE2 2.84Å; R546-E625 VanDerWaalsContact CZ-OE2 3.29Å; R546-E625 IonicContact NE-OE2 2.65Å; R546-E625 PolarHBondContact NE-OE2 3.02Å; R546-E625 VanDerWaalsContact NE-OE2 3.13Å; R546-E625 IonicContact NH1-OE2 3.07Å; R546-E625 IonicContact NH2-OE2 2.67Å; L547-E625 HydrophobicContact CB-CG 4.17Å; M550-E625 HydrophobicContact CE-CB 3.62Å; M550-E625 HydrophobicContact CE-CG 3.94Å; K621-E625 PolarHBondContact O-N 2.96Å; A622-E625 PolarHBondContact O-N 3.31Å; E625-N627 VanDerWaalsContact C-N 3.3Å; E625-N627 PolarHBondContact O-N 3.28Å; E625-K628 WeakPolarHBondContact O-CB 3.02Å; E625-K628 PolarHBondContact O-N 3.14Å; E625-K628 WeakPolarHBondContact OE1-CD 3.43Å; E625-K628 IonicContact OE1-NZ 3.24Å; E625-K628 PolarHBondContact OE1-NZ 2.92Å; E625-K628 VanDerWaalsContact OE2-CE 3.29Å; E625-K628 WeakPolarHBondContact OE2-CE 3.34Å; E625-K628 IonicContact OE2-NZ 2.62Å; E625-K628 PolarHBondContact OE2-NZ 2.91Å; E625-I629 PolarHBondContact O-N 3.42Å
626	A	80.7	Confident	84.2	Confident	25 Å²	25	67.6 Å²	67.6	21%	0.207	31%	0.314	C	S	.	.	H	α-helix	trans	-62	-36.6	172.4	0	0	0	0	0	112.3	L547 A622 I629 K630	L547-A626 HydrophobicContact CD1-CB 4.35Å; L547-A626 HydrophobicContact CD2-CB 4.04Å; A622-A626 VanDerWaalsContact O-CB 3.3Å; A622-A626 WeakPolarHBondContact O-CB 3.32Å; A622-A626 PolarHBondContact O-N 3.21Å; A626-I629 PolarHBondContact O-N 2.8Å; A626-K630 PolarHBondContact O-N 3.35Å
627	N	85.1	Confident	83.1	Confident	33 Å²	33	65 Å²	65	18%	0.176	29%	0.294	C	S	.	.	H	α-helix	trans	-66.9	-36.1	174	-71.1	-30.8	0	0	0	112.3	F623 H624 E625 I629 K630 Y631	F623-N627 WeakPolarHBondContact CD1-ND2 3.14Å; F623-N627 WeakPolarHBondContact CE1-ND2 3.31Å; F623-N627 WeakPolarHBondContact CZ-ND2 3.24Å; F623-N627 WeakPolarHBondContact O-CB 3.19Å; F623-N627 PolarHBondContact O-N 3.2Å; F623-N627 PolarHBondContact O-ND2 2.75Å; H624-N627 WeakPolarHBondContact O-CB 3.49Å; H624-N627 PolarHBondContact O-N 3.2Å; E625-N627 VanDerWaalsContact C-N 3.3Å; E625-N627 PolarHBondContact O-N 3.28Å; N627-I629 VanDerWaalsContact C-N 3.35Å; N627-I629 PolarHBondContact O-N 3.45Å; N627-K630 WeakPolarHBondContact O-CB 3.15Å; N627-K630 PolarHBondContact O-N 2.9Å; N627-Y631 HydrophobicContact CB-CD2 4.43Å; N627-Y631 HydrophobicContact CB-CE2 4.08Å; N627-Y631 WeakPolarHBondContact O-CD2 3.44Å; N627-Y631 PolarHBondContact O-N 3.49Å
628	K	86	Confident	82.5	Confident	12 Å²	12	63.2 Å²	63.2	5%	0.052	29%	0.288	C	S	.	.	H	α-helix	trans	-58.4	-47.7	172.6	-55.9	-177.8	-168.3	174.2	0	111.2	D539 T541 P542 H624 E625 K630 Y631 L632	D539-K628 WeakPolarHBondContact O-CE 3.48Å; D539-K628 PolarHBondContact O-NZ 2.84Å; D539-K628 IonicContact OD2-NZ 3.13Å; D539-K628 PolarHBondContact OD2-NZ 3.1Å; T541-K628 WeakPolarHBondContact O-CD 3.45Å; T541-K628 PolarHBondContact O-NZ 3.37Å; P542-K628 HydrophobicContact CB-CB 3.87Å; H624-K628 WeakPolarHBondContact O-CG 3.46Å; H624-K628 PolarHBondContact O-N 3.39Å; E625-K628 WeakPolarHBondContact O-CB 3.02Å; E625-K628 PolarHBondContact O-N 3.14Å; E625-K628 WeakPolarHBondContact OE1-CD 3.43Å; E625-K628 IonicContact OE1-NZ 3.24Å; E625-K628 PolarHBondContact OE1-NZ 2.92Å; E625-K628 VanDerWaalsContact OE2-CE 3.29Å; E625-K628 WeakPolarHBondContact OE2-CE 3.34Å; E625-K628 IonicContact OE2-NZ 2.62Å; E625-K628 PolarHBondContact OE2-NZ 2.91Å; K628-K630 VanDerWaalsContact C-N 3.3Å; K628-K630 PolarHBondContact O-N 3.41Å; K628-Y631 PolarHBondContact O-N 3.44Å; K628-L632 PolarHBondContact O-N 3.23Å
629	I	80.7	Confident	81.9	Confident	27 Å²	27	66.9 Å²	66.9	14%	0.138	31%	0.307	C	S	.	.	H	α-helix	trans	-60.8	-42.2	178.2	-65.2	164.7	0	0	0	110.2	P542 L544 L547 E625 A626 N627 L632 G633	P542-I629 HydrophobicContact CB-CB 4.34Å; P542-I629 HydrophobicContact CB-CG1 3.61Å; L544-I629 HydrophobicContact CD1-CD1 4.14Å; L547-I629 HydrophobicContact CB-CD1 4.35Å; L547-I629 HydrophobicContact CD2-CD1 3.69Å; E625-I629 PolarHBondContact O-N 3.42Å; A626-I629 PolarHBondContact O-N 2.8Å; N627-I629 VanDerWaalsContact C-N 3.35Å; N627-I629 PolarHBondContact O-N 3.45Å; I629-L632 PolarHBondContact O-N 2.86Å; I629-G633 PolarHBondContact O-N 2.93Å
630	K	78.1	Confident	81.3	Confident	68 Å²	68	62.8 Å²	62.8	30%	0.296	29%	0.29	S	S	.	.	H	α-helix	trans	-61.4	-44.6	174.9	-170.6	-165.7	172.5	-163.8	0	112.4	Y440 A626 N627 K628 G633 L634	Y440-K630 HydrophobicContact CE2-CD 4.09Å; Y440-K630 PolarHBondContact OH-NZ 2.89Å; A626-K630 PolarHBondContact O-N 3.35Å; N627-K630 WeakPolarHBondContact O-CB 3.15Å; N627-K630 PolarHBondContact O-N 2.9Å; K628-K630 VanDerWaalsContact C-N 3.3Å; K628-K630 PolarHBondContact O-N 3.41Å; K630-G633 PolarHBondContact O-N 2.97Å; K630-L634 HydrophobicContact CG-CD1 4.38Å; K630-L634 WeakPolarHBondContact O-CG 3.44Å; K630-L634 PolarHBondContact O-N 3.18Å
631	Y	80.9	Confident	80.9	Confident	149 Å²	149	58.5 Å²	58.5	58%	0.584	28%	0.275	S	S	*	.	H	α-helix	trans	-66.6	-39.7	179.7	-69.2	-53.5	0	0	0	112.2	N627 K628 G633 L634 E635	N627-Y631 HydrophobicContact CB-CD2 4.43Å; N627-Y631 HydrophobicContact CB-CE2 4.08Å; N627-Y631 WeakPolarHBondContact O-CD2 3.44Å; N627-Y631 PolarHBondContact O-N 3.49Å; K628-Y631 PolarHBondContact O-N 3.44Å; Y631-G633 VanDerWaalsContact C-N 3.32Å; Y631-G633 PolarHBondContact O-N 3.1Å; Y631-L634 HydrophobicContact CD1-CD1 4.33Å; Y631-L634 PolarHBondContact O-N 3.4Å; Y631-E635 WeakPolarHBondContact O-CB 3.44Å; Y631-E635 PolarHBondContact O-N 2.83Å
632	L	81	Confident	80.8	Confident	30 Å²	30	55.5 Å²	55.5	16%	0.157	27%	0.268	C	S	.	.	H	α-helix	trans	-60.4	-41.3	170.2	176.1	65.3	0	0	0	111.7	P542 K628 I629 E635 I636 A778 L779	P542-L632 HydrophobicContact CG-CB 4Å; P542-L632 HydrophobicContact CG-CD2 3.51Å; P542-L632 HydrophobicContact CG-CG 4.33Å; K628-L632 PolarHBondContact O-N 3.23Å; I629-L632 PolarHBondContact O-N 2.86Å; L632-E635 PolarHBondContact O-N 2.71Å; L632-I636 HydrophobicContact CD1-CD1 4.02Å; L632-I636 HydrophobicContact CD1-CG1 4.27Å; L632-I636 HydrophobicContact CG-CD1 3.95Å; L632-I636 VanDerWaalsContact O-CG1 3.28Å; L632-I636 WeakPolarHBondContact O-CG1 3.12Å; L632-I636 PolarHBondContact O-N 3.38Å; L632-A778 HydrophobicContact CD1-CB 4.48Å; L632-A778 HydrophobicContact CD2-CB 4.15Å; L632-L779 HydrophobicContact CD2-CD2 3.81Å; L632-L779 HydrophobicContact CD2-CG 4.26Å
633	G	75.1	Confident	80.5	Confident	7 Å²	7	57.7 Å²	57.7	7%	0.072	28%	0.283	C	S	.	.	H	α-helix	trans	-60.3	-45.6	175.6	0	0	0	0	0	112.8	I629 K630 Y631 I636 E637	I629-G633 PolarHBondContact O-N 2.93Å; K630-G633 PolarHBondContact O-N 2.97Å; Y631-G633 VanDerWaalsContact C-N 3.32Å; Y631-G633 PolarHBondContact O-N 3.1Å; G633-I636 PolarHBondContact O-N 2.83Å; G633-E637 PolarHBondContact O-N 3.4Å
634	L	76.3	Confident	80.3	Confident	82 Å²	82	53.4 Å²	53.4	43%	0.429	26%	0.264	S	S	.	.	H	α-helix	trans	-65.5	-38.1	176	-70.3	170.9	0	0	0	112.7	K630 Y631 I636 E637 Y638	K630-L634 HydrophobicContact CG-CD1 4.38Å; K630-L634 WeakPolarHBondContact O-CG 3.44Å; K630-L634 PolarHBondContact O-N 3.18Å; Y631-L634 HydrophobicContact CD1-CD1 4.33Å; Y631-L634 PolarHBondContact O-N 3.4Å; L634-I636 VanDerWaalsContact C-N 3.33Å; L634-E637 PolarHBondContact O-N 3.49Å; L634-Y638 VanDerWaalsContact O-CB 3.26Å; L634-Y638 WeakPolarHBondContact O-CB 3.16Å; L634-Y638 PolarHBondContact O-N 3.05Å
635	E	78.9	Confident	80.2	Confident	115 Å²	115	54.2 Å²	54.2	54%	0.537	27%	0.27	S	S	.	.	H	α-helix	trans	-62.5	-40.5	174	178.4	175.9	-159.2	0	0	111.4	Y631 L632 N639	Y631-E635 WeakPolarHBondContact O-CB 3.44Å; Y631-E635 PolarHBondContact O-N 2.83Å; L632-E635 PolarHBondContact O-N 2.71Å; E635-N639 WeakPolarHBondContact O-CB 3.22Å; E635-N639 VanDerWaalsContact O-CG 3.3Å; E635-N639 PolarHBondContact O-N 2.96Å; E635-N639 PolarHBondContact O-ND2 3.18Å
636	I	75.6	Confident	80.2	Confident	24 Å²	24	58.1 Å²	58.1	12%	0.123	29%	0.294	C	S	.	.	H	α-helix	trans	-66.5	-48.6	175.9	-69.1	168.6	0	0	0	110.8	L632 G633 L634 Y638 N639 E640 P774 L775 A778	L632-I636 HydrophobicContact CD1-CD1 4.02Å; L632-I636 HydrophobicContact CD1-CG1 4.27Å; L632-I636 HydrophobicContact CG-CD1 3.95Å; L632-I636 VanDerWaalsContact O-CG1 3.28Å; L632-I636 WeakPolarHBondContact O-CG1 3.12Å; L632-I636 PolarHBondContact O-N 3.38Å; G633-I636 PolarHBondContact O-N 2.83Å; L634-I636 VanDerWaalsContact C-N 3.33Å; I636-Y638 VanDerWaalsContact C-N 3.31Å; I636-Y638 PolarHBondContact O-N 3.32Å; I636-N639 PolarHBondContact O-N 3.38Å; I636-E640 WeakPolarHBondContact O-CG 3.5Å; I636-E640 PolarHBondContact O-N 3.49Å; I636-P774 HydrophobicContact CG2-CB 3.98Å; I636-L775 HydrophobicContact CD1-CB 4.16Å; I636-A778 HydrophobicContact CD1-CB 3.76Å
637	E	71.7	Confident	80.3	Confident	35 Å²	35	60.2 Å²	60.2	16%	0.164	30%	0.298	C	S	.	.	H	α-helix	trans	-60.5	-39.7	176.9	-70.4	-161.9	124.2	0	0	112.4	G633 L634 E640 L641 R728 T729	G633-E637 PolarHBondContact O-N 3.4Å; L634-E637 PolarHBondContact O-N 3.49Å; E637-E640 PolarHBondContact O-N 3.06Å; E637-L641 VanDerWaalsContact O-CB 3.29Å; E637-L641 WeakPolarHBondContact O-CB 3.44Å; E637-L641 PolarHBondContact O-N 3.28Å; E637-R728 PolarHBondContact OE1-N 2.82Å; E637-T729 WeakPolarHBondContact CG-OG1 3.15Å; E637-T729 WeakPolarHBondContact OE1-CA 3.29Å; E637-T729 WeakPolarHBondContact OE1-CB 3.22Å; E637-T729 PolarHBondContact OE1-N 3.34Å; E637-T729 PolarHBondContact OE1-OG1 3.05Å
638	Y	81.6	Confident	80.2	Confident	161 Å²	161	60.8 Å²	60.8	63%	0.631	30%	0.301	S	S	*	.	H	α-helix	trans	-62.3	-45.5	174.9	174.5	-95.8	0	0	0	112	L634 I636 L641 A642	L634-Y638 VanDerWaalsContact O-CB 3.26Å; L634-Y638 WeakPolarHBondContact O-CB 3.16Å; L634-Y638 PolarHBondContact O-N 3.05Å; I636-Y638 VanDerWaalsContact C-N 3.31Å; I636-Y638 PolarHBondContact O-N 3.32Å; Y638-L641 PolarHBondContact O-N 3.03Å; Y638-A642 VanDerWaalsContact O-CB 3.32Å; Y638-A642 WeakPolarHBondContact O-CB 3.48Å; Y638-A642 PolarHBondContact O-N 2.8Å
