A0A3Q0KRV6_SCHMA Loading...

Putative transcriptional repressor protein yy (Yin and yang) (Delta transcription factor)

AlphaFold DB , UniProt , Accession A0A3Q0KRV6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 995 aa.

						>A0A3Q0KRV6_SCHMA|A0A3Q0KRV6
MIGSFFDDSSIKNELNSDFSTNCYSTVDLQSDFSLDNVEIYPEMPNNDSYGALFLMDSADLLDVREEVIGEEHLASNLDQPPYIEGLPKKFGLFSTKSSRISTSHKDKGNKELDVFHDKNSFSDEQKHNKCPWNDGSEEITDKAYLCNPDSPLSISNDIGVTSSDNIDEVFDKDHVTSHDIIDGDDVSLERLSDLHIPLPLFHTESNYSDSSQINPSDSEVDACGLFSSDNCATNQSDDYVQIKHLTSPDSSNSNSNESTTKIPTIVPVSSLSSAEKTELIRLPSHANHLTTTVNPSYPSRPISTCLSLKSKYRRCGQITLKSGASILRTKSSFNELKPCFKPTFTSTRIAHCGFLAAPRFPGSMKESAVSPTWFPKVAFVNSNTPLTLRKPAIVIASSYPNSRSDATYLKSEGINFMTHSSVMQSTDLQSSLLYSQNGFYISTMRHNSLGGNNPGDLASLVTATIPSDFTSNRTVFCPHLGCGKTFRDTAAMRKHLHTHGPRVHICAECGKAFVESSKLKRHQLVHTGEKPYQCAFDGCGKRFSLDFNLRTHLRIHTGDRPYPCPQPGCSKRFAQSTNLKSHLATHSKIRATHQSSFMNRHHLNSTVNSGGVGSVLLRPAAAAHPNHTHDQHIPNSLNGSILQSPMNFSTIIPIGSKDINVRNRCVNRFKSNLSSLFQEVHLENSRLHTSSLLNINNTLSIPTSSPDQCEPTDISPLSPLDLTSSSTESNSSTLSSQSATNHIKYNISSSSSVISKTQQLFTNAIESQLNEFTNPTTTSDAVQLFENHSLESSINLDHEKIDLSIGVTQPMINKTDEDFSNNSHVNIDDIYYQPSFIKPESDIIINSSIPPMQNCKTSTRRSRKCLSITKRSESPNFEDFLKTQDDISFTENDPLSKHHFYLDNGNDHLSSNNKTTTLKSPYRRRRRRHCKSKSDSNKYICKTSSHSNNNMLITSSHYGTRSKSRESFDKLLPNNQRGRRRCTLKTCAKRRFRP
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.8	Very low	32	Very low	230 Å²	230	135.9 Å²	135.9	100%	1.133	75%	0.746	S	S	*	*				0	131.8	0	-74.5	152.2	171.4	0	0	107.5
2	I	28.4	Very low	32.1	Very low	169 Å²	169	137.6 Å²	137.6	87%	0.867	74%	0.741	S	S	*	*				28.2	127.9	115.9	-44.9	161.3	0	0	0	114.1
3	G	27.1	Very low	32	Very low	57 Å²	57	135.4 Å²	135.4	59%	0.588	73%	0.729	S	S	*	*			cis	169	134.1	3.7	0	0	0	0	0	106.6
4	S	31.6	Very low	32	Very low	92 Å²	92	136.6 Å²	136.6	64%	0.643	73%	0.727	S	S	*	*				76.6	131.7	93.5	66.8	0	0	0	0	115.6
5	F	29.8	Very low	32	Very low	167 Å²	167	137.5 Å²	137.5	73%	0.732	73%	0.731	S	S	*	*			trans	80.8	146.8	163.8	-55.1	-57.2	0	0	0	118.3
6	F	36.7	Very low	31.8	Very low	174 Å²	174	136.8 Å²	136.8	76%	0.763	73%	0.728	S	S	*	*			cis	-146.1	158.1	-6.9	-115.2	-53.5	0	0	0	109.5
7	D	32.3	Very low	31.6	Very low	147 Å²	147	133.5 Å²	133.5	79%	0.786	72%	0.718	S	S	*	*			trans	-75.9	161.2	169.4	-46.2	-89.1	0	0	0	112.1
8	D	34.7	Very low	31.3	Very low	159 Å²	159	133.6 Å²	133.6	85%	0.85	72%	0.718	S	S	*	*				-157.9	176.1	111.2	-143.8	-31.4	0	0	0	110.4
9	S	32.3	Very low	31.2	Very low	71 Å²	71	136.5 Å²	136.5	50%	0.497	72%	0.724	S	S	.	*			trans	-128.6	-178	-155.4	67.8	0	0	0	0	113.5
10	S	33.9	Very low	30.9	Very low	95 Å²	95	134.6 Å²	134.6	66%	0.664	72%	0.723	S	S	*	*			trans	78	147.2	147	-64.9	0	0	0	0	116.3
11	I	32.2	Very low	31.1	Very low	134 Å²	134	134 Å²	134	69%	0.687	72%	0.724	S	S	*	*			cis	-164.3	153.2	8.8	-131.5	174.7	0	0	0	115.1
12	K	32.9	Very low	30.8	Very low	156 Å²	156	129.5 Å²	129.5	68%	0.678	70%	0.704	S	S	*	*			trans	77.3	131.4	147.5	-75.7	-178.1	-173.5	169	0	125.3
13	N	31.6	Very low	30.8	Very low	109 Å²	109	126.6 Å²	126.6	58%	0.583	70%	0.698	S	S	*	*				74.6	152.7	123.3	-65.6	19.4	0	0	0	120.8
14	E	31.7	Very low	30.9	Very low	152 Å²	152	133.5 Å²	133.5	71%	0.71	71%	0.707	S	S	*	*			cis	-162.8	178	-12.4	-115.1	161.7	171.7	0	0	109.6
15	L	31.8	Very low	30.8	Very low	150 Å²	150	133.7 Å²	133.7	79%	0.785	71%	0.709	S	S	*	*			trans	70.5	150.4	172	-46.4	-179	0	0	0	114.4
16	N	29.4	Very low	30.7	Very low	127 Å²	127	131.3 Å²	131.3	68%	0.679	71%	0.708	S	S	*	*			cis	-144.8	137.4	-10.3	-113.8	-6.4	0	0	0	107.1
17	S	27.8	Very low	30.5	Very low	81 Å²	81	129.3 Å²	129.3	57%	0.566	71%	0.71	S	S	*	*				77.8	134.3	92.1	97	0	0	0	0	115.7
18	D	27.3	Very low	30.2	Very low	134 Å²	134	128.8 Å²	128.8	72%	0.717	71%	0.707	S	S	*	*			trans	72.6	166.1	158.4	-48.9	-55.9	0	0	0	121.2
19	F	27.8	Very low	30.2	Very low	189 Å²	189	129.4 Å²	129.4	83%	0.829	71%	0.709	S	S	*	*			trans	61.9	88.4	169.8	-68.2	-79.7	0	0	0	121.3
20	S	26.7	Very low	30.1	Very low	99 Å²	99	133.9 Å²	133.9	69%	0.692	72%	0.722	S	S	*	*				89.6	165.2	110.4	80.9	0	0	0	0	120.3
21	T	34.1	Very low	30.1	Very low	123 Å²	123	134.8 Å²	134.8	76%	0.755	73%	0.729	S	S	*	*			trans	-48.4	136.3	165.7	44.7	0	0	0	0	112.9
22	N	27	Very low	30	Very low	135 Å²	135	134.3 Å²	134.3	72%	0.722	73%	0.728	S	S	*	*			trans	-143.3	133.6	138.1	-111.3	-40	0	0	0	112.1	Y24	N22-Y24 HydrophobicContact CB-CD2 4.44Å; N22-Y24 HydrophobicContact CB-CE2 4.25Å