639	N	80.5	Confident	80.1	Confident	88 Å²	88	64.9 Å²	64.9	47%	0.471	32%	0.319	S	S	.	.	H	α-helix	trans	-67.4	-36.6	178.9	-77.2	-50.6	0	0	0	112.4	E635 I636 S643	E635-N639 WeakPolarHBondContact O-CB 3.22Å; E635-N639 VanDerWaalsContact O-CG 3.3Å; E635-N639 PolarHBondContact O-N 2.96Å; E635-N639 PolarHBondContact O-ND2 3.18Å; I636-N639 PolarHBondContact O-N 3.38Å; N639-S643 WeakPolarHBondContact O-CB 3.43Å; N639-S643 PolarHBondContact O-N 3.18Å
640	E	76.9	Confident	80.4	Confident	33 Å²	33	68 Å²	68	15%	0.154	33%	0.333	C	S	.	.	H	α-helix	trans	-65.2	-46	172	-72.3	-172.4	-179.3	0	0	111.7	I636 E637 S643 V644 T724 H725 V726 P774	I636-E640 WeakPolarHBondContact O-CG 3.5Å; I636-E640 PolarHBondContact O-N 3.49Å; E637-E640 PolarHBondContact O-N 3.06Å; E640-S643 WeakPolarHBondContact O-CB 3.27Å; E640-S643 PolarHBondContact O-N 2.81Å; E640-S643 VanDerWaalsContact O-N 3.17Å; E640-V644 PolarHBondContact O-N 2.84Å; E640-T724 HydrophobicContact CB-CG2 4.43Å; E640-H725 WeakPolarHBondContact OE2-CA 3.31Å; E640-H725 WeakPolarHBondContact OE2-CB 3.31Å; E640-V726 HydrophobicContact CB-CG2 4.02Å; E640-V726 PolarHBondContact OE2-N 2.86Å; E640-P774 WeakPolarHBondContact OE1-CG 3.25Å
641	L	79.5	Confident	80.6	Confident	74 Å²	74	66 Å²	66	39%	0.387	33%	0.325	S	S	.	.	H	α-helix	trans	-60.7	-46.7	177	175.2	60.4	0	0	0	111.6	E637 Y638 S643 V644 I645 V726	E637-L641 VanDerWaalsContact O-CB 3.29Å; E637-L641 WeakPolarHBondContact O-CB 3.44Å; E637-L641 PolarHBondContact O-N 3.28Å; Y638-L641 PolarHBondContact O-N 3.03Å; L641-S643 VanDerWaalsContact C-N 3.28Å; L641-S643 PolarHBondContact O-N 3.02Å; L641-V644 PolarHBondContact O-N 3Å; L641-V644 VanDerWaalsContact O-N 3.15Å; L641-I645 HydrophobicContact CD1-CD1 3.96Å; L641-I645 HydrophobicContact CD1-CG1 4.25Å; L641-I645 HydrophobicContact CG-CD1 3.9Å; L641-I645 WeakPolarHBondContact O-CG1 3.46Å; L641-I645 PolarHBondContact O-N 3.05Å; L641-V726 HydrophobicContact CB-CG1 4.08Å; L641-V726 HydrophobicContact CB-CG2 4.46Å; L641-V726 HydrophobicContact CD1-CG1 3.85Å
642	A	84.8	Confident	80.7	Confident	33 Å²	33	63.1 Å²	63.1	27%	0.273	32%	0.319	S	S	.	.	H	α-helix	trans	-58.8	-40.2	174.6	0	0	0	0	0	111.6	Y638 V644 I645 V646	Y638-A642 VanDerWaalsContact O-CB 3.32Å; Y638-A642 WeakPolarHBondContact O-CB 3.48Å; Y638-A642 PolarHBondContact O-N 2.8Å; A642-V644 PolarHBondContact O-N 3.07Å; A642-I645 PolarHBondContact O-N 3.32Å; A642-V646 WeakPolarHBondContact O-CG2 3.01Å; A642-V646 PolarHBondContact O-N 3.17Å
643	S	82	Confident	80.7	Confident	48 Å²	48	65.4 Å²	65.4	34%	0.336	33%	0.334	S	S	.	.	H	α-helix	trans	-61.8	-42	174.6	-166.8	0	0	0	0	112.4	N639 E640 L641 K647	N639-S643 WeakPolarHBondContact O-CB 3.43Å; N639-S643 PolarHBondContact O-N 3.18Å; E640-S643 WeakPolarHBondContact O-CB 3.27Å; E640-S643 PolarHBondContact O-N 2.81Å; E640-S643 VanDerWaalsContact O-N 3.17Å; L641-S643 VanDerWaalsContact C-N 3.28Å; L641-S643 PolarHBondContact O-N 3.02Å; S643-K647 WeakPolarHBondContact O-CB 3.1Å; S643-K647 VanDerWaalsContact O-CD 3.31Å; S643-K647 WeakPolarHBondContact O-CD 3.49Å; S643-K647 WeakPolarHBondContact O-CG 3.38Å; S643-K647 PolarHBondContact O-N 3.31Å; S643-K647 WeakPolarHBondContact OG-CE 3.3Å; S643-K647 PolarHBondContact OG-NZ 3.15Å
644	V	78.4	Confident	81	Confident	4 Å²	4	70 Å²	70	2%	0.024	35%	0.352	C	S	.	.	H	α-helix	trans	-64.8	-46	175.1	173.2	0	0	0	0	111.3	E640 L641 A642 V646 K647 I648 T724 V726	E640-V644 PolarHBondContact O-N 2.84Å; L641-V644 PolarHBondContact O-N 3Å; L641-V644 VanDerWaalsContact O-N 3.15Å; A642-V644 PolarHBondContact O-N 3.07Å; V644-V646 VanDerWaalsContact C-N 3.34Å; V644-V646 PolarHBondContact O-N 3.25Å; V644-K647 PolarHBondContact O-N 3.05Å; V644-I648 HydrophobicContact CG1-CD1 3.57Å; V644-I648 HydrophobicContact CG1-CG1 4.18Å; V644-I648 WeakPolarHBondContact O-CB 3.38Å; V644-I648 WeakPolarHBondContact O-CG1 3.27Å; V644-I648 PolarHBondContact O-N 2.76Å; V644-T724 VanDerWaalsContact CG2-CB 3.44Å; V644-T724 HydrophobicContact CG2-CG2 3.58Å; V644-V726 HydrophobicContact CB-CG2 4.27Å; V644-V726 HydrophobicContact CG2-CG2 3.52Å
645	I	83.3	Confident	81.2	Confident	90 Å²	90	66.7 Å²	66.7	46%	0.462	34%	0.336	S	S	.	.	H	α-helix	trans	-59.3	-44.9	179.3	-68.4	166.6	0	0	0	110.9	L641 A642 I648 K649	L641-I645 HydrophobicContact CD1-CD1 3.96Å; L641-I645 HydrophobicContact CD1-CG1 4.25Å; L641-I645 HydrophobicContact CG-CD1 3.9Å; L641-I645 WeakPolarHBondContact O-CG1 3.46Å; L641-I645 PolarHBondContact O-N 3.05Å; A642-I645 PolarHBondContact O-N 3.32Å; I645-I648 PolarHBondContact O-N 2.67Å; I645-K649 WeakPolarHBondContact O-CB 3.29Å; I645-K649 PolarHBondContact O-N 3.35Å
646	V	87.8	Confident	81.2	Confident	82 Å²	82	65.3 Å²	65.3	50%	0.497	33%	0.332	S	S	.	.	H	α-helix	trans	-63.5	-45.9	176.5	172.3	0	0	0	0	111.5	A642 V644 I648 K649 E650	A642-V646 WeakPolarHBondContact O-CG2 3.01Å; A642-V646 PolarHBondContact O-N 3.17Å; V644-V646 VanDerWaalsContact C-N 3.34Å; V644-V646 PolarHBondContact O-N 3.25Å; V646-I648 PolarHBondContact O-N 3.24Å; V646-K649 PolarHBondContact O-N 3.15Å; V646-E650 PolarHBondContact O-N 2.63Å
647	K	82.4	Confident	81.4	Confident	69 Å²	69	74 Å²	74	30%	0.3	36%	0.364	S	S	.	.	H	α-helix	trans	-60.8	-43.6	177.1	-73	161.6	-178	152	0	112.4	S643 V644 E650 L651	S643-K647 WeakPolarHBondContact O-CB 3.1Å; S643-K647 VanDerWaalsContact O-CD 3.31Å; S643-K647 WeakPolarHBondContact O-CD 3.49Å; S643-K647 WeakPolarHBondContact O-CG 3.38Å; S643-K647 PolarHBondContact O-N 3.31Å; S643-K647 WeakPolarHBondContact OG-CE 3.3Å; S643-K647 PolarHBondContact OG-NZ 3.15Å; V644-K647 PolarHBondContact O-N 3.05Å; K647-E650 WeakPolarHBondContact O-CB 3.41Å; K647-E650 PolarHBondContact O-N 2.85Å; K647-L651 WeakPolarHBondContact O-CG 3.42Å; K647-L651 PolarHBondContact O-N 2.9Å
648	I	83.1	Confident	81.7	Confident	45 Å²	45	78.7 Å²	78.7	23%	0.231	39%	0.39	C	S	.	.	H	α-helix	trans	-67.5	-41.6	178.3	-68.8	176.9	0	0	0	110.4	V644 I645 V646 E650 L651 I652 A717	V644-I648 HydrophobicContact CG1-CD1 3.57Å; V644-I648 HydrophobicContact CG1-CG1 4.18Å; V644-I648 WeakPolarHBondContact O-CB 3.38Å; V644-I648 WeakPolarHBondContact O-CG1 3.27Å; V644-I648 PolarHBondContact O-N 2.76Å; I645-I648 PolarHBondContact O-N 2.67Å; V646-I648 PolarHBondContact O-N 3.24Å; I648-E650 VanDerWaalsContact C-N 3.35Å; I648-E650 PolarHBondContact O-N 3.34Å; I648-L651 PolarHBondContact O-N 3.39Å; I648-I652 HydrophobicContact CG2-CD1 3.78Å; I648-I652 HydrophobicContact CG2-CG1 4.41Å; I648-I652 WeakPolarHBondContact O-CG1 3.39Å; I648-I652 PolarHBondContact O-N 2.86Å; I648-A717 HydrophobicContact CD1-CB 4.43Å; I648-A717 HydrophobicContact CG1-CB 4.24Å
649	K	84.4	Confident	80.9	Confident	99 Å²	99	76 Å²	76	43%	0.43	39%	0.386	S	S	.	.	H	α-helix	trans	-57.9	-46.5	172.7	-171.6	172.6	-176.3	174.2	0	111	F39 I645 V646 L651 I652 T653	F39-K649 HydrophobicContact CE1-CD 4.36Å; F39-K649 VanDerWaalsContact CE1-NZ 3.26Å; F39-K649 HydrophobicContact CZ-CD 4.13Å; F39-K649 VanDerWaalsContact CZ-NZ 3.34Å; I645-K649 WeakPolarHBondContact O-CB 3.29Å; I645-K649 PolarHBondContact O-N 3.35Å; V646-K649 PolarHBondContact O-N 3.15Å; K649-L651 PolarHBondContact O-N 2.71Å; K649-I652 PolarHBondContact O-N 2.98Å; K649-T653 WeakPolarHBondContact O-CB 3.27Å; K649-T653 PolarHBondContact O-N 3.21Å; K649-T653 PolarHBondContact O-OG1 2.83Å
650	E	85.3	Confident	79.9	Confident	93 Å²	93	77.5 Å²	77.5	44%	0.435	39%	0.394	S	S	.	.	H	α-helix	trans	-58.3	-43.9	174.2	-83.7	-170.3	-128.8	0	0	113.3	V646 K647 I648 T653 K654	V646-E650 PolarHBondContact O-N 2.63Å; K647-E650 WeakPolarHBondContact O-CB 3.41Å; K647-E650 PolarHBondContact O-N 2.85Å; I648-E650 VanDerWaalsContact C-N 3.35Å; I648-E650 PolarHBondContact O-N 3.34Å; E650-T653 PolarHBondContact O-N 3.13Å; E650-K654 WeakPolarHBondContact O-CB 3.45Å; E650-K654 WeakPolarHBondContact O-CD 3.06Å; E650-K654 WeakPolarHBondContact O-CG 3.45Å; E650-K654 PolarHBondContact O-N 2.84Å; E650-K654 WeakPolarHBondContact OE2-CE 3.35Å; E650-K654 IonicContact OE2-NZ 2.67Å; E650-K654 PolarHBondContact OE2-NZ 2.93Å
651	L	82.8	Confident	78.8	Confident	26 Å²	26	80.4 Å²	80.4	14%	0.136	42%	0.415	C	S	.	.	H	α-helix	trans	-63.8	-43.8	178.4	-71.9	168.1	0	0	0	111.6	K647 I648 K649 K654 A655 Q716 F720	K647-L651 WeakPolarHBondContact O-CG 3.42Å; K647-L651 PolarHBondContact O-N 2.9Å; I648-L651 PolarHBondContact O-N 3.39Å; K649-L651 PolarHBondContact O-N 2.71Å; L651-K654 PolarHBondContact O-N 2.9Å; L651-A655 VanDerWaalsContact O-CB 3.3Å; L651-A655 WeakPolarHBondContact O-CB 3.41Å; L651-A655 PolarHBondContact O-N 3.11Å; L651-Q716 HydrophobicContact CD1-CB 4.38Å; L651-F720 HydrophobicContact CD1-CD2 3.59Å; L651-F720 HydrophobicContact CD1-CE2 3.83Å
652	I	82.2	Confident	77.5	Confident	87 Å²	87	81.3 Å²	81.3	45%	0.446	43%	0.426	S	S	.	.	H	α-helix	trans	-63.6	-47.6	175.9	-66.5	167.5	0	0	0	110.3	I648 K649 K654 A655 L656	I648-I652 HydrophobicContact CG2-CD1 3.78Å; I648-I652 HydrophobicContact CG2-CG1 4.41Å; I648-I652 WeakPolarHBondContact O-CG1 3.39Å; I648-I652 PolarHBondContact O-N 2.86Å; K649-I652 PolarHBondContact O-N 2.98Å; I652-K654 VanDerWaalsContact C-N 3.35Å; I652-K654 PolarHBondContact O-N 3.08Å; I652-A655 PolarHBondContact O-N 3.3Å; I652-L656 HydrophobicContact CG2-CD1 3.87Å; I652-L656 HydrophobicContact CG2-CG 4.33Å; I652-L656 WeakPolarHBondContact O-CB 3.46Å; I652-L656 WeakPolarHBondContact O-CG 3.17Å; I652-L656 PolarHBondContact O-N 2.92Å
653	T	82.7	Confident	75.8	Confident	78 Å²	78	85.9 Å²	85.9	48%	0.479	44%	0.442	S	S	.	.	H	α-helix	trans	-62.7	-39.1	178.2	-57.8	0	0	0	0	112.3	K649 E650 R657	K649-T653 WeakPolarHBondContact O-CB 3.27Å; K649-T653 PolarHBondContact O-N 3.21Å; K649-T653 PolarHBondContact O-OG1 2.83Å; E650-T653 PolarHBondContact O-N 3.13Å; T653-R657 VanDerWaalsContact O-CB 3.27Å; T653-R657 WeakPolarHBondContact O-CB 3.11Å; T653-R657 PolarHBondContact O-N 3.07Å
654	K	81.8	Confident	73.8	Confident	105 Å²	105	90.1 Å²	90.1	46%	0.457	46%	0.46	S	S	.	.	H	α-helix	trans	-66	-42.7	174	-71	162.3	-166.3	170.3	0	111.3	E650 L651 I652 R657 N658	E650-K654 WeakPolarHBondContact O-CB 3.45Å; E650-K654 WeakPolarHBondContact O-CD 3.06Å; E650-K654 WeakPolarHBondContact O-CG 3.45Å; E650-K654 PolarHBondContact O-N 2.84Å; E650-K654 WeakPolarHBondContact OE2-CE 3.35Å; E650-K654 IonicContact OE2-NZ 2.67Å; E650-K654 PolarHBondContact OE2-NZ 2.93Å; L651-K654 PolarHBondContact O-N 2.9Å; I652-K654 VanDerWaalsContact C-N 3.35Å; I652-K654 PolarHBondContact O-N 3.08Å; K654-R657 PolarHBondContact O-N 2.84Å; K654-N658 WeakPolarHBondContact O-CB 3.37Å; K654-N658 PolarHBondContact O-N 3.33Å; K654-N658 PolarHBondContact O-ND2 3.49Å; K654-N658 PolarHBondContact O-OD1 3.44Å
655	A	79.1	Confident	72	Confident	11 Å²	11	96.1 Å²	96.1	9%	0.091	49%	0.486	C	S	.	.	H	α-helix	trans	-62.9	-44.9	176	0	0	0	0	0	112	L651 I652 N658 N659 V713	L651-A655 VanDerWaalsContact O-CB 3.3Å; L651-A655 WeakPolarHBondContact O-CB 3.41Å; L651-A655 PolarHBondContact O-N 3.11Å; I652-A655 PolarHBondContact O-N 3.3Å; A655-N658 PolarHBondContact O-N 2.96Å; A655-N659 PolarHBondContact O-N 3.49Å; A655-N659 PolarHBondContact O-ND2 3.08Å; A655-V713 HydrophobicContact CB-CG1 4.1Å; A655-V713 HydrophobicContact CB-CG2 3.86Å
656	L	78.5	Confident	70	Confident	87 Å²	87	100.2 Å²	100.2	46%	0.455	50%	0.496	S	S	.	.	H	α-helix	trans	-63.6	-48.2	176	-69.5	171.8	0	0	0	111.3	I652 N658 N659 L660	I652-L656 HydrophobicContact CG2-CD1 3.87Å; I652-L656 HydrophobicContact CG2-CG 4.33Å; I652-L656 WeakPolarHBondContact O-CB 3.46Å; I652-L656 WeakPolarHBondContact O-CG 3.17Å; I652-L656 PolarHBondContact O-N 2.92Å; L656-N658 PolarHBondContact O-N 3.45Å; L656-N659 PolarHBondContact O-N 3.3Å; L656-L660 WeakPolarHBondContact O-CD1 3.49Å; L656-L660 PolarHBondContact O-N 3.13Å
657	R	80.6	Confident	67.8	Low	206 Å²	206	105.5 Å²	105.5	78%	0.777	51%	0.508	S	S	*	.	H	α-helix	trans	-61.1	-29.4	178.8	-172.1	174	-176.7	173.8	2.8	113.4	T653 K654	T653-R657 VanDerWaalsContact O-CB 3.27Å; T653-R657 WeakPolarHBondContact O-CB 3.11Å; T653-R657 PolarHBondContact O-N 3.07Å; K654-R657 PolarHBondContact O-N 2.84Å
658	N	77.2	Confident	65.6	Low	133 Å²	133	107.4 Å²	107.4	71%	0.711	52%	0.518	S	S	*	.	H	α-helix	trans	-82.7	-17.2	176.3	-68.4	-6	0	0	0	113.8	K654 A655 L656	K654-N658 WeakPolarHBondContact O-CB 3.37Å; K654-N658 PolarHBondContact O-N 3.33Å; K654-N658 PolarHBondContact O-ND2 3.49Å; K654-N658 PolarHBondContact O-OD1 3.44Å; A655-N658 PolarHBondContact O-N 2.96Å; L656-N658 PolarHBondContact O-N 3.45Å
659	N	66.6	Low	63.7	Low	105 Å²	105	111 Å²	111	56%	0.561	54%	0.537	S	S	*	.	H	α-helix	trans	-109	-12.1	-179.2	-73.4	-74	0	0	0	113.8	A655 L656	A655-N659 PolarHBondContact O-N 3.49Å; A655-N659 PolarHBondContact O-ND2 3.08Å; L656-N659 PolarHBondContact O-N 3.3Å
660	L	59.1	Low	61.7	Low	120 Å²	120	108.8 Å²	108.8	63%	0.628	54%	0.538	S	S	*	.	S	Bend	trans	-67.8	128.4	165.7	-102.1	68.5	0	0	0	109.2	L656	L656-L660 WeakPolarHBondContact O-CD1 3.49Å; L656-L660 PolarHBondContact O-N 3.13Å
661	P	52.9	Low	59.6	Low	93 Å²	93	108.4 Å²	108.4	60%	0.604	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-62.4	147.6	167	29	-34	0	0	0	109.4	E663	P661-E663 PolarHBondContact O-N 3.37Å
662	P	52.5	Low	57.6	Low	94 Å²	94	113.4 Å²	113.4	61%	0.61	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-59.7	140.1	175.8	25.2	-33.7	0	0	0	110.9	N664	P662-N664 PolarHBondContact O-N 2.73Å
663	E	48.5	Very low	55.4	Low	129 Å²	129	116.7 Å²	116.7	60%	0.603	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-57.6	-5.2	-174.1	-90.5	-90.1	137.5	0	0	115.5	P661 F665 R666	P661-E663 PolarHBondContact O-N 3.37Å; E663-F665 PolarHBondContact O-N 3.42Å; E663-F665 VanDerWaalsContact O-N 3.09Å; E663-R666 VanDerWaalsContact CD-CD 3.43Å; E663-R666 PolarHBondContact O-N 3.19Å; E663-R666 VanDerWaalsContact OE1-CD 3.28Å; E663-R666 WeakPolarHBondContact OE1-CD 3.31Å; E663-R666 IonicContact OE1-CZ 3.88Å; E663-R666 IonicContact OE1-NH1 2.93Å; E663-R666 PolarHBondContact OE1-NH1 3.41Å; E663-R666 WeakPolarHBondContact OE2-CD 3.34Å; E663-R666 IonicContact OE2-NE 3.94Å; E663-R666 IonicContact OE2-NH1 3.36Å; E663-R666 PolarHBondContact OE2-NH1 3.27Å
664	N	41.4	Very low	53.3	Low	137 Å²	137	120.9 Å²	120.9	73%	0.733	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-58.5	-21	177.5	-67.6	0.9	0	0	0	114.1	P662 R666	P662-N664 PolarHBondContact O-N 2.73Å; N664-R666 VanDerWaalsContact C-N 3.32Å; N664-R666 PolarHBondContact O-N 3.07Å
665	F	39.9	Very low	51	Low	129 Å²	129	124.8 Å²	124.8	57%	0.566	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-76.9	-7.6	-179.9	-92.5	-70.7	0	0	0	115.6	E663 Y667 E668	E663-F665 PolarHBondContact O-N 3.42Å; E663-F665 VanDerWaalsContact O-N 3.09Å; F665-Y667 VanDerWaalsContact C-N 3.25Å; F665-Y667 PolarHBondContact O-N 2.92Å; F665-E668 HydrophobicContact CD1-CB 4.42Å; F665-E668 PolarHBondContact O-N 2.96Å
666	R	41.4	Very low	48.9	Very low	177 Å²	177	133.6 Å²	133.6	67%	0.668	65%	0.645	S	S	*	*	G	3₁₀ helix	trans	-72.5	-12.4	-179	-69.9	179.5	86.8	158.9	0.1	114.9	E663 N664	E663-R666 VanDerWaalsContact CD-CD 3.43Å; E663-R666 PolarHBondContact O-N 3.19Å; E663-R666 VanDerWaalsContact OE1-CD 3.28Å; E663-R666 WeakPolarHBondContact OE1-CD 3.31Å; E663-R666 IonicContact OE1-CZ 3.88Å; E663-R666 IonicContact OE1-NH1 2.93Å; E663-R666 PolarHBondContact OE1-NH1 3.41Å; E663-R666 WeakPolarHBondContact OE2-CD 3.34Å; E663-R666 IonicContact OE2-NE 3.94Å; E663-R666 IonicContact OE2-NH1 3.36Å; E663-R666 PolarHBondContact OE2-NH1 3.27Å; N664-R666 VanDerWaalsContact C-N 3.32Å; N664-R666 PolarHBondContact O-N 3.07Å
667	Y	41.4	Very low	46.8	Very low	192 Å²	192	137.8 Å²	137.8	75%	0.753	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.7	-19.7	175.6	-77.9	-80.9	0	0	0	114.5	F665 S671	F665-Y667 VanDerWaalsContact C-N 3.25Å; F665-Y667 PolarHBondContact O-N 2.92Å; Y667-S671 WeakPolarHBondContact O-CB 3.35Å; Y667-S671 PolarHBondContact O-N 3.5Å; Y667-S671 PolarHBondContact O-OG 3.07Å
668	E	36.9	Very low	44.5	Very low	109 Å²	109	133.1 Å²	133.1	51%	0.509	66%	0.663	S	S	.	*	H	α-helix	trans	-88.9	-30.1	-170.9	-156.7	154.3	-142.4	0	0	113.5	F665 Q672	F665-E668 HydrophobicContact CD1-CB 4.42Å; F665-E668 PolarHBondContact O-N 2.96Å; E668-Q672 WeakPolarHBondContact O-CG 3.45Å; E668-Q672 PolarHBondContact O-N 2.98Å
669	L	42.9	Very low	42.3	Very low	120 Å²	120	135.4 Å²	135.4	63%	0.628	67%	0.67	S	S	*	*	H	α-helix	trans	-72.5	-38.4	170.2	-106.1	68.8	0	0	0	112.8	S671 Q672 Q673	L669-S671 VanDerWaalsContact C-N 3.28Å; L669-S671 PolarHBondContact O-N 2.94Å; L669-Q672 PolarHBondContact O-N 3.44Å; L669-Q673 PolarHBondContact O-N 2.89Å
670	A	42.2	Very low	40.8	Very low	54 Å²	54	137.3 Å²	137.3	45%	0.446	68%	0.68	S	S	.	*	H	α-helix	trans	-63.2	-36.6	175	0	0	0	0	0	111.7	Q672	A670-Q672 VanDerWaalsContact C-N 3.33Å; A670-Q672 PolarHBondContact O-N 2.98Å
671	S	42	Very low	39.6	Very low	85 Å²	85	140.4 Å²	140.4	59%	0.594	69%	0.691	S	S	*	*	H	α-helix	trans	-69.7	-26.5	177.3	-60.4	0	0	0	0	113.5	Y667 L669	Y667-S671 WeakPolarHBondContact O-CB 3.35Å; Y667-S671 PolarHBondContact O-N 3.5Å; Y667-S671 PolarHBondContact O-OG 3.07Å; L669-S671 VanDerWaalsContact C-N 3.28Å; L669-S671 PolarHBondContact O-N 2.94Å
672	Q	39.3	Very low	38.4	Very low	130 Å²	130	144 Å²	144	61%	0.607	70%	0.704	S	S	*	*	H	α-helix	trans	-84.2	-27.9	178.1	-71.3	-179.4	14.3	0	0	113.5	E668 L669 A670 H674 F675	E668-Q672 WeakPolarHBondContact O-CG 3.45Å; E668-Q672 PolarHBondContact O-N 2.98Å; L669-Q672 PolarHBondContact O-N 3.44Å; A670-Q672 VanDerWaalsContact C-N 3.33Å; A670-Q672 PolarHBondContact O-N 2.98Å; Q672-H674 PolarHBondContact O-N 2.94Å; Q672-F675 PolarHBondContact O-N 3.25Å
673	Q	37.4	Very low	37.5	Very low	156 Å²	156	147.2 Å²	147.2	73%	0.729	72%	0.716	S	S	*	*	H	α-helix	trans	-67.8	-23.6	175	-73.7	-175	-24.6	0	0	113.1	L669 F675	L669-Q673 PolarHBondContact O-N 2.89Å; Q673-F675 VanDerWaalsContact C-N 3.25Å; Q673-F675 PolarHBondContact O-N 3.3Å
674	H	37.7	Very low	37	Very low	166 Å²	166	150.2 Å²	150.2	77%	0.769	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	-7.1	178.1	-107.9	-74.6	0	0	0	115.4	Q672	Q672-H674 PolarHBondContact O-N 2.94Å
675	F	33.7	Very low	36.6	Very low	187 Å²	187	150 Å²	150	82%	0.82	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-0.9	179.8	-141.7	-94.8	0	0	0	114.3	Q672 Q673	Q672-F675 PolarHBondContact O-N 3.25Å; Q673-F675 VanDerWaalsContact C-N 3.25Å; Q673-F675 PolarHBondContact O-N 3.3Å
676	Y	34.6	Very low	36.2	Very low	197 Å²	197	150.4 Å²	150.4	77%	0.773	74%	0.739	S	S	*	*	S	Bend	trans	-103.7	15.3	-176.4	-96.9	-85.1	0	0	0	115.2
677	M	33.7	Very low	35.8	Very low	174 Å²	174	150.3 Å²	150.3	86%	0.857	75%	0.75	S	S	*	*	S	Bend	trans	-120.2	42.7	178.4	-73.6	-78.7	98.6	0	0	112.7
678	S	32.5	Very low	35.2	Very low	108 Å²	108	146.1 Å²	146.1	76%	0.755	75%	0.749	S	S	*	*			trans	-134.8	34.8	173.3	-170.3	0	0	0	0	113	N680	S678-N680 VanDerWaalsContact C-N 3.28Å; S678-N680 PolarHBondContact O-N 2.8Å
679	E	31.5	Very low	35.1	Very low	181 Å²	181	146.3 Å²	146.3	85%	0.846	76%	0.763	S	S	*	*			trans	-69.9	85.6	164.2	-72.1	-163.5	136.2	0	0	110.2
680	N	34.4	Very low	34.6	Very low	145 Å²	145	145.3 Å²	145.3	78%	0.775	77%	0.766	S	S	*	*			trans	-161.6	131.4	153.8	-110.8	-65.4	0	0	0	112.3	S678	S678-N680 VanDerWaalsContact C-N 3.28Å; S678-N680 PolarHBondContact O-N 2.8Å
681	Q	33.7	Very low	34.2	Very low	186 Å²	186	147.2 Å²	147.2	87%	0.869	78%	0.776	S	S	*	*			trans	64.6	77.4	167.7	-54.8	-164.8	88.7	0	0	118.1
682	L	29.3	Very low	33.9	Very low	167 Å²	167	151.6 Å²	151.6	87%	0.874	79%	0.787	S	S	*	*			trans	-131	121.2	141.7	-161.1	76.4	0	0	0	109.4