23	C	28.6	Very low	30	Very low	107 Å²	107	137 Å²	137	72%	0.723	74%	0.74	S	S	*	*			trans	-78.9	143.1	163.8	-59.2	0	0	0	0	107.7
24	Y	29.4	Very low	30.1	Very low	202 Å²	202	136.8 Å²	136.8	79%	0.792	75%	0.747	S	S	*	*			trans	-133.7	121.4	155.2	-90.3	-75	0	0	0	111.4	N22	N22-Y24 HydrophobicContact CB-CD2 4.44Å; N22-Y24 HydrophobicContact CB-CE2 4.25Å
25	S	29	Very low	30.1	Very low	97 Å²	97	136.9 Å²	136.9	68%	0.678	75%	0.751	S	S	*	*			trans	-58.2	160.3	149.7	49.7	0	0	0	0	109.5
26	T	26.8	Very low	30.2	Very low	116 Å²	116	136.4 Å²	136.4	71%	0.712	75%	0.75	S	S	*	*			cis	-150.6	167.7	42.6	48.6	0	0	0	0	112.5
27	V	32.8	Very low	30.4	Very low	132 Å²	132	136.9 Å²	136.9	80%	0.8	75%	0.752	S	S	*	*				178	124.4	124.6	150.9	0	0	0	0	107.1
28	D	27.1	Very low	30.5	Very low	137 Å²	137	138.5 Å²	138.5	73%	0.733	76%	0.759	S	S	*	*			trans	-78.1	137.6	177.1	-55.7	-85.5	0	0	0	111.7
29	L	34.8	Very low	30.7	Very low	171 Å²	171	139.7 Å²	139.7	90%	0.895	76%	0.76	S	S	*	*			trans	-142.7	113.1	145.3	-83.8	-173	0	0	0	109.6
30	Q	28.8	Very low	30.9	Very low	165 Å²	165	136.6 Å²	136.6	77%	0.771	75%	0.751	S	S	*	*			trans	-71.8	141.9	171.5	-64.4	155.7	-95.2	0	0	110.3
31	S	34.7	Very low	31	Very low	114 Å²	114	141.5 Å²	141.5	80%	0.797	76%	0.756	S	S	*	*			trans	-152.8	113.7	146.5	47.4	0	0	0	0	108.7
32	D	29.2	Very low	31	Very low	125 Å²	125	141.5 Å²	141.5	67%	0.668	76%	0.757	S	S	*	*			trans	-81.8	135.5	-170.9	-47.3	-89.4	0	0	0	111.6
33	F	33.6	Very low	31	Very low	212 Å²	212	143.2 Å²	143.2	93%	0.93	76%	0.761	S	S	*	*			trans	-144.2	94.3	156	-93.1	-71.3	0	0	0	109.7
34	S	32.8	Very low	31.1	Very low	105 Å²	105	147 Å²	147	73%	0.734	77%	0.77	S	S	*	*			trans	-73.1	141.2	172.3	-66.3	0	0	0	0	111.6
35	L	32.6	Very low	31.1	Very low	153 Å²	153	142.5 Å²	142.5	80%	0.801	77%	0.766	S	S	*	*			trans	28.9	137.6	135.7	-63.1	165.8	0	0	0	120
36	D	33.6	Very low	31	Very low	141 Å²	141	144.7 Å²	144.7	75%	0.754	77%	0.77	S	S	*	*				-158.9	150.6	112.3	-102.9	-19.6	0	0	0	111.9
37	N	34.3	Very low	31.2	Very low	136 Å²	136	146.3 Å²	146.3	73%	0.727	78%	0.775	S	S	*	*			trans	67.6	115.4	166.6	-53.7	-40.7	0	0	0	117.4
38	V	29.9	Very low	30.9	Very low	116 Å²	116	148 Å²	148	70%	0.703	78%	0.779	S	S	*	*			cis	65.3	116.7	29.7	-161.5	0	0	0	0	108.9
39	E	30.9	Very low	31	Very low	159 Å²	159	144.9 Å²	144.9	74%	0.743	77%	0.768	S	S	*	*			cis	-166.1	-178.8	25.5	-137.7	167.7	-153.6	0	0	115
40	I	32.4	Very low	30.8	Very low	124 Å²	124	147.3 Å²	147.3	64%	0.636	77%	0.767	S	S	*	*			trans	76.3	99.5	151.1	-66.7	157.5	0	0	0	121.2
41	Y	29.4	Very low	30.7	Very low	202 Å²	202	142.8 Å²	142.8	79%	0.792	76%	0.764	S	S	*	*				47.8	165.6	120.7	-64.8	-65.7	0	0	0	123.4
42	P	32.7	Very low	30.3	Very low	122 Å²	122	141.7 Å²	141.7	79%	0.792	76%	0.762	S	S	*	*			cis	-127.4	179.1	8.5	43.1	-27.5	0	0	0	117.4
43	E	26.8	Very low	30.4	Very low	172 Å²	172	143.9 Å²	143.9	80%	0.804	77%	0.773	S	S	*	*			trans	-77.8	162.6	175.9	-49.8	173.7	125.4	0	0	113.7
44	M	31.2	Very low	30.2	Very low	185 Å²	185	140.1 Å²	140.1	91%	0.911	76%	0.757	S	S	*	*			trans	-166.1	160.8	152.1	-98.8	-81.1	137.7	0	0	109.2
45	P	30.9	Very low	30.1	Very low	108 Å²	108	140.2 Å²	140.2	70%	0.701	75%	0.748	S	S	*	*			trans	-96.6	163.4	-137.3	35.6	-40.7	0	0	0	118.4
46	N	25.7	Very low	30	Very low	143 Å²	143	140 Å²	140	77%	0.765	75%	0.745	S	S	*	*			trans	-58.1	148.2	164.6	-64.3	-31.9	0	0	0	112.3
47	N	30.3	Very low	29.7	Very low	151 Å²	151	138.1 Å²	138.1	81%	0.807	74%	0.735	S	S	*	*			trans	-153.1	99.9	165.4	-142.4	-9.8	0	0	0	111	S49	N47-S49 PolarHBondContact O-N 3.45Å
48	D	26.7	Very low	29.6	Very low	166 Å²	166	136.1 Å²	136.1	89%	0.888	73%	0.731	S	S	*	*			trans	-78.2	98.9	179.7	-76.5	-59	0	0	0	111.5
49	S	30	Very low	29.5	Very low	72 Å²	72	134.4 Å²	134.4	50%	0.503	73%	0.73	S	S	.	*			trans	-174.2	169.6	161.4	36.9	0	0	0	0	112	N47	N47-S49 PolarHBondContact O-N 3.45Å
50	Y	29.5	Very low	29.5	Very low	222 Å²	222	134 Å²	134	87%	0.871	73%	0.733	S	S	*	*			trans	67.3	122.6	177.1	-47	-80.5	0	0	0	115
51	G	27	Very low	29.5	Very low	70 Å²	70	136.8 Å²	136.8	72%	0.722	75%	0.748	S	S	*	*			cis	104.7	111.5	2.9	0	0	0	0	0	112.6
52	A	27.3	Very low	29.7	Very low	91 Å²	91	134.5 Å²	134.5	75%	0.752	75%	0.748	S	S	*	*			trans	58.7	84.9	169.7	0	0	0	0	0	118
53	L	30.5	Very low	29.8	Very low	171 Å²	171	136.6 Å²	136.6	90%	0.895	75%	0.753	S	S	*	*			trans	-118.9	91.7	156.7	-84.9	175.8	0	0	0	112.8