683	N	33.5	Very low	33.7	Very low	162 Å²	162	150.3 Å²	150.3	87%	0.866	80%	0.798	S	S	*	*			trans	-163	141.5	173.4	-117.1	-38.4	0	0	0	110.4
684	K	36.5	Very low	33.3	Very low	193 Å²	193	146.6 Å²	146.6	84%	0.839	80%	0.802	S	S	*	*			trans	66.6	140.5	-155	-60.1	-176.7	173.4	-179	0	112.8
685	V	35	Very low	33	Very low	132 Å²	132	144.5 Å²	144.5	80%	0.8	81%	0.806	S	S	*	*			cis	-123.9	150.6	6.3	179.8	0	0	0	0	110.3
686	D	31.1	Very low	32.8	Very low	138 Å²	138	144 Å²	144	74%	0.738	81%	0.81	S	S	*	*			trans	-65.3	149.1	178.1	-43.7	-101.3	0	0	0	114.4
687	L	31.4	Very low	32.6	Very low	174 Å²	174	140.2 Å²	140.2	91%	0.911	81%	0.812	S	S	*	*				-159	163.5	115.9	-127.7	67.3	0	0	0	111.4
688	S	30.7	Very low	32.3	Very low	104 Å²	104	139.8 Å²	139.8	73%	0.727	81%	0.813	S	S	*	*			trans	-110.7	170.5	-151	57	0	0	0	0	116.8
689	S	34.7	Very low	32.5	Very low	114 Å²	114	139.4 Å²	139.4	80%	0.797	82%	0.816	S	S	*	*			trans	85.1	135.3	170.7	75.9	0	0	0	0	116.8
690	S	31.7	Very low	32.7	Very low	98 Å²	98	139.3 Å²	139.3	69%	0.685	82%	0.816	S	S	*	*			cis	-165.7	138.6	-11.9	48.2	0	0	0	0	113.4
691	S	33.4	Very low	32.3	Very low	95 Å²	95	138.6 Å²	138.6	66%	0.664	82%	0.822	S	S	*	*			trans	62	148.7	143.6	74	0	0	0	0	119.7
692	H	35.6	Very low	32.2	Very low	176 Å²	176	135.3 Å²	135.3	82%	0.815	82%	0.815	S	S	*	*			cis	-145.4	151.8	15.2	-101.5	-67.6	0	0	0	112.8
693	A	35.6	Very low	32.2	Very low	103 Å²	103	133.5 Å²	133.5	85%	0.851	81%	0.811	S	S	*	*			trans	47.5	124.3	143.6	0	0	0	0	0	121.7
694	G	28.1	Very low	32.3	Very low	79 Å²	79	135 Å²	135	81%	0.814	81%	0.809	S	S	*	*			trans	-143.1	154	152.6	0	0	0	0	0	110.5
695	S	32.8	Very low	32	Very low	122 Å²	122	133.3 Å²	133.3	85%	0.853	81%	0.808	S	S	*	*			trans	-141.7	130.7	169.1	55.5	0	0	0	0	109.5
696	I	28.4	Very low	31.9	Very low	175 Å²	175	136.1 Å²	136.1	90%	0.897	81%	0.81	S	S	*	*			trans	-98	141.1	-172.5	-62.3	170.2	0	0	0	109.4
697	S	31.3	Very low	32.1	Very low	118 Å²	118	135.2 Å²	135.2	83%	0.825	81%	0.812	S	S	*	*			trans	-136.7	151.9	160.6	-167.6	0	0	0	0	110.2
698	L	28.2	Very low	32.4	Very low	166 Å²	166	133.8 Å²	133.8	87%	0.869	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-89.3	124.2	-160.9	-160	69.7	0	0	0	111.6
699	A	34.8	Very low	33.1	Very low	99 Å²	99	133.2 Å²	133.2	82%	0.818	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-91.4	141.8	-179.8	0	0	0	0	0	112.5
700	Q	36.8	Very low	33.6	Very low	180 Å²	180	132 Å²	132	84%	0.841	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-77.8	153.8	-176.1	-66.8	164.2	-60.1	0	0	112.8	T702	Q700-T702 PolarHBondContact O-N 3.46Å; Q700-T702 VanDerWaalsContact O-N 3.15Å
701	S	25.9	Very low	34.6	Very low	129 Å²	129	129 Å²	129	90%	0.902	77%	0.769	S	S	*	*			trans	-68.3	107.8	175	-172.8	0	0	0	0	111
702	T	31.5	Very low	36.3	Very low	118 Å²	118	127.9 Å²	127.9	72%	0.724	76%	0.761	S	S	*	*			trans	-102.9	127.3	172.1	46.4	0	0	0	0	110.5	Q700 K704	Q700-T702 PolarHBondContact O-N 3.46Å; Q700-T702 VanDerWaalsContact O-N 3.15Å; T702-K704 PolarHBondContact O-N 3.05Å
703	V	30	Very low	37.8	Very low	129 Å²	129	120.9 Å²	120.9	78%	0.782	73%	0.731	S	S	*	*			trans	-59.5	125.6	172.2	175.7	0	0	0	0	108.6	L705	V703-L705 PolarHBondContact O-N 3.48Å
704	K	34.4	Very low	39.5	Very low	194 Å²	194	123.1 Å²	123.1	84%	0.843	72%	0.722	S	S	*	*			trans	-72	79.6	176.2	-70.5	-176	179.5	177.8	0	110.7	T702 F706	T702-K704 PolarHBondContact O-N 3.05Å; K704-F706 PolarHBondContact O-N 3.43Å
705	L	31.7	Very low	41.7	Very low	156 Å²	156	126.6 Å²	126.6	82%	0.817	71%	0.714	S	S	*	*			trans	-53	121.2	160.1	-78.4	162.6	0	0	0	108.4	V703 P707	V703-L705 PolarHBondContact O-N 3.48Å; L705-P707 WeakPolarHBondContact O-CD 3.34Å
706	F	32.5	Very low	43.4	Very low	192 Å²	192	125.1 Å²	125.1	84%	0.842	69%	0.694	S	S	*	*			trans	-61.3	121.1	179.1	-79.4	-91.6	0	0	0	109.5	K704 N708	K704-F706 PolarHBondContact O-N 3.43Å; F706-N708 PolarHBondContact O-N 3.32Å; F706-N708 VanDerWaalsContact O-N 3.12Å
707	P	35.3	Very low	45.4	Very low	118 Å²	118	117.7 Å²	117.7	77%	0.766	66%	0.658	S	S	*	*			trans	-71.9	111.9	-173	27.6	-33.9	0	0	0	110.6	L705	L705-P707 WeakPolarHBondContact O-CD 3.34Å
708	N	36.5	Very low	47.3	Very low	145 Å²	145	115.3 Å²	115.3	78%	0.775	64%	0.636	S	S	*	*			trans	43.4	82.3	165.2	-68.3	-33.7	0	0	0	115.7	F706 S710	F706-N708 PolarHBondContact O-N 3.32Å; F706-N708 VanDerWaalsContact O-N 3.12Å; N708-S710 PolarHBondContact O-N 2.86Å
709	I	46	Very low	49.4	Very low	91 Å²	91	112 Å²	112	47%	0.467	62%	0.619	S	S	.	*			trans	-64.5	85.6	145.5	-58.9	-179.8	0	0	0	106.1	V713	I709-V713 HydrophobicContact CG2-CB 4.25Å; I709-V713 HydrophobicContact CG2-CG2 3.98Å
710	S	45.7	Very low	50.9	Low	89 Å²	89	111 Å²	111	62%	0.622	60%	0.596	S	S	*	*			trans	-56.9	148.2	-167.7	-172.1	0	0	0	0	111.2	N708 S712	N708-S710 PolarHBondContact O-N 2.86Å; S710-S712 PolarHBondContact O-N 2.82Å; S710-S712 PolarHBondContact O-OG 2.78Å
711	G	53	Low	52.3	Low	35 Å²	35	108.1 Å²	108.1	36%	0.361	58%	0.578	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.7	6.4	-157.6	0	0	0	0	0	117.8	K715	G711-K715 VanDerWaalsContact O-CB 3.23Å; G711-K715 WeakPolarHBondContact O-CB 3.42Å; G711-K715 WeakPolarHBondContact O-CG 3.31Å; G711-K715 PolarHBondContact O-N 3.34Å
712	S	67.4	Low	54.2	Low	71 Å²	71	108 Å²	108	50%	0.497	56%	0.563	S	S	.	*	H	α-helix	trans	-61.6	-43.1	170.9	57.2	0	0	0	0	112.5	S710 K715 Q716	S710-S712 PolarHBondContact O-N 2.82Å; S710-S712 PolarHBondContact O-OG 2.78Å; S712-K715 PolarHBondContact O-N 2.84Å; S712-Q716 WeakPolarHBondContact O-CB 3.15Å; S712-Q716 VanDerWaalsContact O-CG 3.28Å; S712-Q716 WeakPolarHBondContact O-CG 3.31Å; S712-Q716 PolarHBondContact O-N 3.45Å
713	V	67.4	Low	55.8	Low	30 Å²	30	106.3 Å²	106.3	18%	0.182	55%	0.553	C	S	.	*	H	α-helix	trans	-67.7	-44.1	-178.6	-174.6	0	0	0	0	110.9	A655 I709 Q716 A717	A655-V713 HydrophobicContact CB-CG1 4.1Å; A655-V713 HydrophobicContact CB-CG2 3.86Å; I709-V713 HydrophobicContact CG2-CB 4.25Å; I709-V713 HydrophobicContact CG2-CG2 3.98Å; V713-Q716 PolarHBondContact O-N 2.96Å; V713-A717 WeakPolarHBondContact O-CB 3.31Å; V713-A717 PolarHBondContact O-N 2.99Å
714	F	72.5	Confident	57.2	Low	149 Å²	149	101.4 Å²	101.4	65%	0.654	52%	0.524	S	S	*	.	H	α-helix	trans	-64.5	-45.1	175.3	-176.5	-96.4	0	0	0	111.8	Q716 A717 L718	F714-Q716 VanDerWaalsContact C-N 3.31Å; F714-Q716 PolarHBondContact O-N 3.39Å; F714-A717 PolarHBondContact O-N 3.42Å; F714-L718 HydrophobicContact CE1-CD2 4.38Å; F714-L718 WeakPolarHBondContact O-CB 3.02Å; F714-L718 PolarHBondContact O-N 3.03Å
715	K	72.9	Confident	58.2	Low	153 Å²	153	96.3 Å²	96.3	67%	0.665	50%	0.503	S	S	*	.	H	α-helix	trans	-62	-36.1	174.8	-75.5	175.6	178.8	-175.2	0	112.5	G711 S712 L719	G711-K715 VanDerWaalsContact O-CB 3.23Å; G711-K715 WeakPolarHBondContact O-CB 3.42Å; G711-K715 WeakPolarHBondContact O-CG 3.31Å; G711-K715 PolarHBondContact O-N 3.34Å; S712-K715 PolarHBondContact O-N 2.84Å; K715-L719 WeakPolarHBondContact O-CB 3.37Å; K715-L719 PolarHBondContact O-N 3.07Å
716	Q	68.7	Low	59	Low	91 Å²	91	89.6 Å²	89.6	43%	0.425	47%	0.468	S	S	.	.	H	α-helix	trans	-67.4	-47.4	173.5	-77.9	175.8	1	0	0	111.5	L651 S712 V713 F714 L718 L719 F720	L651-Q716 HydrophobicContact CD1-CB 4.38Å; S712-Q716 WeakPolarHBondContact O-CB 3.15Å; S712-Q716 VanDerWaalsContact O-CG 3.28Å; S712-Q716 WeakPolarHBondContact O-CG 3.31Å; S712-Q716 PolarHBondContact O-N 3.45Å; V713-Q716 PolarHBondContact O-N 2.96Å; F714-Q716 VanDerWaalsContact C-N 3.31Å; F714-Q716 PolarHBondContact O-N 3.39Å; Q716-L718 VanDerWaalsContact C-N 3.34Å; Q716-L718 PolarHBondContact O-N 2.98Å; Q716-L719 PolarHBondContact O-N 2.88Å; Q716-F720 WeakPolarHBondContact O-CD2 3.3Å; Q716-F720 PolarHBondContact O-N 3.09Å
717	A	70.5	Confident	59.7	Low	18 Å²	18	84.7 Å²	84.7	15%	0.149	45%	0.454	C	S	.	.	H	α-helix	trans	-60.6	-42.7	177.6	0	0	0	0	0	112.1	I648 V713 F714 F720 Y721	I648-A717 HydrophobicContact CD1-CB 4.43Å; I648-A717 HydrophobicContact CG1-CB 4.24Å; V713-A717 WeakPolarHBondContact O-CB 3.31Å; V713-A717 PolarHBondContact O-N 2.99Å; F714-A717 PolarHBondContact O-N 3.42Å; A717-F720 PolarHBondContact O-N 2.85Å; A717-Y721 WeakPolarHBondContact O-CB 3.5Å; A717-Y721 PolarHBondContact O-N 2.91Å
718	L	72.1	Confident	60.3	Low	68 Å²	68	85.6 Å²	85.6	36%	0.356	44%	0.442	S	S	.	.	H	α-helix	trans	-63.4	-47.7	174.1	-176.8	62.3	0	0	0	111.5	F714 Q716 F720 Y721 E722	F714-L718 HydrophobicContact CE1-CD2 4.38Å; F714-L718 WeakPolarHBondContact O-CB 3.02Å; F714-L718 PolarHBondContact O-N 3.03Å; Q716-L718 VanDerWaalsContact C-N 3.34Å; Q716-L718 PolarHBondContact O-N 2.98Å; L718-F720 VanDerWaalsContact C-N 3.3Å; L718-F720 PolarHBondContact O-N 3.22Å; L718-Y721 WeakPolarHBondContact O-CB 3.36Å; L718-Y721 PolarHBondContact O-N 3.46Å; L718-Y721 VanDerWaalsContact O-N 3.1Å; L718-E722 HydrophobicContact CD1-CG 4.18Å; L718-E722 HydrophobicContact CG-CG 4.38Å; L718-E722 WeakPolarHBondContact O-CB 3.36Å; L718-E722 WeakPolarHBondContact O-CG 3.3Å; L718-E722 PolarHBondContact O-N 3.45Å
719	L	71.2	Confident	60.3	Low	97 Å²	97	79.8 Å²	79.8	51%	0.508	41%	0.412	S	S	.	.	H	α-helix	trans	-58	-41.4	175.3	-175	75.1	0	0	0	111.7	K715 Q716 E722 T723	K715-L719 WeakPolarHBondContact O-CB 3.37Å; K715-L719 PolarHBondContact O-N 3.07Å; Q716-L719 PolarHBondContact O-N 2.88Å; L719-E722 PolarHBondContact O-N 3.37Å; L719-T723 HydrophobicContact CD1-CG2 4.13Å; L719-T723 HydrophobicContact CG-CG2 4.27Å; L719-T723 VanDerWaalsContact O-CB 3.28Å; L719-T723 WeakPolarHBondContact O-CB 3.48Å; L719-T723 VanDerWaalsContact O-CG2 3.26Å; L719-T723 WeakPolarHBondContact O-CG2 3.33Å; L719-T723 PolarHBondContact O-N 3.5Å; L719-T723 PolarHBondContact O-OG1 2.87Å
720	F	67.2	Low	59.9	Low	77 Å²	77	79.3 Å²	79.3	34%	0.338	42%	0.421	S	S	.	.	H	α-helix	trans	-68.4	-33.8	176.4	-80.9	-62.8	0	0	0	113.1	L651 Q716 A717 L718 T724	L651-F720 HydrophobicContact CD1-CD2 3.59Å; L651-F720 HydrophobicContact CD1-CE2 3.83Å; Q716-F720 WeakPolarHBondContact O-CD2 3.3Å; Q716-F720 PolarHBondContact O-N 3.09Å; A717-F720 PolarHBondContact O-N 2.85Å; L718-F720 VanDerWaalsContact C-N 3.3Å; L718-F720 PolarHBondContact O-N 3.22Å; F720-T724 VanDerWaalsContact O-CB 3.29Å; F720-T724 WeakPolarHBondContact O-CB 3.36Å; F720-T724 PolarHBondContact O-N 3Å; F720-T724 VanDerWaalsContact O-N 3.08Å; F720-T724 PolarHBondContact O-OG1 3.48Å
721	Y	65.1	Low	59.6	Low	120 Å²	120	80.4 Å²	80.4	47%	0.471	42%	0.417	S	S	.	.	H	α-helix	trans	-68.2	-45.8	172.9	177.7	-96.2	0	0	0	111.6	A717 L718 T724	A717-Y721 WeakPolarHBondContact O-CB 3.5Å; A717-Y721 PolarHBondContact O-N 2.91Å; L718-Y721 WeakPolarHBondContact O-CB 3.36Å; L718-Y721 PolarHBondContact O-N 3.46Å; L718-Y721 VanDerWaalsContact O-N 3.1Å; Y721-T724 VanDerWaalsContact O-O 3.05Å
722	E	67	Low	58.9	Low	126 Å²	126	83.1 Å²	83.1	59%	0.589	42%	0.416	S	S	*	.	H	α-helix	trans	-70.4	-32.8	179.6	-69.2	172.8	168.9	0	0	113.2	L718 L719	L718-E722 HydrophobicContact CD1-CG 4.18Å; L718-E722 HydrophobicContact CG-CG 4.38Å; L718-E722 WeakPolarHBondContact O-CB 3.36Å; L718-E722 WeakPolarHBondContact O-CG 3.3Å; L718-E722 PolarHBondContact O-N 3.45Å; L719-E722 PolarHBondContact O-N 3.37Å
723	T	65	Low	57.8	Low	83 Å²	83	83.2 Å²	83.2	51%	0.509	41%	0.41	S	S	.	.	H	α-helix	trans	-87.8	-23.6	-179.5	56.4	0	0	0	0	114.3	L719	L719-T723 HydrophobicContact CD1-CG2 4.13Å; L719-T723 HydrophobicContact CG-CG2 4.27Å; L719-T723 VanDerWaalsContact O-CB 3.28Å; L719-T723 WeakPolarHBondContact O-CB 3.48Å; L719-T723 VanDerWaalsContact O-CG2 3.26Å; L719-T723 WeakPolarHBondContact O-CG2 3.33Å; L719-T723 PolarHBondContact O-N 3.5Å; L719-T723 PolarHBondContact O-OG1 2.87Å
724	T	58.6	Low	56.6	Low	26 Å²	26	85.4 Å²	85.4	16%	0.16	42%	0.42	C	S	.	.	S	Bend	trans	-86.2	135.8	171.7	-45.2	0	0	0	0	109.1	E640 V644 F720 Y721 V726	E640-T724 HydrophobicContact CB-CG2 4.43Å; V644-T724 VanDerWaalsContact CG2-CB 3.44Å; V644-T724 HydrophobicContact CG2-CG2 3.58Å; F720-T724 VanDerWaalsContact O-CB 3.29Å; F720-T724 WeakPolarHBondContact O-CB 3.36Å; F720-T724 PolarHBondContact O-N 3Å; F720-T724 VanDerWaalsContact O-N 3.08Å; F720-T724 PolarHBondContact O-OG1 3.48Å; Y721-T724 VanDerWaalsContact O-O 3.05Å; T724-V726 HydrophobicContact CG2-CG2 4.08Å; T724-V726 PolarHBondContact O-N 3.33Å
725	H	54.9	Low	55.4	Low	88 Å²	88	83.9 Å²	83.9	41%	0.407	42%	0.417	S	S	.	.			trans	-79.8	24.2	-166.8	-65.5	-18.2	0	0	0	116.1	E640 T727	E640-H725 WeakPolarHBondContact OE2-CA 3.31Å; E640-H725 WeakPolarHBondContact OE2-CB 3.31Å; H725-T727 PolarHBondContact O-N 3.44Å
726	V	50.3	Low	53.9	Low	15 Å²	15	77.8 Å²	77.8	9%	0.091	39%	0.392	C	S	.	.			trans	-50.9	129.4	175.5	179.4	0	0	0	0	110.6	E640 L641 V644 T724	E640-V726 HydrophobicContact CB-CG2 4.02Å; E640-V726 PolarHBondContact OE2-N 2.86Å; L641-V726 HydrophobicContact CB-CG1 4.08Å; L641-V726 HydrophobicContact CB-CG2 4.46Å; L641-V726 HydrophobicContact CD1-CG1 3.85Å; V644-V726 HydrophobicContact CB-CG2 4.27Å; V644-V726 HydrophobicContact CG2-CG2 3.52Å; T724-V726 HydrophobicContact CG2-CG2 4.08Å; T724-V726 PolarHBondContact O-N 3.33Å
727	T	45.8	Very low	52.8	Low	88 Å²	88	76.1 Å²	76.1	54%	0.54	39%	0.388	S	S	.	.	S	Bend	trans	52	83.7	178	49.9	0	0	0	0	114.4	H725	H725-T727 PolarHBondContact O-N 3.44Å
728	R	47.5	Very low	51.6	Low	138 Å²	138	77.9 Å²	77.9	52%	0.521	40%	0.395	S	S	.	.			trans	-152.5	7	137.2	-125.3	-173.4	173.8	160.5	5.6	114.3	E637 A730 E731 R732	E637-R728 PolarHBondContact OE1-N 2.82Å; R728-A730 PolarHBondContact O-N 3.22Å; R728-A730 VanDerWaalsContact O-N 3.13Å; R728-E731 HydrophobicContact CG-CB 4.22Å; R728-E731 IonicContact CZ-OE2 2.83Å; R728-E731 VanDerWaalsContact CZ-OE2 3.24Å; R728-E731 IonicContact NE-OE2 2.92Å; R728-E731 PolarHBondContact NE-OE2 3.29Å; R728-E731 IonicContact NH2-OE2 3.75Å; R728-E731 PolarHBondContact NH2-OE2 3.38Å; R728-E731 CarbonylContact O-C 3.51Å; R728-E731 WeakPolarHBondContact O-CA 3.39Å; R728-E731 PolarHBondContact O-N 3.32Å; R728-R732 HydrophobicContact CB-CG 4.01Å; R728-R732 WeakPolarHBondContact O-CB 3.26Å; R728-R732 PolarHBondContact O-N 2.9Å
729	T	37.5	Very low	50.2	Low	23 Å²	23	77 Å²	77	14%	0.141	39%	0.389	C	S	.	.	H	α-helix	trans	-64.6	-26.4	-164.6	-47.1	0	0	0	0	113.3	E637 M733 L775	E637-T729 WeakPolarHBondContact CG-OG1 3.15Å; E637-T729 WeakPolarHBondContact OE1-CA 3.29Å; E637-T729 WeakPolarHBondContact OE1-CB 3.22Å; E637-T729 PolarHBondContact OE1-N 3.34Å; E637-T729 PolarHBondContact OE1-OG1 3.05Å; T729-M733 VanDerWaalsContact O-CB 3.32Å; T729-M733 WeakPolarHBondContact O-CB 3.5Å; T729-M733 WeakPolarHBondContact O-CG 3.48Å; T729-M733 PolarHBondContact O-N 2.93Å; T729-L775 HydrophobicContact CG2-CD1 3.77Å
730	A	36.9	Very low	49.1	Very low	80 Å²	80	73.4 Å²	73.4	66%	0.661	37%	0.371	S	S	*	.	H	α-helix	trans	-65.1	-38	169.2	0	0	0	0	0	113.9	R728	R728-A730 PolarHBondContact O-N 3.22Å; R728-A730 VanDerWaalsContact O-N 3.13Å
731	E	39.6	Very low	48.1	Very low	113 Å²	113	70.4 Å²	70.4	53%	0.528	36%	0.358	S	S	.	.	H	α-helix	trans	-90.1	-23.2	176.5	-51.8	-174.1	152.3	0	0	112.5	R728	R728-E731 HydrophobicContact CG-CB 4.22Å; R728-E731 IonicContact CZ-OE2 2.83Å; R728-E731 VanDerWaalsContact CZ-OE2 3.24Å; R728-E731 IonicContact NE-OE2 2.92Å; R728-E731 PolarHBondContact NE-OE2 3.29Å; R728-E731 IonicContact NH2-OE2 3.75Å; R728-E731 PolarHBondContact NH2-OE2 3.38Å; R728-E731 CarbonylContact O-C 3.51Å; R728-E731 WeakPolarHBondContact O-CA 3.39Å; R728-E731 PolarHBondContact O-N 3.32Å
732	R	38.5	Very low	47.3	Very low	91 Å²	91	69.1 Å²	69.1	34%	0.343	36%	0.356	S	S	.	.	H	α-helix	trans	-86.2	-15.1	175.8	-86.6	177.6	174.6	149.9	-5.1	112.7	R728 D734 I735 L736	R728-R732 HydrophobicContact CB-CG 4.01Å; R728-R732 WeakPolarHBondContact O-CB 3.26Å; R728-R732 PolarHBondContact O-N 2.9Å; R732-D734 PolarHBondContact O-N 3.33Å; R732-I735 PolarHBondContact O-N 2.83Å; R732-L736 HydrophobicContact CB-CD1 4.07Å; R732-L736 HydrophobicContact CB-CG 4.47Å; R732-L736 VanDerWaalsContact O-CB 3.24Å; R732-L736 WeakPolarHBondContact O-CB 3.44Å; R732-L736 VanDerWaalsContact O-CG 3.31Å; R732-L736 WeakPolarHBondContact O-CG 3.35Å; R732-L736 PolarHBondContact O-N 3.39Å
733	M	45.5	Very low	46.2	Very low	74 Å²	74	67.6 Å²	67.6	37%	0.365	35%	0.353	S	S	.	.	H	α-helix	trans	-54.4	-41.1	171	-103.7	179.8	57.4	0	0	110.3	T729 V737	T729-M733 VanDerWaalsContact O-CB 3.32Å; T729-M733 WeakPolarHBondContact O-CB 3.5Å; T729-M733 WeakPolarHBondContact O-CG 3.48Å; T729-M733 PolarHBondContact O-N 2.93Å; M733-V737 WeakPolarHBondContact O-CB 3.27Å; M733-V737 WeakPolarHBondContact O-CG2 3.38Å; M733-V737 PolarHBondContact O-N 3.35Å
734	D	41.6	Very low	45.1	Very low	75 Å²	75	69.2 Å²	69.2	40%	0.401	35%	0.35	S	S	.	.	H	α-helix	trans	-62.1	-51.4	179.8	-59	-16.4	0	0	0	111.3	F437 R732 D738	F437-D734 HydrophobicContact CE2-CB 4.26Å; F437-D734 HydrophobicContact CZ-CB 4.37Å; F437-D734 WeakPolarHBondContact CZ-OD1 3.35Å; R732-D734 PolarHBondContact O-N 3.33Å; D734-D738 PolarHBondContact O-N 2.96Å; D734-D738 VanDerWaalsContact O-N 3.15Å
735	I	47	Very low	44	Very low	117 Å²	117	69.9 Å²	69.9	60%	0.6	36%	0.356	S	S	*	.	H	α-helix	trans	-68.8	-40.6	-179.1	-59.1	175.1	0	0	0	112	R732 D738 E739	R732-I735 PolarHBondContact O-N 2.83Å; I735-D738 PolarHBondContact O-N 3.05Å; I735-E739 WeakPolarHBondContact O-CB 3.23Å; I735-E739 PolarHBondContact O-N 2.89Å
736	L	40.9	Very low	42.7	Very low	26 Å²	26	74.5 Å²	74.5	14%	0.136	38%	0.375	C	S	.	.	H	α-helix	trans	-76.8	-29.8	-178.8	-69.1	170.3	0	0	0	112.6	R732 V740 T773	R732-L736 HydrophobicContact CB-CD1 4.07Å; R732-L736 HydrophobicContact CB-CG 4.47Å; R732-L736 VanDerWaalsContact O-CB 3.24Å; R732-L736 WeakPolarHBondContact O-CB 3.44Å; R732-L736 VanDerWaalsContact O-CG 3.31Å; R732-L736 WeakPolarHBondContact O-CG 3.35Å; R732-L736 PolarHBondContact O-N 3.39Å; L736-V740 VanDerWaalsContact O-CB 3.22Å; L736-V740 WeakPolarHBondContact O-CB 3.47Å; L736-V740 WeakPolarHBondContact O-CG2 3.47Å; L736-V740 PolarHBondContact O-N 3.02Å; L736-T773 HydrophobicContact CD1-CG2 3.93Å; L736-T773 HydrophobicContact CD2-CG2 3.6Å; L736-T773 HydrophobicContact CG-CG2 4.44Å
737	V	46.8	Very low	41.9	Very low	55 Å²	55	78.7 Å²	78.7	33%	0.333	40%	0.403	S	S	.	.	H	α-helix	trans	-66.3	-43.3	170	167	0	0	0	0	109.5	M733 V740 I741	M733-V737 WeakPolarHBondContact O-CB 3.27Å; M733-V737 WeakPolarHBondContact O-CG2 3.38Å; M733-V737 PolarHBondContact O-N 3.35Å; V737-V740 PolarHBondContact O-N 3.23Å; V737-I741 HydrophobicContact CG1-CD1 3.62Å; V737-I741 HydrophobicContact CG1-CG1 4.39Å; V737-I741 VanDerWaalsContact O-CB 3.29Å; V737-I741 WeakPolarHBondContact O-CB 3.35Å; V737-I741 WeakPolarHBondContact O-CD1 3.25Å; V737-I741 WeakPolarHBondContact O-CG1 3.25Å; V737-I741 PolarHBondContact O-N 3.09Å
738	D	44.3	Very low	41	Very low	56 Å²	56	80 Å²	80	30%	0.299	41%	0.414	S	S	.	.	H	α-helix	trans	-63.3	-43.7	173.8	-86.5	-3.5	0	0	0	112.7	D734 I735 I741 Q742	D734-D738 PolarHBondContact O-N 2.96Å; D734-D738 VanDerWaalsContact O-N 3.15Å; I735-D738 PolarHBondContact O-N 3.05Å; D738-I741 PolarHBondContact O-N 3.33Å; D738-Q742 WeakPolarHBondContact O-CB 3.37Å; D738-Q742 VanDerWaalsContact O-CG 3.27Å; D738-Q742 WeakPolarHBondContact O-CG 2.95Å; D738-Q742 PolarHBondContact O-N 3.33Å
739	E	42.2	Very low	40.2	Very low	50 Å²	50	79.1 Å²	79.1	23%	0.234	43%	0.426	C	S	.	.	H	α-helix	trans	-66.1	-39.1	177.4	-176.1	171.1	-157.2	0	0	112.3	I735 Q742 N743 Y771	I735-E739 WeakPolarHBondContact O-CB 3.23Å; I735-E739 PolarHBondContact O-N 2.89Å; E739-Q742 PolarHBondContact O-N 2.65Å; E739-N743 WeakPolarHBondContact CG-ND2 3.43Å; E739-N743 PolarHBondContact O-N 3.27Å; E739-N743 PolarHBondContact O-ND2 3.26Å; E739-Y771 VanDerWaalsContact OE1-CD2 3.25Å; E739-Y771 WeakPolarHBondContact OE1-CD2 3.26Å