54	F	29.8	Very low	30.1	Very low	134 Å²	134	134.5 Å²	134.5	59%	0.588	75%	0.752	S	S	*	*			trans	29.4	105.7	136.4	-72.2	-115.6	0	0	0	118	M56 N473	F54-M56 PolarHBondContact O-N 3.22Å; F54-N473 VanDerWaalsContact CD1-ND2 3.29Å; F54-N473 WeakPolarHBondContact CD1-ND2 3.31Å; F54-N473 HydrophobicContact CE1-CB 4.27Å; F54-N473 WeakPolarHBondContact CE1-ND2 3.49Å
55	L	30.4	Very low	30.3	Very low	107 Å²	107	136.7 Å²	136.7	56%	0.56	75%	0.75	S	S	*	*			trans	-67.9	121.1	156.8	-74.9	174.9	0	0	0	110.1
56	M	30.5	Very low	30.6	Very low	149 Å²	149	140.2 Å²	140.2	73%	0.734	76%	0.757	S	S	*	*			trans	-107.3	104.6	163.4	-77.8	-165.5	163.4	0	0	110.6	F54 S58	F54-M56 PolarHBondContact O-N 3.22Å; M56-S58 PolarHBondContact O-N 3.24Å
57	D	27.5	Very low	31	Very low	100 Å²	100	141.8 Å²	141.8	54%	0.535	76%	0.76	S	S	.	*			trans	-66.3	111.6	157.6	10.1	-61.3	0	0	0	110.1	R488	D57-R488 VanDerWaalsContact O-CZ 3.29Å; D57-R488 PolarHBondContact O-NH1 3.16Å; D57-R488 PolarHBondContact O-NH2 2.94Å; D57-R488 IonicContact OD1-CZ 3.36Å; D57-R488 IonicContact OD1-NE 3.53Å; D57-R488 IonicContact OD1-NH1 2.68Å; D57-R488 WeakPolarHBondContact OD2-CD 3.07Å; D57-R488 IonicContact OD2-CZ 2.79Å; D57-R488 IonicContact OD2-NE 3.95Å; D57-R488 IonicContact OD2-NH1 4Å; D57-R488 PolarHBondContact OD2-NH1 3.39Å
58	S	31.4	Very low	31.3	Very low	94 Å²	94	141.6 Å²	141.6	66%	0.657	76%	0.764	S	S	*	*			trans	-136.9	123.4	155.4	-53.4	0	0	0	0	104.4	M56	M56-S58 PolarHBondContact O-N 3.24Å
59	A	29.9	Very low	31.7	Very low	81 Å²	81	141 Å²	141	67%	0.669	76%	0.759	S	S	*	*				58.2	123.9	52.8	0	0	0	0	0	111.9
60	D	30.2	Very low	32	Very low	151 Å²	151	140.3 Å²	140.3	81%	0.807	76%	0.763	S	S	*	*			trans	61.2	76.5	158.6	-46.7	-30.1	0	0	0	117.5
61	L	31.3	Very low	32.2	Very low	181 Å²	181	138.3 Å²	138.3	95%	0.948	76%	0.762	S	S	*	*			trans	-100.4	84.8	146.6	-82.9	174.5	0	0	0	109.5
62	L	34.9	Very low	32.5	Very low	154 Å²	154	142.5 Å²	142.5	81%	0.806	76%	0.763	S	S	*	*	S	Bend	trans	-126.4	148.4	158	-74.1	175.4	0	0	0	107.5	V64	L62-V64 PolarHBondContact O-N 3.36Å
63	D	33.5	Very low	32.8	Very low	167 Å²	167	145.3 Å²	145.3	89%	0.893	76%	0.76	S	S	*	*			trans	-57.2	122.6	-170.2	-80.8	-64.6	0	0	0	113.8
64	V	34.1	Very low	32.9	Very low	127 Å²	127	144.5 Å²	144.5	77%	0.77	76%	0.756	S	S	*	*			trans	-94.2	97.9	164.1	-179.2	0	0	0	0	108.7	L62	L62-V64 PolarHBondContact O-N 3.36Å
65	R	34.6	Very low	33	Very low	231 Å²	231	142.1 Å²	142.1	87%	0.872	76%	0.76	S	S	*	*			trans	-117.4	91.7	155.6	-87.2	-172.4	164.4	-161.1	-5.8	108.3
66	E	37.3	Very low	33.2	Very low	182 Å²	182	141.8 Å²	141.8	85%	0.85	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-83.7	148.8	162.5	-73.3	-164.7	129.5	0	0	110.3
67	E	34.2	Very low	33.3	Very low	176 Å²	176	141.4 Å²	141.4	82%	0.822	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-85	137.7	-175.2	-59	177.6	124.2	0	0	111.6
68	V	37.9	Very low	33.6	Very low	148 Å²	148	142.8 Å²	142.8	90%	0.897	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-99.2	118.6	162.1	174.7	0	0	0	0	107.5
69	I	34.4	Very low	33.8	Very low	152 Å²	152	143.2 Å²	143.2	78%	0.779	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-89.3	131.8	-176.6	-62.9	172.2	0	0	0	110.6
70	G	35	Very low	33.9	Very low	58 Å²	58	147.1 Å²	147.1	60%	0.598	77%	0.774	S	S	*	*			trans	178.8	104.2	166.8	0	0	0	0	0	106.8
71	E	35.4	Very low	34.3	Very low	181 Å²	181	144.4 Å²	144.4	85%	0.846	77%	0.765	S	S	*	*				50.5	103	88.2	-62.8	-171.9	160.6	0	0	109.3
72	E	32.8	Very low	34.6	Very low	157 Å²	157	141.4 Å²	141.4	73%	0.734	76%	0.756	S	S	*	*			cis	-163.9	165.3	42.4	-118	172.7	-172.1	0	0	114.8
73	H	32.4	Very low	34.2	Very low	150 Å²	150	145.1 Å²	145.1	69%	0.694	76%	0.761	S	S	*	*			trans	69.1	121.2	150.4	-71.7	-50.7	0	0	0	124.8
74	L	32.7	Very low	34.3	Very low	155 Å²	155	144.7 Å²	144.7	81%	0.812	76%	0.757	S	S	*	*			trans	82.3	91.5	147.7	-87.3	76.3	0	0	0	122.1
75	A	33.3	Very low	34.1	Very low	83 Å²	83	148 Å²	148	69%	0.686	76%	0.764	S	S	*	*				79	110.5	116.4	0	0	0	0	0	122.8
76	S	33.8	Very low	34.1	Very low	100 Å²	100	140.9 Å²	140.9	70%	0.699	76%	0.763	S	S	*	*			trans	67.8	141.4	136.6	56.3	0	0	0	0	120.7
77	N	32.6	Very low	33.9	Very low	142 Å²	142	138.8 Å²	138.8	76%	0.759	76%	0.757	S	S	*	*			cis	-159.1	159.5	-6.1	-101.9	-18	0	0	0	109.9
78	L	34.5	Very low	33.8	Very low	128 Å²	128	136.4 Å²	136.4	67%	0.67	76%	0.757	S	S	*	*			trans	18.3	147.7	150	-72.2	80.5	0	0	0	120.6