740	V	49	Very low	39.7	Very low	20 Å²	20	86.5 Å²	86.5	12%	0.121	46%	0.464	C	S	.	.	H	α-helix	trans	-70.5	-35.2	174.8	170.1	0	0	0	0	111.3	L544 L736 V737 Y744 L776	L544-V740 HydrophobicContact CD2-CG1 3.91Å; L736-V740 VanDerWaalsContact O-CB 3.22Å; L736-V740 WeakPolarHBondContact O-CB 3.47Å; L736-V740 WeakPolarHBondContact O-CG2 3.47Å; L736-V740 PolarHBondContact O-N 3.02Å; V737-V740 PolarHBondContact O-N 3.23Å; V740-Y744 HydrophobicContact CG1-CD2 3.92Å; V740-Y744 HydrophobicContact CG1-CE2 4.35Å; V740-Y744 WeakPolarHBondContact O-CB 3.21Å; V740-Y744 WeakPolarHBondContact O-CD2 3.41Å; V740-Y744 PolarHBondContact O-N 3.02Å; V740-L776 HydrophobicContact CG2-CD1 3.74Å; V740-L776 HydrophobicContact CG2-CD2 4.06Å; V740-L776 HydrophobicContact CG2-CG 4.45Å
741	I	45.6	Very low	39.5	Very low	15 Å²	15	88 Å²	88	8%	0.077	47%	0.469	C	S	.	.	H	α-helix	trans	-62.3	-46.7	170.9	-75.4	166	0	0	0	110	A435 V737 D738 Y744 S745	A435-I741 HydrophobicContact CB-CD1 4.3Å; A435-I741 HydrophobicContact CB-CG2 3.91Å; V737-I741 HydrophobicContact CG1-CD1 3.62Å; V737-I741 HydrophobicContact CG1-CG1 4.39Å; V737-I741 VanDerWaalsContact O-CB 3.29Å; V737-I741 WeakPolarHBondContact O-CB 3.35Å; V737-I741 WeakPolarHBondContact O-CD1 3.25Å; V737-I741 WeakPolarHBondContact O-CG1 3.25Å; V737-I741 PolarHBondContact O-N 3.09Å; D738-I741 PolarHBondContact O-N 3.33Å; I741-Y744 PolarHBondContact O-N 2.99Å; I741-S745 WeakPolarHBondContact O-CB 3.38Å; I741-S745 PolarHBondContact O-N 3.24Å; I741-S745 PolarHBondContact O-OG 2.88Å; I741-S745 VanDerWaalsContact O-OG 3.06Å
742	Q	48.4	Very low	38.9	Very low	92 Å²	92	87.7 Å²	87.7	43%	0.43	48%	0.48	S	S	.	.	H	α-helix	trans	-61.1	-47.5	178.4	-72.4	169.6	42.8	0	0	112.4	L431 D738 E739	L431-Q742 HydrophobicContact CD1-CG 4.17Å; D738-Q742 WeakPolarHBondContact O-CB 3.37Å; D738-Q742 VanDerWaalsContact O-CG 3.27Å; D738-Q742 WeakPolarHBondContact O-CG 2.95Å; D738-Q742 PolarHBondContact O-N 3.33Å; E739-Q742 PolarHBondContact O-N 2.65Å
743	N	43.6	Very low	38.3	Very low	95 Å²	95	88.5 Å²	88.5	51%	0.508	50%	0.499	S	S	.	.	H	α-helix	trans	-71.4	-29.5	-178	-75.3	-77.7	0	0	0	113.6	E739	E739-N743 WeakPolarHBondContact CG-ND2 3.43Å; E739-N743 PolarHBondContact O-N 3.27Å; E739-N743 PolarHBondContact O-ND2 3.26Å
744	Y	42.3	Very low	37.4	Very low	116 Å²	116	95.6 Å²	95.6	46%	0.455	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	26.6	178.7	-69.5	-92.9	0	0	0	113.9	R548 V740 I741	R548-Y744 PolarHBondContact NH1-O 2.92Å; V740-Y744 HydrophobicContact CG1-CD2 3.92Å; V740-Y744 HydrophobicContact CG1-CE2 4.35Å; V740-Y744 WeakPolarHBondContact O-CB 3.21Å; V740-Y744 WeakPolarHBondContact O-CD2 3.41Å; V740-Y744 PolarHBondContact O-N 3.02Å; I741-Y744 PolarHBondContact O-N 2.99Å
745	S	35.8	Very low	36.7	Very low	40 Å²	40	96.9 Å²	96.9	28%	0.28	53%	0.533	S	S	.	.			trans	-123	31.2	174.5	-78.3	0	0	0	0	113.8	I741 P747	I741-S745 WeakPolarHBondContact O-CB 3.38Å; I741-S745 PolarHBondContact O-N 3.24Å; I741-S745 PolarHBondContact O-OG 2.88Å; I741-S745 VanDerWaalsContact O-OG 3.06Å; S745-P747 WeakPolarHBondContact O-CD 3.42Å
746	F	28.1	Very low	35.7	Very low	185 Å²	185	97.8 Å²	97.8	81%	0.811	54%	0.539	S	S	*	.			trans	-93.7	107.6	163.7	-84.9	-85.2	0	0	0	111.3
747	P	33.7	Very low	35	Very low	103 Å²	103	102.9 Å²	102.9	67%	0.669	57%	0.566	S	S	*	*			trans	-74.6	139.3	157	-1.4	19.8	0	0	0	109	S745	S745-P747 WeakPolarHBondContact O-CD 3.42Å
748	C	25.9	Very low	34	Very low	115 Å²	115	108.3 Å²	108.3	78%	0.777	59%	0.585	S	S	*	*			trans	-60.6	133.2	168.2	-70.3	0	0	0	0	110.3	L750	C748-L750 PolarHBondContact O-N 3.3Å
749	P	31.4	Very low	33.2	Very low	121 Å²	121	111.6 Å²	111.6	79%	0.786	60%	0.599	S	S	*	*			trans	-71.5	101.2	178.1	28.4	-33.8	0	0	0	110.7	S751	P749-S751 PolarHBondContact O-N 2.98Å
750	L	27	Very low	32.5	Very low	177 Å²	177	118.7 Å²	118.7	93%	0.927	62%	0.623	S	S	*	*			trans	-75.2	68.6	170.9	-85.4	157.7	0	0	0	110.7	C748 S752	C748-L750 PolarHBondContact O-N 3.3Å; L750-S752 PolarHBondContact O-N 3.48Å
751	S	31.4	Very low	31.5	Very low	111 Å²	111	123.5 Å²	123.5	78%	0.776	65%	0.648	S	S	*	*			trans	-83.1	95	174.2	58.1	0	0	0	0	111	P749	P749-S751 PolarHBondContact O-N 2.98Å
752	S	27.9	Very low	30.5	Very low	108 Å²	108	129.6 Å²	129.6	76%	0.755	68%	0.681	S	S	*	*			trans	-89.2	119.5	175.5	-176.4	0	0	0	0	111.9	L750	L750-S752 PolarHBondContact O-N 3.48Å
753	S	26.1	Very low	29.5	Very low	107 Å²	107	134.6 Å²	134.6	75%	0.748	70%	0.704	S	S	*	*			trans	62.7	151.3	175.5	77.3	0	0	0	0	115.4
754	R	26.3	Very low	28.6	Very low	223 Å²	223	135.4 Å²	135.4	84%	0.842	72%	0.717	S	S	*	*			cis	-155	153.5	12.9	-150.3	179	177.1	158.2	-2.8	108.7
755	T	26.1	Very low	27.9	Very low	103 Å²	103	137.8 Å²	137.8	63%	0.632	74%	0.737	S	S	*	*			trans	16.6	124	152.9	53.8	0	0	0	0	118.4
756	D	26.2	Very low	27.4	Very low	135 Å²	135	141 Å²	141	72%	0.722	76%	0.756	S	S	*	*				-158.8	149.4	51.2	-92.7	-46.6	0	0	0	116.8
757	L	26.8	Very low	27.4	Very low	133 Å²	133	137.2 Å²	137.2	70%	0.696	75%	0.752	S	S	*	*			trans	60.6	134.9	144.4	-68.9	161.9	0	0	0	122.9
758	F	26.5	Very low	27	Very low	170 Å²	170	137.8 Å²	137.8	75%	0.746	75%	0.749	S	S	*	*			trans	60.9	81.2	169.4	-56.7	-65.1	0	0	0	117.1
759	E	27.4	Very low	27.2	Very low	124 Å²	124	141 Å²	141	58%	0.579	75%	0.745	S	S	*	*				86	104.6	73.4	-75.9	-157	106.2	0	0	115.9
760	R	27.1	Very low	27	Very low	200 Å²	200	142.4 Å²	142.4	76%	0.755	74%	0.739	S	S	*	*			trans	63.8	144.8	130.9	-63.9	-166.1	-80.5	159	-8.5	119.6
761	D	27.1	Very low	27.1	Very low	120 Å²	120	139.7 Å²	139.7	64%	0.642	72%	0.717	S	S	*	*			cis	-145.9	172.4	8.4	-133.8	-42.8	0	0	0	113.9
762	N	26.1	Very low	27.3	Very low	143 Å²	143	141.4 Å²	141.4	77%	0.765	71%	0.707	S	S	*	*			trans	-63.9	136.5	-169	-66.5	-96	0	0	0	115.4
763	Q	26.7	Very low	28.4	Very low	197 Å²	197	137.7 Å²	137.7	92%	0.921	68%	0.681	S	S	*	*			trans	-137	139.1	144.8	-71.6	-161.4	17.1	0	0	111.5	L765	Q763-L765 PolarHBondContact O-N 2.92Å
764	S	24.2	Very low	29.5	Very low	112 Å²	112	135.4 Å²	135.4	78%	0.783	66%	0.663	S	S	*	*			trans	-77.4	112.2	-177.4	54.4	0	0	0	0	112	T766	S764-T766 PolarHBondContact O-N 3.47Å
765	L	27.5	Very low	30.6	Very low	167 Å²	167	126.3 Å²	126.3	87%	0.874	63%	0.631	S	S	*	*			trans	-97.2	89.1	174.6	-159.4	73.4	0	0	0	112.2	Q763 S767	Q763-L765 PolarHBondContact O-N 2.92Å; L765-S767 PolarHBondContact O-N 3.22Å
766	T	25.2	Very low	31.9	Very low	108 Å²	108	123.4 Å²	123.4	66%	0.663	61%	0.611	S	S	*	*			trans	-71.8	91.5	168.6	41.6	0	0	0	0	110.3	S764 N768	S764-T766 PolarHBondContact O-N 3.47Å; T766-N768 PolarHBondContact O-N 3.16Å; T766-N768 PolarHBondContact O-ND2 3.04Å
767	S	29.7	Very low	33.2	Very low	105 Å²	105	119.3 Å²	119.3	73%	0.734	59%	0.588	S	S	*	*			trans	-63.9	88.1	-178.7	-167.6	0	0	0	0	112.3	L765 R769	L765-S767 PolarHBondContact O-N 3.22Å; S767-R769 PolarHBondContact O-N 3.49Å
768	N	25.1	Very low	34.5	Very low	115 Å²	115	114.2 Å²	114.2	62%	0.615	57%	0.565	S	S	*	*			trans	-78.5	79.4	-179.9	-88.9	-95.1	0	0	0	111.1	T766	T766-N768 PolarHBondContact O-N 3.16Å; T766-N768 PolarHBondContact O-ND2 3.04Å
769	R	28.9	Very low	35.7	Very low	183 Å²	183	106.6 Å²	106.6	69%	0.691	53%	0.532	S	S	*	.			trans	-99.6	85.9	160.5	-95.2	177.7	164.3	-148.1	-1.7	110	S767 Y771	S767-R769 PolarHBondContact O-N 3.49Å; R769-Y771 VanDerWaalsContact C-N 3.25Å; R769-Y771 HydrophobicContact CB-CD2 4.06Å; R769-Y771 HydrophobicContact CB-CE2 3.97Å; R769-Y771 HydrophobicContact CG-CD2 4.49Å; R769-Y771 HydrophobicContact CG-CE2 3.9Å; R769-Y771 PolarHBondContact O-N 3.49Å
770	K	27.1	Very low	36.9	Very low	150 Å²	150	102.5 Å²	102.5	65%	0.652	52%	0.515	S	S	*	.			trans	-76.4	70.8	176.4	-70.8	-169.5	-177	-174.4	0	111.6	Y772	K770-Y772 HydrophobicContact CB-CD2 4Å; K770-Y772 HydrophobicContact CB-CE2 4.49Å; K770-Y772 HydrophobicContact CD-CD2 4.48Å; K770-Y772 HydrophobicContact CD-CE2 4.3Å; K770-Y772 HydrophobicContact CG-CD2 4.31Å; K770-Y772 HydrophobicContact CG-CE2 4.29Å; K770-Y772 PolarHBondContact O-N 2.83Å
771	Y	30.5	Very low	38.1	Very low	120 Å²	120	96.8 Å²	96.8	47%	0.471	50%	0.5	S	S	.	.			trans	-77.2	70.9	162.8	-66.9	-69.1	0	0	0	109.5	E739 R769 T773	E739-Y771 VanDerWaalsContact OE1-CD2 3.25Å; E739-Y771 WeakPolarHBondContact OE1-CD2 3.26Å; R769-Y771 VanDerWaalsContact C-N 3.25Å; R769-Y771 HydrophobicContact CB-CD2 4.06Å; R769-Y771 HydrophobicContact CB-CE2 3.97Å; R769-Y771 HydrophobicContact CG-CD2 4.49Å; R769-Y771 HydrophobicContact CG-CE2 3.9Å; R769-Y771 PolarHBondContact O-N 3.49Å; Y771-T773 VanDerWaalsContact C-N 3.33Å; Y771-T773 PolarHBondContact O-N 3.43Å
772	Y	34.4	Very low	39.2	Very low	146 Å²	146	92.2 Å²	92.2	57%	0.573	48%	0.477	S	S	*	.			trans	-72.5	83.7	177	-102.3	-124.3	0	0	0	109.8	K770 Q777	K770-Y772 HydrophobicContact CB-CD2 4Å; K770-Y772 HydrophobicContact CB-CE2 4.49Å; K770-Y772 HydrophobicContact CD-CD2 4.48Å; K770-Y772 HydrophobicContact CD-CE2 4.3Å; K770-Y772 HydrophobicContact CG-CD2 4.31Å; K770-Y772 HydrophobicContact CG-CE2 4.29Å; K770-Y772 PolarHBondContact O-N 2.83Å; Y772-Q777 HydrophobicContact CD1-CG 4.4Å; Y772-Q777 HydrophobicContact CE1-CG 4Å; Y772-Q777 PolarHBondContact OH-OE1 3.5Å
773	T	52.5	Low	39.9	Very low	31 Å²	31	86.3 Å²	86.3	19%	0.19	45%	0.446	C	S	.	.			trans	-80.7	136.1	154.1	59.6	0	0	0	0	108.8	L736 Y771 L775 L776 Q777	L736-T773 HydrophobicContact CD1-CG2 3.93Å; L736-T773 HydrophobicContact CD2-CG2 3.6Å; L736-T773 HydrophobicContact CG-CG2 4.44Å; Y771-T773 VanDerWaalsContact C-N 3.33Å; Y771-T773 PolarHBondContact O-N 3.43Å; T773-L775 PolarHBondContact O-N 3.43Å; T773-L775 VanDerWaalsContact O-N 3.16Å; T773-L776 PolarHBondContact O-N 3Å; T773-L776 VanDerWaalsContact O-N 3.08Å; T773-L776 WeakPolarHBondContact OG1-CB 3.49Å; T773-L776 PolarHBondContact OG1-N 2.61Å; T773-Q777 PolarHBondContact O-N 3.38Å
774	P	48.8	Very low	40.4	Very low	58 Å²	58	82.2 Å²	82.2	38%	0.377	43%	0.428	S	S	.	.	H	α-helix	trans	-57.4	-29.2	176.8	-32.2	41.6	0	0	0	113.2	I636 E640 A778	I636-P774 HydrophobicContact CG2-CB 3.98Å; E640-P774 WeakPolarHBondContact OE1-CG 3.25Å; P774-A778 WeakPolarHBondContact O-CB 3.28Å; P774-A778 PolarHBondContact O-N 3.22Å
775	L	49.1	Very low	40.8	Very low	33 Å²	33	85.5 Å²	85.5	17%	0.173	43%	0.425	C	S	.	.	H	α-helix	trans	-66.2	-47.6	172.3	-172.7	149.5	0	0	0	112.9	I636 T729 T773 Q777 A778 L779	I636-L775 HydrophobicContact CD1-CB 4.16Å; T729-L775 HydrophobicContact CG2-CD1 3.77Å; T773-L775 PolarHBondContact O-N 3.43Å; T773-L775 VanDerWaalsContact O-N 3.16Å; L775-Q777 VanDerWaalsContact C-N 3.33Å; L775-Q777 PolarHBondContact O-N 3.29Å; L775-A778 PolarHBondContact O-N 2.83Å; L775-L779 HydrophobicContact CD2-CD1 3.64Å; L775-L779 HydrophobicContact CD2-CG 4.39Å; L775-L779 HydrophobicContact CG-CD1 4.48Å; L775-L779 WeakPolarHBondContact O-CB 3.49Å; L775-L779 WeakPolarHBondContact O-CG 3.45Å; L775-L779 PolarHBondContact O-N 2.83Å
776	L	53	Low	41.1	Very low	41 Å²	41	79.5 Å²	79.5	22%	0.215	40%	0.396	C	S	.	.	H	α-helix	trans	-66.5	-36.9	175.9	-177.7	56.1	0	0	0	111.3	V740 T773 T780	V740-L776 HydrophobicContact CG2-CD1 3.74Å; V740-L776 HydrophobicContact CG2-CD2 4.06Å; V740-L776 HydrophobicContact CG2-CG 4.45Å; T773-L776 PolarHBondContact O-N 3Å; T773-L776 VanDerWaalsContact O-N 3.08Å; T773-L776 WeakPolarHBondContact OG1-CB 3.49Å; T773-L776 PolarHBondContact OG1-N 2.61Å; L776-T780 VanDerWaalsContact O-CB 3.27Å; L776-T780 WeakPolarHBondContact O-CB 3.49Å; L776-T780 PolarHBondContact O-N 3.26Å; L776-T780 PolarHBondContact O-OG1 3.26Å
777	Q	54.5	Low	41.5	Very low	49 Å²	49	79.7 Å²	79.7	23%	0.229	39%	0.393	C	S	.	.	H	α-helix	trans	-68.2	-40.1	175.6	-169.5	60.8	43.1	0	0	112	Y772 T773 L775 T780 N781	Y772-Q777 HydrophobicContact CD1-CG 4.4Å; Y772-Q777 HydrophobicContact CE1-CG 4Å; Y772-Q777 PolarHBondContact OH-OE1 3.5Å; T773-Q777 PolarHBondContact O-N 3.38Å; L775-Q777 VanDerWaalsContact C-N 3.33Å; L775-Q777 PolarHBondContact O-N 3.29Å; Q777-T780 PolarHBondContact O-N 3.42Å; Q777-N781 PolarHBondContact NE2-OD1 3.32Å; Q777-N781 VanDerWaalsContact O-CB 3.27Å; Q777-N781 WeakPolarHBondContact O-CB 3.49Å; Q777-N781 PolarHBondContact O-N 3.1Å; Q777-N781 PolarHBondContact O-ND2 3.08Å; Q777-N781 PolarHBondContact O-OD1 3.18Å
778	A	54	Low	41.7	Very low	27 Å²	27	80.8 Å²	80.8	22%	0.223	39%	0.39	C	S	.	.	H	α-helix	trans	-65	-45	175.9	0	0	0	0	0	111.7	L632 I636 P774 L775 N781 S782	L632-A778 HydrophobicContact CD1-CB 4.48Å; L632-A778 HydrophobicContact CD2-CB 4.15Å; I636-A778 HydrophobicContact CD1-CB 3.76Å; P774-A778 WeakPolarHBondContact O-CB 3.28Å; P774-A778 PolarHBondContact O-N 3.22Å; L775-A778 PolarHBondContact O-N 2.83Å; A778-N781 PolarHBondContact O-N 3.09Å; A778-S782 PolarHBondContact O-N 3.43Å; A778-S782 PolarHBondContact O-OG 2.95Å
779	L	51.2	Low	42	Very low	10 Å²	10	82.8 Å²	82.8	5%	0.052	40%	0.396	C	S	.	.	H	α-helix	trans	-65.2	-38	173.7	-70.8	177.2	0	0	0	112.2	P542 L632 L775 S782 N783	P542-L779 HydrophobicContact CB-CD2 4.14Å; P542-L779 HydrophobicContact CG-CD2 4.1Å; L632-L779 HydrophobicContact CD2-CD2 3.81Å; L632-L779 HydrophobicContact CD2-CG 4.26Å; L775-L779 HydrophobicContact CD2-CD1 3.64Å; L775-L779 HydrophobicContact CD2-CG 4.39Å; L775-L779 HydrophobicContact CG-CD1 4.48Å; L775-L779 WeakPolarHBondContact O-CB 3.49Å; L775-L779 WeakPolarHBondContact O-CG 3.45Å; L775-L779 PolarHBondContact O-N 2.83Å; L779-S782 PolarHBondContact O-OG 3.41Å; L779-S782 VanDerWaalsContact O-OG 3.1Å; L779-N783 WeakPolarHBondContact O-CB 3.37Å; L779-N783 PolarHBondContact O-N 3.41Å; L779-N783 PolarHBondContact O-ND2 2.87Å
780	T	52.5	Low	42.1	Very low	37 Å²	37	81.9 Å²	81.9	23%	0.227	41%	0.405	C	S	.	.	H	α-helix	trans	-67.5	-43.1	176.4	-56.6	0	0	0	0	110.5	L776 Q777 M784	L776-T780 VanDerWaalsContact O-CB 3.27Å; L776-T780 WeakPolarHBondContact O-CB 3.49Å; L776-T780 PolarHBondContact O-N 3.26Å; L776-T780 PolarHBondContact O-OG1 3.26Å; Q777-T780 PolarHBondContact O-N 3.42Å; T780-M784 HydrophobicContact CG2-CG 4.35Å; T780-M784 VanDerWaalsContact O-CB 3.3Å; T780-M784 WeakPolarHBondContact O-CB 3.35Å; T780-M784 WeakPolarHBondContact O-CG 3.3Å; T780-M784 PolarHBondContact O-N 3.09Å
781	N	51.9	Low	42.2	Very low	80 Å²	80	77 Å²	77	43%	0.428	40%	0.398	S	S	.	.	H	α-helix	trans	-61.4	-47.6	175.2	-72.6	-7.3	0	0	0	111.7	Q777 A778 N783 M784 Y785	Q777-N781 PolarHBondContact NE2-OD1 3.32Å; Q777-N781 VanDerWaalsContact O-CB 3.27Å; Q777-N781 WeakPolarHBondContact O-CB 3.49Å; Q777-N781 PolarHBondContact O-N 3.1Å; Q777-N781 PolarHBondContact O-ND2 3.08Å; Q777-N781 PolarHBondContact O-OD1 3.18Å; A778-N781 PolarHBondContact O-N 3.09Å; N781-N783 PolarHBondContact O-N 3.38Å; N781-M784 PolarHBondContact O-N 3.02Å; N781-Y785 WeakPolarHBondContact O-CD2 3.34Å; N781-Y785 PolarHBondContact O-N 3.04Å
782	S	49.4	Very low	42.1	Very low	24 Å²	24	79.3 Å²	79.3	17%	0.168	42%	0.418	C	S	.	.	H	α-helix	trans	-61.6	-47.2	179.9	69.2	0	0	0	0	111.5	P542 A778 L779 M784 Y785 C786	P542-S782 PolarHBondContact O-OG 3.27Å; A778-S782 PolarHBondContact O-N 3.43Å; A778-S782 PolarHBondContact O-OG 2.95Å; L779-S782 PolarHBondContact O-OG 3.41Å; L779-S782 VanDerWaalsContact O-OG 3.1Å; S782-M784 VanDerWaalsContact C-N 3.33Å; S782-M784 PolarHBondContact O-N 2.93Å; S782-Y785 PolarHBondContact O-N 3.35Å; S782-C786 PolarHBondContact O-N 2.96Å; S782-C786 PolarHBondContact O-SG 3.35Å; S782-C786 VanDerWaalsContact O-SG 3.33Å
783	N	42.9	Very low	41.8	Very low	20 Å²	20	81.9 Å²	81.9	11%	0.107	43%	0.432	C	S	.	.	H	α-helix	trans	-67.9	-30	178.6	-69.8	-76.2	0	0	0	112.6	N543 L779 N781 C786 N787	N543-N783 PolarHBondContact OD1-OD1 2.83Å; L779-N783 WeakPolarHBondContact O-CB 3.37Å; L779-N783 PolarHBondContact O-N 3.41Å; L779-N783 PolarHBondContact O-ND2 2.87Å; N781-N783 PolarHBondContact O-N 3.38Å; N783-C786 PolarHBondContact O-N 3.48Å; N783-N787 WeakPolarHBondContact O-CB 3.37Å; N783-N787 PolarHBondContact O-N 3.02Å; N783-N787 PolarHBondContact O-ND2 3.44Å
784	M	36.1	Very low	40.7	Very low	110 Å²	110	85.8 Å²	85.8	54%	0.542	46%	0.46	S	S	.	.	H	α-helix	trans	-68	-33.2	172.2	-76.3	-71.4	137	0	0	113	T780 N781 S782 N788	T780-M784 HydrophobicContact CG2-CG 4.35Å; T780-M784 VanDerWaalsContact O-CB 3.3Å; T780-M784 WeakPolarHBondContact O-CB 3.35Å; T780-M784 WeakPolarHBondContact O-CG 3.3Å; T780-M784 PolarHBondContact O-N 3.09Å; N781-M784 PolarHBondContact O-N 3.02Å; S782-M784 VanDerWaalsContact C-N 3.33Å; S782-M784 PolarHBondContact O-N 2.93Å; M784-N788 PolarHBondContact O-ND2 3.03Å
785	Y	33.4	Very low	39.7	Very low	182 Å²	182	88.8 Å²	88.8	71%	0.714	48%	0.48	S	S	*	.	H	α-helix	trans	-75.2	-36.7	171.4	-86.9	-82.7	0	0	0	112.5	N781 S782	N781-Y785 WeakPolarHBondContact O-CD2 3.34Å; N781-Y785 PolarHBondContact O-N 3.04Å; S782-Y785 PolarHBondContact O-N 3.35Å
786	C	32.9	Very low	38.8	Very low	41 Å²	41	94 Å²	94	28%	0.277	51%	0.508	S	S	.	.	H	α-helix	trans	-66.4	-44.8	176.1	-66.1	0	0	0	0	112.9	S782 N783 N788 H789	S782-C786 PolarHBondContact O-N 2.96Å; S782-C786 PolarHBondContact O-SG 3.35Å; S782-C786 VanDerWaalsContact O-SG 3.33Å; N783-C786 PolarHBondContact O-N 3.48Å; C786-N788 PolarHBondContact O-N 2.94Å; C786-H789 PolarHBondContact O-N 3.41Å
787	N	34	Very low	37.7	Very low	112 Å²	112	97.9 Å²	97.9	60%	0.599	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-3.3	-177.3	-72.5	-11.2	0	0	0	114.7	N783	N783-N787 WeakPolarHBondContact O-CB 3.37Å; N783-N787 PolarHBondContact O-N 3.02Å; N783-N787 PolarHBondContact O-ND2 3.44Å
788	N	33.3	Very low	36.4	Very low	127 Å²	127	106.6 Å²	106.6	68%	0.679	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.9	10.3	175.5	-70.6	-76.9	0	0	0	113.2	M784 C786	M784-N788 PolarHBondContact O-ND2 3.03Å; C786-N788 PolarHBondContact O-N 2.94Å
789	H	32.1	Very low	35.2	Very low	157 Å²	157	112.5 Å²	112.5	73%	0.727	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.3	-2.9	-179.3	-94.2	-36.2	0	0	0	116.6	C786 G791	C786-H789 PolarHBondContact O-N 3.41Å; H789-G791 PolarHBondContact O-N 2.88Å
790	D	31.7	Very low	34	Very low	164 Å²	164	116 Å²	116	88%	0.877	62%	0.623	S	S	*	*	S	Bend	trans	-85.1	17.6	167.1	-73.4	-43	0	0	0	113.1
791	G	29.1	Very low	32.8	Very low	49 Å²	49	121 Å²	121	51%	0.505	65%	0.648	S	S	.	*	S	Bend	trans	-104.2	139.1	173.9	0	0	0	0	0	113.5	H789	H789-G791 PolarHBondContact O-N 2.88Å
792	D	27.8	Very low	31.6	Very low	167 Å²	167	121.8 Å²	121.8	89%	0.893	67%	0.666	S	S	*	*			trans	54.8	58.5	158.9	-59.9	-19.6	0	0	0	119
793	K	28.5	Very low	30.5	Very low	201 Å²	201	126.2 Å²	126.2	87%	0.874	69%	0.686	S	S	*	*			trans	-130.9	92.2	149.9	-71.8	-165.7	176.9	177.1	0	112.8
794	S	27.7	Very low	29.7	Very low	112 Å²	112	133.8 Å²	133.8	78%	0.783	72%	0.719	S	S	*	*			trans	-55.9	135	173.4	-178.1	0	0	0	0	112.3
795	P	28.2	Very low	29.3	Very low	122 Å²	122	136.4 Å²	136.4	79%	0.792	73%	0.729	S	S	*	*			trans	-99.3	80.5	179.4	37.8	-32.6	0	0	0	112.2
796	D	29.8	Very low	29.2	Very low	143 Å²	143	135.8 Å²	135.8	77%	0.765	73%	0.733	S	S	*	*			trans	-150.1	128	162.8	-125.6	-29.3	0	0	0	116.7
797	S	30.8	Very low	29	Very low	122 Å²	122	138 Å²	138	85%	0.853	75%	0.754	S	S	*	*			trans	164.7	72.3	159.1	37	0	0	0	0	110.5
798	R	27.6	Very low	29	Very low	231 Å²	231	137.6 Å²	137.6	87%	0.872	76%	0.758	S	S	*	*			trans	-89.6	113.6	163.6	-82.5	179.8	170.1	167.4	-2.7	110.7
799	N	28.2	Very low	28.8	Very low	152 Å²	152	139.7 Å²	139.7	81%	0.813	76%	0.763	S	S	*	*			trans	-158	134.2	137.6	-100.4	-19.7	0	0	0	108.8
800	S	26.9	Very low	29	Very low	83 Å²	83	138.9 Å²	138.9	58%	0.58	76%	0.763	S	S	*	*			cis	100.7	107	33.9	-64.4	0	0	0	0	112.5