79	D	36	Very low	33.5	Very low	103 Å²	103	137.3 Å²	137.3	55%	0.551	75%	0.749	S	S	*	*			cis	-151.6	163	44.7	-111.8	-55.2	0	0	0	115	Y298	D79-Y298 VanDerWaalsContact OD1-CE2 3.24Å; D79-Y298 WeakPolarHBondContact OD1-CE2 3.18Å; D79-Y298 PolarHBondContact OD1-OH 2.94Å; D79-Y298 WeakPolarHBondContact OD2-CE2 3.23Å
80	Q	31	Very low	33.5	Very low	164 Å²	164	140.1 Å²	140.1	77%	0.766	76%	0.755	S	S	*	*			trans	-159	-175.9	176	-148.4	-160.4	34.5	0	0	110.7
81	P	39.3	Very low	33.2	Very low	93 Å²	93	147 Å²	147	60%	0.604	77%	0.769	S	S	*	*				-86.4	-153	-106.2	42.8	-28.8	0	0	0	113.4
82	P	36	Very low	32.9	Very low	119 Å²	119	142.1 Å²	142.1	77%	0.773	77%	0.767	S	S	*	*			trans	-129	143.9	139.1	36.7	-28	0	0	0	114.4
83	Y	27.8	Very low	32.8	Very low	232 Å²	232	141.8 Å²	141.8	91%	0.91	77%	0.77	S	S	*	*			trans	-112	146.6	163.9	-140.7	-91.9	0	0	0	106.8
84	I	34.5	Very low	32.6	Very low	158 Å²	158	145.2 Å²	145.2	81%	0.81	78%	0.783	S	S	*	*			trans	-122.8	136.5	-179.6	-62.9	-178.4	0	0	0	110.7
85	E	31.2	Very low	32.5	Very low	195 Å²	195	141.8 Å²	141.8	91%	0.911	77%	0.772	S	S	*	*			trans	-87.8	155.5	-175.9	-57.3	-175.4	109.5	0	0	113.3
86	G	33.6	Very low	32.4	Very low	83 Å²	83	143.4 Å²	143.4	86%	0.856	77%	0.774	S	S	*	*			trans	-169.1	71.3	178.7	0	0	0	0	0	115
87	L	32.7	Very low	32.3	Very low	137 Å²	137	147.9 Å²	147.9	72%	0.717	78%	0.78	S	S	*	*			trans	-91.2	148.8	178.2	-112.1	168.3	0	0	0	112	K89	L87-K89 HydrophobicContact CD2-CG 4.16Å
88	P	33.5	Very low	32.1	Very low	126 Å²	126	147 Å²	147	82%	0.818	79%	0.786	S	S	*	*				-146.9	169.5	102.7	37.5	-21.5	0	0	0	116.3
89	K	31.1	Very low	31.9	Very low	168 Å²	168	145.6 Å²	145.6	73%	0.73	79%	0.786	S	S	*	*			trans	-99.1	148.3	-174.2	-60.3	148.9	-176.9	162.1	0	112.5	L87	L87-K89 HydrophobicContact CD2-CG 4.16Å
90	K	33.9	Very low	31.6	Very low	211 Å²	211	151.8 Å²	151.8	92%	0.917	80%	0.802	S	S	*	*			trans	-155.8	155.5	143.9	-110.8	161.7	-172.3	176	0	112.1
91	F	29.3	Very low	31.5	Very low	203 Å²	203	152.4 Å²	152.4	89%	0.89	81%	0.809	S	S	*	*			trans	-105.1	156.8	-168.8	-78.1	-113	0	0	0	112.1
92	G	30.1	Very low	31	Very low	78 Å²	78	152.1 Å²	152.1	80%	0.804	81%	0.809	S	S	*	*			trans	-165	33.3	-179.1	0	0	0	0	0	118.6
93	L	29.3	Very low	30.8	Very low	150 Å²	150	153.4 Å²	153.4	79%	0.785	81%	0.814	S	S	*	*			trans	-1	127.7	168	-69.7	164.7	0	0	0	119.8
94	F	29.2	Very low	30.8	Very low	222 Å²	222	146.8 Å²	146.8	97%	0.974	80%	0.802	S	S	*	*				-148	153.9	119.3	-111.3	-74.4	0	0	0	111.1
95	S	30.1	Very low	30.7	Very low	83 Å²	83	146.4 Å²	146.4	58%	0.58	80%	0.797	S	S	*	*			trans	-152.2	122.9	-156.9	-172	0	0	0	0	115.3
96	T	30.4	Very low	30.8	Very low	117 Å²	117	145.2 Å²	145.2	72%	0.718	79%	0.789	S	S	*	*			trans	59.6	142.8	148.5	63.8	0	0	0	0	121
97	K	31.9	Very low	30.7	Very low	193 Å²	193	146.3 Å²	146.3	84%	0.839	78%	0.775	S	S	*	*				-166.9	107.5	110.8	-99.2	150.8	-171.4	168.8	0	112.3
98	S	28.4	Very low	30.8	Very low	125 Å²	125	148.4 Å²	148.4	87%	0.874	78%	0.778	S	S	*	*			trans	-107.8	128.5	143.4	-173.7	0	0	0	0	106.8
99	S	31	Very low	30.8	Very low	97 Å²	97	145.7 Å²	145.7	68%	0.678	77%	0.773	S	S	*	*			trans	-163.1	103.3	-169.3	-70.7	0	0	0	0	112.3
100	R	29.9	Very low	30.8	Very low	234 Å²	234	145.1 Å²	145.1	88%	0.883	78%	0.778	S	S	*	*			trans	-160.4	75.1	159.9	-139.1	-178.3	-78.5	-174	-2.7	114.7
101	I	29.4	Very low	30.9	Very low	177 Å²	177	143.4 Å²	143.4	91%	0.908	77%	0.771	S	S	*	*			trans	-122.9	124.8	141.3	-64.4	-175	0	0	0	107.3
102	S	27.5	Very low	31	Very low	87 Å²	87	140.9 Å²	140.9	61%	0.608	76%	0.762	S	S	*	*			trans	-102.7	141.3	-173.8	56.7	0	0	0	0	112
103	T	31.8	Very low	31.1	Very low	145 Å²	145	144.2 Å²	144.2	89%	0.89	76%	0.76	S	S	*	*			trans	-144.1	153.8	144.5	12.2	0	0	0	0	109.3
104	S	28.5	Very low	31.1	Very low	93 Å²	93	142.7 Å²	142.7	65%	0.65	75%	0.753	S	S	*	*			trans	-68	154.4	-175.5	45.8	0	0	0	0	111.9
105	H	32.2	Very low	31.2	Very low	150 Å²	150	137.7 Å²	137.7	69%	0.694	74%	0.74	S	S	*	*				-159.1	162.9	54.3	-97.4	-86.9	0	0	0	114.5
106	K	33.2	Very low	31.2	Very low	171 Å²	171	141.3 Å²	141.3	74%	0.743	75%	0.745	S	S	*	*			trans	18	137.8	139.2	-62.5	-178.3	178.8	-178.3	0	118.2
107	D	31.8	Very low	31.3	Very low	106 Å²	106	140.7 Å²	140.7	57%	0.567	73%	0.734	S	S	*	*			cis	-161.3	151.9	15.2	-121	-10.3	0	0	0	112.6
108	K	35.3	Very low	31	Very low	180 Å²	180	139 Å²	139	78%	0.783	73%	0.734	S	S	*	*			trans	55.1	116	145.1	-64.3	158.8	-173.9	147.1	0	122
109	G	33.2	Very low	31.2	Very low	69 Å²	69	140.8 Å²	140.8	71%	0.711	73%	0.727	S	S	*	*			trans	96.3	151.9	139.5	0	0	0	0	0	117.6
110	N	30.6	Very low	31.1	Very low	157 Å²	157	143.3 Å²	143.3	84%	0.84	73%	0.732	S	S	*	*			cis	-174.2	154.6	-22.7	-115.6	8.7	0	0	0	107.2
111	K	35.5	Very low	30.9	Very low	175 Å²	175	136.7 Å²	136.7	76%	0.761	72%	0.722	S	S	*	*			trans	74.5	112.5	175	-53.7	-160.3	170.4	-169.1	0	114.6
112	E	32.3	Very low	30.9	Very low	150 Å²	150	137.3 Å²	137.3	70%	0.701	72%	0.718	S	S	*	*				80.5	114.8	84	-71.8	166.2	127.1	0	0	110.8
113	L	32.2	Very low	30.9	Very low	147 Å²	147	137.3 Å²	137.3	77%	0.77	72%	0.718	S	S	*	*				70.5	140.1	75.9	-67.5	178.9	0	0	0	111.2
114	D	29.3	Very low	30.7	Very low	119 Å²	119	136.8 Å²	136.8	64%	0.636	71%	0.71	S	S	*	*			cis	-162.3	-169.6	15	-141.7	-34	0	0	0	111.7
115	V	31.5	Very low	30.7	Very low	116 Å²	116	139.2 Å²	139.2	70%	0.703	71%	0.711	S	S	*	*			trans	69.4	143.8	150.5	160.9	0	0	0	0	116.5
116	F	29.5	Very low	30.7	Very low	159 Å²	159	138.3 Å²	138.3	70%	0.697	71%	0.707	S	S	*	*			cis	-171.9	-175.3	-30.1	-115.2	-25.8	0	0	0	106.2
117	H	32.2	Very low	30.6	Very low	104 Å²	104	137 Å²	137	48%	0.481	70%	0.702	S	S	.	*			cis	-151.3	155.9	1.2	-136.9	-52.5	0	0	0	108.9	K119	H117-K119 WeakPolarHBondContact CE1-CE 3.3Å; H117-K119 WeakPolarHBondContact NE2-CE 3.43Å
118	D	25.8	Very low	30.5	Very low	157 Å²	157	139.2 Å²	139.2	84%	0.84	71%	0.708	S	S	*	*			trans	-119.7	145.9	145.6	-92.8	-51.1	0	0	0	108.4
119	K	32.1	Very low	30.2	Very low	164 Å²	164	136.9 Å²	136.9	71%	0.713	70%	0.704	S	S	*	*			trans	-147.1	111.5	166.2	-68.7	-171.5	-177.2	179.3	0	106.3	H117	H117-K119 WeakPolarHBondContact CE1-CE 3.3Å; H117-K119 WeakPolarHBondContact NE2-CE 3.43Å
120	N	28.7	Very low	30.2	Very low	149 Å²	149	142.1 Å²	142.1	80%	0.797	71%	0.707	S	S	*	*				42.7	96.9	71	-81.8	26.7	0	0	0	113.9
121	S	27	Very low	30.1	Very low	95 Å²	95	140.1 Å²	140.1	66%	0.664	71%	0.705	S	S	*	*				10.2	134	128.4	46.2	0	0	0	0	118.6
122	F	28.2	Very low	30.2	Very low	190 Å²	190	136.8 Å²	136.8	83%	0.833	70%	0.701	S	S	*	*				-159.8	170.7	93.4	-124.4	-94.7	0	0	0	112.5
123	S	27.1	Very low	30.2	Very low	87 Å²	87	142.2 Å²	142.2	61%	0.608	72%	0.715	S	S	*	*			trans	-67.1	-177.9	171.9	-36	0	0	0	0	112.1
124	D	28.2	Very low	30.1	Very low	135 Å²	135	141.6 Å²	141.6	72%	0.722	71%	0.713	S	S	*	*			cis	-150	167.7	25.2	-92.9	-53.9	0	0	0	114.1
125	E	28.6	Very low	30.3	Very low	143 Å²	143	143.1 Å²	143.1	67%	0.668	72%	0.721	S	S	*	*			trans	7.3	145.1	152.2	-52.2	-167.3	116.2	0	0	122.7
126	Q	32	Very low	30.4	Very low	132 Å²	132	141.6 Å²	141.6	62%	0.617	73%	0.728	S	S	*	*				-178.1	137.8	88.1	-92.8	-167.7	8.2	0	0	116.6
127	K	31.6	Very low	30.4	Very low	144 Å²	144	139.3 Å²	139.3	63%	0.626	73%	0.732	S	S	*	*			trans	79.2	129.7	136.6	-78.9	172.3	179.4	153.9	0	124.2
128	H	30.2	Very low	30.5	Very low	151 Å²	151	143.3 Å²	143.3	70%	0.699	75%	0.751	S	S	*	*			trans	67.2	132.8	142.3	-59.6	-40.2	0	0	0	118
129	N	29.5	Very low	30.6	Very low	132 Å²	132	144.2 Å²	144.2	71%	0.706	75%	0.75	S	S	*	*			cis	-164.9	155.2	29.1	-110.5	-30.5	0	0	0	114.6
130	K	32.8	Very low	30.8	Very low	178 Å²	178	144.1 Å²	144.1	77%	0.774	76%	0.756	S	S	*	*			trans	60	105.8	146.9	-68.8	-174.8	174.7	-175.8	0	123.5
131	C	28.7	Very low	30.8	Very low	116 Å²	116	142 Å²	142	78%	0.784	75%	0.748	S	S	*	*				59.9	171.4	107.7	-57.3	0	0	0	0	121.5
132	P	36.8	Very low	31	Very low	105 Å²	105	142.6 Å²	142.6	68%	0.682	74%	0.744	S	S	*	*				-139.4	152	-56.6	39.4	-24.4	0	0	0	113.9
133	W	33.5	Very low	31.1	Very low	263 Å²	263	141.5 Å²	141.5	100%	0.996	74%	0.739	S	S	*	*			trans	-140.3	142	155.6	-84.2	78.3	0	0	0	109.4
134	N	29.3	Very low	31.1	Very low	135 Å²	135	140.7 Å²	140.7	72%	0.722	74%	0.737	S	S	*	*			trans	-148.2	-173.3	-170.5	-158.1	71.7	0	0	0	109.5
135	D	33	Very low	31.1	Very low	151 Å²	151	143.8 Å²	143.8	81%	0.807	74%	0.74	S	S	*	*			trans	77.3	136.7	169.1	-47.5	-30.4	0	0	0	116.1
136	G	34.8	Very low	31.1	Very low	83 Å²	83	144 Å²	144	86%	0.856	75%	0.745	S	S	*	*			trans	147.9	43.4	-173.8	0	0	0	0	0	114.7
137	S	28.5	Very low	30.8	Very low	111 Å²	111	143.3 Å²	143.3	78%	0.776	75%	0.754	S	S	*	*			trans	-79.6	142.6	175.4	53	0	0	0	0	112.3
138	E	34.6	Very low	30.7	Very low	188 Å²	188	143.8 Å²	143.8	88%	0.879	76%	0.763	S	S	*	*			trans	-166.2	154.1	134.4	-113.4	164.7	-154.2	0	0	112.6
139	E	28.1	Very low	31.1	Very low	177 Å²	177	141 Å²	141	83%	0.827	76%	0.758	S	S	*	*			trans	-97.5	136.2	179.4	-56.9	170.3	112.1	0	0	110.4
140	I	36.4	Very low	31.1	Very low	162 Å²	162	140.7 Å²	140.7	83%	0.831	76%	0.757	S	S	*	*			trans	-133.2	135.2	151.3	-76.9	96.5	0	0	0	108.8