801	N	26.2	Very low	29.1	Very low	142 Å²	142	136.4 Å²	136.4	76%	0.759	75%	0.749	S	S	*	*			trans	66.2	104.8	138.2	-52.2	-14.3	0	0	0	122	I803	N801-I803 HydrophobicContact CB-CD1 4.17Å
802	A	27.3	Very low	29.4	Very low	97 Å²	97	142.8 Å²	142.8	80%	0.802	76%	0.763	S	S	*	*			trans	-166.7	120.1	133.9	0	0	0	0	0	106.4
803	I	25.9	Very low	29.6	Very low	116 Å²	116	138.4 Å²	138.4	60%	0.595	75%	0.75	S	S	*	*			cis	85	133.6	25.2	-43.4	173.8	0	0	0	113.8	N801	N801-I803 HydrophobicContact CB-CD1 4.17Å
804	F	25.7	Very low	29.7	Very low	180 Å²	180	135.9 Å²	135.9	79%	0.789	75%	0.746	S	S	*	*			trans	74.4	146.4	-179.2	-47.7	-73.8	0	0	0	115.4
805	H	29	Very low	30	Very low	164 Å²	164	137.9 Å²	137.9	76%	0.759	75%	0.748	S	S	*	*			cis	-117.9	176.4	1.8	-82.8	-110.7	0	0	0	110.2
806	E	29.9	Very low	30.1	Very low	170 Å²	170	139 Å²	139	79%	0.794	75%	0.746	S	S	*	*			cis	-155.3	139.1	12.7	-147.8	160	-175.1	0	0	114.5
807	A	30.2	Very low	30.3	Very low	88 Å²	88	141.5 Å²	141.5	73%	0.727	75%	0.753	S	S	*	*			trans	63.6	156.5	143.7	0	0	0	0	0	122.8
808	P	34	Very low	30.4	Very low	103 Å²	103	144 Å²	144	67%	0.669	75%	0.751	S	S	*	*			trans	-145.8	-162.8	-135.9	44.9	-23.7	0	0	0	117.3
809	E	29.1	Very low	30.6	Very low	171 Å²	171	140 Å²	140	80%	0.799	75%	0.747	S	S	*	*			trans	70.8	142.8	160	-65.1	170	-149	0	0	117
810	I	35.6	Very low	30.8	Very low	140 Å²	140	138.3 Å²	138.3	72%	0.718	74%	0.743	S	S	*	*				-165	134.9	64.7	-86.3	-179.4	0	0	0	111
811	N	34.6	Very low	31.1	Very low	111 Å²	111	142.7 Å²	142.7	59%	0.594	75%	0.754	S	S	*	*			trans	48.7	117.8	154.7	-68.2	-39.4	0	0	0	121.4
812	K	34.4	Very low	31.5	Very low	184 Å²	184	145.2 Å²	145.2	80%	0.8	76%	0.758	S	S	*	*				73.5	152.8	95.1	-67.7	170	-173.6	146.8	0	115.9
813	A	32.1	Very low	31.6	Very low	75 Å²	75	149.9 Å²	149.9	62%	0.62	76%	0.763	S	S	*	*			cis	-173.4	153.2	-27.1	0	0	0	0	0	107.2
814	N	30.6	Very low	31.8	Very low	147 Å²	147	152.9 Å²	152.9	79%	0.786	78%	0.775	S	S	*	*			trans	38.4	127.7	157.8	-52.2	-0.9	0	0	0	119.6
815	D	34.4	Very low	31.7	Very low	154 Å²	154	149.2 Å²	149.2	82%	0.824	77%	0.77	S	S	*	*				-163.3	174.2	87	-117	-34.4	0	0	0	114.4
816	I	29.4	Very low	31.7	Very low	145 Å²	145	146.7 Å²	146.7	74%	0.744	77%	0.768	S	S	*	*			trans	-98.4	133.4	-164.4	-60.7	160.5	0	0	0	112.2
817	Q	33.9	Very low	31.6	Very low	196 Å²	196	144.2 Å²	144.2	92%	0.916	77%	0.77	S	S	*	*			trans	-149.5	131.9	140	-114.9	163.7	26.5	0	0	111.2
818	Q	34.1	Very low	31.7	Very low	174 Å²	174	145.6 Å²	145.6	81%	0.813	77%	0.769	S	S	*	*			trans	-87.1	137.5	169.9	-66.3	175.6	-16.9	0	0	108.5
819	D	31.8	Very low	31.5	Very low	147 Å²	147	145.2 Å²	145.2	79%	0.786	77%	0.77	S	S	*	*			trans	-141.3	136.7	146.2	-154.6	-13.8	0	0	0	110.3	Q821	D819-Q821 PolarHBondContact O-N 3.23Å
820	T	31.7	Very low	31.7	Very low	118 Å²	118	146 Å²	146	72%	0.724	77%	0.77	S	S	*	*			trans	-102	63.5	-163.5	-51.5	0	0	0	0	110.8	K822	T820-K822 PolarHBondContact O-N 2.69Å
821	Q	34.4	Very low	31.4	Very low	175 Å²	175	146.2 Å²	146.2	82%	0.818	77%	0.772	S	S	*	*			trans	-70.2	114.5	170.2	-68.6	-157.5	4.5	0	0	110.2	D819 Q823	D819-Q821 PolarHBondContact O-N 3.23Å; Q821-Q823 PolarHBondContact O-N 2.72Å; Q821-Q823 VanDerWaalsContact O-N 3.15Å
822	K	33.6	Very low	31.3	Very low	194 Å²	194	147.9 Å²	147.9	84%	0.843	78%	0.781	S	S	*	*			trans	-56.5	116.1	179.5	-63.8	167.3	-177.7	169.7	0	109.4	T820 Q824	T820-K822 PolarHBondContact O-N 2.69Å; K822-Q824 PolarHBondContact O-N 3.3Å
823	Q	30.2	Very low	31.2	Very low	195 Å²	195	147.9 Å²	147.9	91%	0.911	78%	0.777	S	S	*	*			trans	-66.1	90.7	162.9	-85.6	-170.6	-18.1	0	0	109	Q821 C825	Q821-Q823 PolarHBondContact O-N 2.72Å; Q821-Q823 VanDerWaalsContact O-N 3.15Å; Q823-C825 PolarHBondContact O-N 3.04Å
824	Q	29.1	Very low	31.4	Very low	180 Å²	180	150 Å²	150	84%	0.841	79%	0.785	S	S	*	*			trans	-55.1	126	167.4	-168.5	168.5	9.4	0	0	107.7	K822	K822-Q824 PolarHBondContact O-N 3.3Å
825	C	24.8	Very low	31.7	Very low	102 Å²	102	154 Å²	154	69%	0.689	79%	0.789	S	S	*	*			trans	-52.8	130.7	-174.2	-60	0	0	0	0	110.1	Q823 S827	Q823-C825 PolarHBondContact O-N 3.04Å; C825-S827 PolarHBondContact O-N 3.23Å
826	P	29	Very low	31.9	Very low	111 Å²	111	150.8 Å²	150.8	72%	0.721	78%	0.777	S	S	*	*			trans	-59.3	108.6	164.7	26.1	-31.9	0	0	0	106	T828	P826-T828 HydrophobicContact CB-CG2 4.27Å; P826-T828 PolarHBondContact O-N 3.18Å
827	S	26.2	Very low	32.2	Very low	119 Å²	119	146.8 Å²	146.8	83%	0.832	76%	0.76	S	S	*	*			trans	-71	84.2	172.5	-67.3	0	0	0	0	105.9	C825 S829	C825-S827 PolarHBondContact O-N 3.23Å; S827-S829 PolarHBondContact O-N 3.1Å
828	T	32.3	Very low	32.5	Very low	116 Å²	116	142.8 Å²	142.8	71%	0.712	75%	0.751	S	S	*	*			trans	-68.1	82.6	-174.7	52.8	0	0	0	0	109.3	P826	P826-T828 HydrophobicContact CB-CG2 4.27Å; P826-T828 PolarHBondContact O-N 3.18Å
829	S	31.2	Very low	32.9	Very low	96 Å²	96	141.1 Å²	141.1	67%	0.671	74%	0.743	S	S	*	*			trans	32.2	118.2	140.7	55.6	0	0	0	0	115.1	S827 L831	S827-S829 PolarHBondContact O-N 3.1Å; S829-L831 PolarHBondContact O-N 3.41Å
830	K	31.6	Very low	33.1	Very low	188 Å²	188	140 Å²	140	82%	0.817	73%	0.731	S	S	*	*			trans	-31.4	126.2	154.2	-63.3	173.7	179.8	176	0	109.1	N832	K830-N832 PolarHBondContact O-N 3.34Å
831	L	29.9	Very low	33.4	Very low	144 Å²	144	140.5 Å²	140.5	75%	0.754	72%	0.724	S	S	*	*			trans	-62.7	90.5	170.6	-104.1	153.3	0	0	0	107.6	S829 Y833	S829-L831 PolarHBondContact O-N 3.41Å; L831-Y833 HydrophobicContact CB-CD2 4.43Å; L831-Y833 HydrophobicContact CB-CE2 4.14Å; L831-Y833 WeakPolarHBondContact O-CD2 3.31Å; L831-Y833 PolarHBondContact O-N 2.95Å
832	N	33.6	Very low	33.6	Very low	146 Å²	146	138.9 Å²	138.9	78%	0.781	72%	0.72	S	S	*	*			trans	-67.2	84.6	164.6	-83.4	-11.2	0	0	0	106.1	K830	K830-N832 PolarHBondContact O-N 3.34Å
833	Y	32	Very low	33.7	Very low	184 Å²	184	136 Å²	136	72%	0.722	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-49.3	130.9	159.3	-72.6	-88.4	0	0	0	107.4	L831 R835	L831-Y833 HydrophobicContact CB-CD2 4.43Å; L831-Y833 HydrophobicContact CB-CE2 4.14Å; L831-Y833 WeakPolarHBondContact O-CD2 3.31Å; L831-Y833 PolarHBondContact O-N 2.95Å; Y833-R835 PolarHBondContact O-N 3.3Å; Y833-R835 VanDerWaalsContact O-N 3.1Å
834	P	36.4	Very low	33.7	Very low	119 Å²	119	135 Å²	135	77%	0.773	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-56.8	123.7	176.7	23.9	-32.4	0	0	0	107.7
835	R	35.9	Very low	33.9	Very low	230 Å²	230	135.4 Å²	135.4	87%	0.868	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-57.2	132.7	171.4	-176.3	-179.6	-66.4	-170.7	-0.6	106.6	Y833	Y833-R835 PolarHBondContact O-N 3.3Å; Y833-R835 VanDerWaalsContact O-N 3.1Å
836	P	38.2	Very low	34.4	Very low	88 Å²	88	137.1 Å²	137.1	57%	0.571	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-50.9	142.1	178	-28.3	35.1	0	0	0	111	F840	P836-F840 HydrophobicContact CB-CB 3.9Å; P836-F840 HydrophobicContact CB-CD2 4.49Å; P836-F840 HydrophobicContact CB-CG 4.31Å
837	P	37.2	Very low	34.7	Very low	61 Å²	61	138.5 Å²	138.5	40%	0.396	70%	0.703	S	S	.	*	P	Polyproline II helix	trans	-49.2	147.1	172.1	-27.1	33.3	0	0	0	111.2	E839 F840	P837-E839 WeakPolarHBondContact CB-OE1 3.47Å; P837-E839 PolarHBondContact O-N 3.35Å; P837-F840 HydrophobicContact CB-CD2 4.12Å; P837-F840 HydrophobicContact CG-CD2 4.09Å; P837-F840 HydrophobicContact CG-CE2 4.17Å; P837-F840 PolarHBondContact O-N 3.48Å
838	P	39.3	Very low	35.1	Very low	112 Å²	112	139.6 Å²	139.6	73%	0.727	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-53.2	-29.8	-177	-26.9	35.4	0	0	0	113.7	F840 K841	P838-F840 PolarHBondContact O-N 3.17Å; P838-K841 WeakPolarHBondContact O-CB 3.24Å; P838-K841 PolarHBondContact O-N 3.49Å
839	E	42	Very low	35.3	Very low	139 Å²	139	140.9 Å²	140.9	65%	0.65	70%	0.695	S	S	*	*	G	3₁₀ helix	trans	-51.5	-37.5	173.7	-62.6	151	-87.6	0	0	113.2	P837 K841 L842	P837-E839 WeakPolarHBondContact CB-OE1 3.47Å; P837-E839 PolarHBondContact O-N 3.35Å; E839-K841 PolarHBondContact O-N 3.11Å; E839-L842 PolarHBondContact O-N 3.42Å
840	F	35.9	Very low	35.6	Very low	122 Å²	122	143.8 Å²	143.8	54%	0.535	70%	0.696	S	S	.	*	G	3₁₀ helix	trans	-72.4	-14.3	177.9	-77	-91.7	0	0	0	113.8	P836 P837 P838	P836-F840 HydrophobicContact CB-CB 3.9Å; P836-F840 HydrophobicContact CB-CD2 4.49Å; P836-F840 HydrophobicContact CB-CG 4.31Å; P837-F840 HydrophobicContact CB-CD2 4.12Å; P837-F840 HydrophobicContact CG-CD2 4.09Å; P837-F840 HydrophobicContact CG-CE2 4.17Å; P837-F840 PolarHBondContact O-N 3.48Å; P838-F840 PolarHBondContact O-N 3.17Å
841	K	39.4	Very low	35.8	Very low	130 Å²	130	140.8 Å²	140.8	57%	0.565	69%	0.688	S	S	*	*	G	3₁₀ helix	trans	-78.9	-25.9	176.6	-163.2	177.8	178.9	-72.3	0	112.1	P838 E839 I843 Y844 E845	P838-K841 WeakPolarHBondContact O-CB 3.24Å; P838-K841 PolarHBondContact O-N 3.49Å; E839-K841 PolarHBondContact O-N 3.11Å; K841-I843 PolarHBondContact O-N 2.82Å; K841-Y844 PolarHBondContact O-N 3.11Å; K841-E845 IonicContact NZ-OE1 2.71Å; K841-E845 PolarHBondContact NZ-OE1 3.2Å
842	L	38	Very low	36.2	Very low	140 Å²	140	140.6 Å²	140.6	73%	0.733	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-82.2	5	175.5	-76.3	163.2	0	0	0	113.8	E839	E839-L842 PolarHBondContact O-N 3.42Å
843	I	36	Very low	36.4	Very low	133 Å²	133	140.2 Å²	140.2	68%	0.682	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-116.7	0.7	175.9	-54.3	171.9	0	0	0	110.1	K841	K841-I843 PolarHBondContact O-N 2.82Å
844	Y	30.4	Very low	36.8	Very low	175 Å²	175	136.5 Å²	136.5	69%	0.686	67%	0.672	S	S	*	*			trans	-118.2	-4.4	-178.1	-111.6	-71	0	0	0	113.4	K841	K841-Y844 PolarHBondContact O-N 3.11Å
845	E	33.2	Very low	36.9	Very low	189 Å²	189	138.1 Å²	138.1	88%	0.883	66%	0.663	S	S	*	*			trans	-103.1	0	161.8	-76.7	167.9	-165.7	0	0	107.8	K841	K841-E845 IonicContact NZ-OE1 2.71Å; K841-E845 PolarHBondContact NZ-OE1 3.2Å

Retrieved 845 of 845 residues in 163.4 ms (Link to these results)

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