141	T	28.2	Very low	31.2	Very low	104 Å²	104	137 Å²	137	64%	0.638	75%	0.753	S	S	*	*			trans	-99.1	-178	-173.3	50.6	0	0	0	0	113.1
142	D	31	Very low	31.6	Very low	107 Å²	107	136.8 Å²	136.8	57%	0.572	75%	0.75	S	S	*	*			trans	84.3	114.5	144.3	-81.1	-22.8	0	0	0	122.3
143	K	30.3	Very low	31.2	Very low	168 Å²	168	139.5 Å²	139.5	73%	0.73	76%	0.758	S	S	*	*				67	156.2	127.9	-61	160.8	-172.9	142.2	0	118.1
144	A	27.5	Very low	31.1	Very low	69 Å²	69	132.7 Å²	132.7	57%	0.57	75%	0.751	S	S	*	*			cis	-170.3	163.1	-29.3	0	0	0	0	0	105.2
145	Y	28.6	Very low	31	Very low	200 Å²	200	132.9 Å²	132.9	78%	0.784	75%	0.75	S	S	*	*				170.7	150.5	60	-96.7	-61.9	0	0	0	108.6
146	L	28.2	Very low	31	Very low	148 Å²	148	131.2 Å²	131.2	78%	0.775	75%	0.751	S	S	*	*			trans	58.2	163.1	141.8	-58.7	171.1	0	0	0	121
147	C	25	Very low	30.6	Very low	117 Å²	117	133.5 Å²	133.5	79%	0.791	74%	0.743	S	S	*	*			cis	-160.6	175.1	-43.3	-115.6	0	0	0	0	112.5
148	N	30.8	Very low	30.9	Very low	155 Å²	155	134.8 Å²	134.8	83%	0.829	74%	0.742	S	S	*	*			trans	-88.5	-167	179.5	-97.1	3.3	0	0	0	113.1
149	P	36.9	Very low	30.5	Very low	92 Å²	92	133.6 Å²	133.6	60%	0.597	74%	0.74	S	S	*	*			cis	-143	-161.6	-40.2	39.4	-18.6	0	0	0	115.5
150	D	31.5	Very low	30.6	Very low	126 Å²	126	128.6 Å²	128.6	67%	0.674	74%	0.735	S	S	*	*			trans	79.3	146.4	148.4	-72.7	-28.2	0	0	0	123.8
151	S	33.2	Very low	30.1	Very low	100 Å²	100	127.9 Å²	127.9	70%	0.699	74%	0.738	S	S	*	*			cis	-157.3	-81	-26.1	-110.8	0	0	0	0	119.2
152	P	37.2	Very low	30	Very low	111 Å²	111	129.5 Å²	129.5	72%	0.721	75%	0.748	S	S	*	*			trans	-139.1	175.4	-140.4	43.1	-25.3	0	0	0	122.5
153	L	29.9	Very low	29.8	Very low	163 Å²	163	129.9 Å²	129.9	85%	0.853	76%	0.759	S	S	*	*			trans	82.5	151.8	166.4	-58.7	178.8	0	0	0	119
154	S	31.1	Very low	29.8	Very low	119 Å²	119	127.3 Å²	127.3	83%	0.832	76%	0.762	S	S	*	*			cis	-136.6	-157.8	23.9	69.9	0	0	0	0	116.5
155	I	27.4	Very low	29.8	Very low	139 Å²	139	130.9 Å²	130.9	71%	0.713	77%	0.772	S	S	*	*			trans	-119.6	149.4	-154.7	-61.6	159.9	0	0	0	112.9
156	S	32.1	Very low	29.8	Very low	117 Å²	117	128.9 Å²	128.9	82%	0.818	78%	0.775	S	S	*	*			trans	-156.5	147.4	140.8	-145.9	0	0	0	0	112.3
157	N	27.2	Very low	29.7	Very low	131 Å²	131	129.3 Å²	129.3	70%	0.701	78%	0.776	S	S	*	*			trans	-89.3	165	174.7	-63.1	-38.9	0	0	0	110.2
158	D	33.1	Very low	29.9	Very low	138 Å²	138	129.4 Å²	129.4	74%	0.738	77%	0.769	S	S	*	*				-172.3	144.5	86.4	-91.7	-24.5	0	0	0	115
159	I	27.7	Very low	29.9	Very low	163 Å²	163	131.1 Å²	131.1	84%	0.836	77%	0.772	S	S	*	*			trans	41.5	123.1	136.5	-50.6	171.3	0	0	0	119.6
160	G	29.5	Very low	29.6	Very low	72 Å²	72	132.4 Å²	132.4	74%	0.742	78%	0.778	S	S	*	*			trans	167.1	61.4	162.1	0	0	0	0	0	117.5
161	V	27.1	Very low	29.6	Very low	147 Å²	147	136 Å²	136	89%	0.891	79%	0.788	S	S	*	*			trans	-100.9	117.3	177.5	178.1	0	0	0	0	111.9
162	T	25.8	Very low	29.4	Very low	138 Å²	138	137.3 Å²	137.3	85%	0.847	79%	0.787	S	S	*	*			trans	-140.7	157.5	154	46.1	0	0	0	0	111.1
163	S	27.1	Very low	29	Very low	115 Å²	115	140.5 Å²	140.5	80%	0.804	79%	0.79	S	S	*	*			trans	-57.9	142.5	-172.2	52.1	0	0	0	0	116.7
164	S	29.5	Very low	28.9	Very low	114 Å²	114	140.1 Å²	140.1	80%	0.797	79%	0.788	S	S	*	*			trans	-160.6	158.4	131.7	50.3	0	0	0	0	112.8
165	D	26.6	Very low	28.7	Very low	144 Å²	144	142 Å²	142	77%	0.77	78%	0.783	S	S	*	*			trans	-74.9	-176	-177.8	-52.6	-90.4	0	0	0	113.9
166	N	28.5	Very low	28.8	Very low	157 Å²	157	142.1 Å²	142.1	84%	0.84	79%	0.79	S	S	*	*			trans	72.6	90.3	176.3	-53.8	-30.9	0	0	0	116.4
167	I	27.5	Very low	28.7	Very low	157 Å²	157	141.6 Å²	141.6	81%	0.805	78%	0.783	S	S	*	*			trans	-134.5	77.1	161.1	-47.3	177.2	0	0	0	109.1
168	D	29.3	Very low	28.8	Very low	120 Å²	120	140.1 Å²	140.1	64%	0.642	78%	0.782	S	S	*	*			trans	-136.2	13.8	171.5	-99.1	-34.6	0	0	0	111.7	R561	D168-R561 IonicContact OD1-NH2 2.72Å; D168-R561 IonicContact OD2-CZ 3.94Å; D168-R561 VanDerWaalsContact OD2-CZ 3.22Å; D168-R561 IonicContact OD2-NH1 3.65Å; D168-R561 PolarHBondContact OD2-NH1 3.12Å; D168-R561 IonicContact OD2-NH2 3.92Å; D168-R561 PolarHBondContact OD2-NH2 3.39Å
169	E	30.1	Very low	29	Very low	190 Å²	190	137.9 Å²	137.9	89%	0.888	77%	0.767	S	S	*	*	S	Bend	trans	-120.7	28.9	-172.6	-65.6	-163.9	137.9	0	0	115.2
170	V	30.5	Very low	29.2	Very low	119 Å²	119	132.4 Å²	132.4	72%	0.721	74%	0.74	S	S	*	*			trans	-136.8	56.1	179	-159.8	0	0	0	0	113.6
171	F	30.8	Very low	29.5	Very low	202 Å²	202	135.1 Å²	135.1	89%	0.886	74%	0.736	S	S	*	*			trans	-148.6	31.5	170.4	-91.9	-61.9	0	0	0	116.1
172	D	30.1	Very low	30	Very low	128 Å²	128	133.9 Å²	133.9	68%	0.684	72%	0.723	S	S	*	*			trans	-112.5	85.2	165.9	-95	-60	0	0	0	111.4	K542	D172-K542 IonicContact OD1-NZ 2.65Å; D172-K542 PolarHBondContact OD1-NZ 3.49Å; D172-K542 IonicContact OD2-NZ 2.75Å
173	K	28.7	Very low	30.2	Very low	178 Å²	178	128.4 Å²	128.4	77%	0.774	69%	0.688	S	S	*	*	S	Bend	trans	-171.4	123.7	147.9	-101.2	147.4	-171.2	172	0	111	H175	K173-H175 PolarHBondContact O-N 3.49Å; K173-H175 VanDerWaalsContact O-N 3.14Å
174	D	26.8	Very low	30.4	Very low	154 Å²	154	125.5 Å²	125.5	82%	0.824	68%	0.677	S	S	*	*	S	Bend	trans	55	36.3	150.3	-45.4	-33.3	0	0	0	118.8
175	H	28	Very low	30.6	Very low	158 Å²	158	125.8 Å²	125.8	73%	0.731	67%	0.669	S	S	*	*			trans	-118.4	120.9	162.6	-84.9	10.4	0	0	0	112	K173 T177	K173-H175 PolarHBondContact O-N 3.49Å; K173-H175 VanDerWaalsContact O-N 3.14Å; H175-T177 PolarHBondContact O-N 3.33Å
176	V	28.9	Very low	30.7	Very low	142 Å²	142	122.6 Å²	122.6	86%	0.861	65%	0.652	S	S	*	*			trans	-68.3	94.1	173.2	179.9	0	0	0	0	108.3	S178	V176-S178 PolarHBondContact O-N 2.94Å
177	T	29.7	Very low	30.9	Very low	107 Å²	107	119.6 Å²	119.6	66%	0.656	64%	0.64	S	S	*	*			trans	-61.9	123.2	-177.1	51.2	0	0	0	0	111.2	H175 H179	H175-T177 PolarHBondContact O-N 3.33Å; T177-H179 PolarHBondContact O-N 3.35Å
178	S	29.6	Very low	31	Very low	99 Å²	99	113.5 Å²	113.5	69%	0.692	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	43.9	-170.9	44.7	0	0	0	0	114.7	V176	V176-S178 PolarHBondContact O-N 2.94Å
179	H	36.2	Very low	31.3	Very low	92 Å²	92	116.8 Å²	116.8	43%	0.426	63%	0.628	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.8	-7.7	176.6	-84	41.4	0	0	0	114.1	T177 I181	T177-H179 PolarHBondContact O-N 3.35Å; H179-I181 PolarHBondContact O-N 3.34Å
180	D	32	Very low	31.4	Very low	48 Å²	48	112 Å²	112	26%	0.257	61%	0.605	S	S	.	*	S	Bend	trans	-78.1	1.6	172.2	-76	-45.7	0	0	0	113.3	K531 S545	D180-K531 IonicContact OD1-NZ 3.06Å; D180-K531 WeakPolarHBondContact OD2-CE 3.33Å; D180-K531 IonicContact OD2-NZ 3.36Å; D180-K531 PolarHBondContact OD2-NZ 3Å; D180-S545 PolarHBondContact OD1-OG 3.18Å
181	I	36.8	Very low	31.6	Very low	128 Å²	128	113.7 Å²	113.7	66%	0.656	60%	0.598	S	S	*	*			trans	-116	72.1	-178.7	-45.8	178.5	0	0	0	110.6	H179	H179-I181 PolarHBondContact O-N 3.34Å
182	I	37	Very low	32	Very low	121 Å²	121	111.2 Å²	111.2	62%	0.621	59%	0.594	S	S	*	*			trans	-127.5	57.6	168.2	-43.2	-178.4	0	0	0	110.5
183	D	29.9	Very low	32.1	Very low	23 Å²	23	108.2 Å²	108.2	12%	0.123	58%	0.583	C	S	.	*			trans	-113.7	81.3	157.5	-69.5	-51.5	0	0	0	107.6	K512 F514 R522 H523	D183-K512 HydrophobicContact CB-CD 4.49Å; D183-K512 PolarHBondContact O-NZ 2.99Å; D183-F514 HydrophobicContact CB-CE1 4.01Å; D183-F514 HydrophobicContact CB-CZ 3.95Å; D183-R522 IonicContact OD1-NH2 2.86Å; D183-R522 PolarHBondContact OD1-NH2 3.07Å; D183-H523 WeakPolarHBondContact OD2-CA 3.44Å; D183-H523 WeakPolarHBondContact OD2-CB 3.3Å; D183-H523 IonicContact OD2-CG 3.42Å; D183-H523 IonicContact OD2-ND1 3.21Å; D183-H523 PolarHBondContact OD2-ND1 3.49Å
184	G	31.4	Very low	32.6	Very low	54 Å²	54	104.9 Å²	104.9	56%	0.557	57%	0.573	S	S	*	*	S	Bend	trans	-162.9	90.7	-176	0	0	0	0	0	109
185	D	33.3	Very low	32.9	Very low	120 Å²	120	101.4 Å²	101.4	64%	0.642	55%	0.554	S	S	*	*	S	Bend	trans	64	161.3	171.3	-59.7	-54.2	0	0	0	120.7	V187 R503	D185-V187 PolarHBondContact O-N 3.09Å; D185-R503 IonicContact OD1-CZ 3.72Å; D185-R503 VanDerWaalsContact OD1-CZ 3.32Å; D185-R503 IonicContact OD1-NH1 3.91Å; D185-R503 PolarHBondContact OD1-NH1 2.91Å; D185-R503 IonicContact OD1-NH2 2.74Å; D185-R503 PolarHBondContact OD1-NH2 2.87Å
186	D	29.4	Very low	33.3	Very low	78 Å²	78	102.7 Å²	102.7	42%	0.417	56%	0.56	S	S	.	*			trans	-79.9	81.3	-157	-81.2	-81.2	0	0	0	114.1	S188 R503	D186-S188 PolarHBondContact O-N 3.47Å; D186-R503 IonicContact OD2-CZ 3.87Å; D186-R503 IonicContact OD2-NE 3.32Å; D186-R503 IonicContact OD2-NH2 2.82Å; D186-R503 PolarHBondContact OD2-NH2 3.4Å
187	V	33.1	Very low	33.7	Very low	94 Å²	94	99.8 Å²	99.8	57%	0.57	54%	0.539	S	S	*	.			trans	-84.2	84.5	154.9	-174.5	0	0	0	0	109.4	D185 R191	D185-V187 PolarHBondContact O-N 3.09Å; V187-R191 HydrophobicContact CG1-CB 4.46Å
188	S	29.7	Very low	33.8	Very low	29 Å²	29	100.5 Å²	100.5	20%	0.203	55%	0.545	C	S	.	.			trans	-57.8	153.1	157.3	-68.9	0	0	0	0	110.1	D186 E190	D186-S188 PolarHBondContact O-N 3.47Å; S188-E190 WeakPolarHBondContact CB-OE2 3.38Å; S188-E190 PolarHBondContact O-N 3.33Å
189	L	34.9	Very low	34	Very low	189 Å²	189	103 Å²	103	99%	0.99	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	40.1	-175.5	-76.2	165.4	0	0	0	113.8
190	E	33.3	Very low	33.8	Very low	88 Å²	88	103.7 Å²	103.7	41%	0.411	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	-112.1	-17	-175.8	-63.6	164.4	149.7	0	0	111.9	S188 L192 S193 K485	S188-E190 WeakPolarHBondContact CB-OE2 3.38Å; S188-E190 PolarHBondContact O-N 3.33Å; E190-L192 PolarHBondContact O-N 2.85Å; E190-S193 PolarHBondContact O-N 3.11Å; E190-S193 PolarHBondContact O-OG 3.43Å; E190-S193 VanDerWaalsContact O-OG 3.12Å; E190-K485 IonicContact OE1-NZ 2.74Å; E190-K485 IonicContact OE2-NZ 3.22Å; E190-K485 PolarHBondContact OE2-NZ 2.89Å
191	R	34.9	Very low	33.9	Very low	155 Å²	155	108.1 Å²	108.1	59%	0.585	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	36.2	-173.4	-86.4	-174.3	159.5	166	-0.7	116.2	V187	V187-R191 HydrophobicContact CG1-CB 4.46Å
192	L	37.5	Very low	33.6	Very low	151 Å²	151	111.1 Å²	111.1	79%	0.791	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.7	-19.4	166	-82.4	166.2	0	0	0	112.9	E190 D194	E190-L192 PolarHBondContact O-N 2.85Å; L192-D194 VanDerWaalsContact C-N 3.32Å; L192-D194 PolarHBondContact O-N 2.73Å
193	S	34	Very low	33.4	Very low	64 Å²	64	111.9 Å²	111.9	45%	0.448	60%	0.595	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.2	-32.3	173.4	46.6	0	0	0	0	113.7	E190 L195	E190-S193 PolarHBondContact O-N 3.11Å; E190-S193 PolarHBondContact O-OG 3.43Å; E190-S193 VanDerWaalsContact O-OG 3.12Å; S193-L195 VanDerWaalsContact C-N 3.26Å; S193-L195 PolarHBondContact O-N 3.31Å; S193-L195 VanDerWaalsContact O-N 3.16Å
194	D	38.2	Very low	33.5	Very low	108 Å²	108	116 Å²	116	58%	0.578	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	8.3	-160.2	-49.9	-18	0	0	0	114.4	L192	L192-D194 VanDerWaalsContact C-N 3.32Å; L192-D194 PolarHBondContact O-N 2.73Å
195	L	33.8	Very low	33.5	Very low	81 Å²	81	121 Å²	121	42%	0.424	63%	0.63	S	S	.	*			trans	-123.3	69.5	170.8	-90.2	85.7	0	0	0	110.4	S193 I197 L584	S193-L195 VanDerWaalsContact C-N 3.26Å; S193-L195 PolarHBondContact O-N 3.31Å; S193-L195 VanDerWaalsContact O-N 3.16Å; L195-I197 HydrophobicContact CD2-CD1 4.42Å; L195-I197 PolarHBondContact O-N 3.42Å; L195-L584 HydrophobicContact CD2-CD1 4.49Å
196	H	36.3	Very low	33.5	Very low	185 Å²	185	120.4 Å²	120.4	86%	0.856	64%	0.635	S	S	*	*			trans	-61.2	104.7	157.7	-95.2	-111.6	0	0	0	109.4
197	I	37.5	Very low	33.8	Very low	82 Å²	82	124.5 Å²	124.5	42%	0.421	66%	0.657	S	S	.	*			trans	-119.5	121.4	163.3	-60.5	178.8	0	0	0	105.4	L195 L199 P566	L195-I197 HydrophobicContact CD2-CD1 4.42Å; L195-I197 PolarHBondContact O-N 3.42Å; I197-L199 PolarHBondContact O-N 3.05Å; I197-L199 VanDerWaalsContact O-N 3.15Å; I197-P566 HydrophobicContact CD1-CB 4.16Å; I197-P566 HydrophobicContact CD1-CG 3.63Å; I197-P566 HydrophobicContact CG2-CB 3.99Å
198	P	31	Very low	33.9	Very low	121 Å²	121	130.4 Å²	130.4	79%	0.786	67%	0.671	S	S	*	*			trans	-61.9	118.7	-178.8	-22.6	33.5	0	0	0	111
199	L	34.3	Very low	34.1	Very low	151 Å²	151	133.5 Å²	133.5	79%	0.791	69%	0.692	S	S	*	*			trans	-75.7	127.6	160.1	-70.8	173.1	0	0	0	107.5	I197 L201	I197-L199 PolarHBondContact O-N 3.05Å; I197-L199 VanDerWaalsContact O-N 3.15Å; L199-L201 PolarHBondContact O-N 3.41Å
200	P	32	Very low	34	Very low	107 Å²	107	131.6 Å²	131.6	70%	0.695	68%	0.683	S	S	*	*			trans	-65.1	108.2	171.3	-18.6	31.8	0	0	0	109.4	F202	P200-F202 PolarHBondContact O-N 3.01Å; P200-F202 VanDerWaalsContact O-N 3.13Å
201	L	33.1	Very low	34.1	Very low	141 Å²	141	131.6 Å²	131.6	74%	0.738	69%	0.693	S	S	*	*			trans	-72.5	103.7	171.7	-69.4	177.4	0	0	0	108.7	L199 H203	L199-L201 PolarHBondContact O-N 3.41Å; L201-H203 VanDerWaalsContact C-N 3.34Å; L201-H203 PolarHBondContact O-N 3.5Å
202	F	32	Very low	34.1	Very low	192 Å²	192	129 Å²	129	84%	0.842	70%	0.699	S	S	*	*			trans	-70.8	92.2	165	-80.2	-84.9	0	0	0	109.1	P200 T204	P200-F202 PolarHBondContact O-N 3.01Å; P200-F202 VanDerWaalsContact O-N 3.13Å; F202-T204 PolarHBondContact O-N 3.14Å
203	H	31.1	Very low	34	Very low	136 Å²	136	129.4 Å²	129.4	63%	0.63	70%	0.697	S	S	*	*			trans	-61.4	121.9	171.5	-79.3	-113.5	0	0	0	109.9	L201 E205	L201-H203 VanDerWaalsContact C-N 3.34Å; L201-H203 PolarHBondContact O-N 3.5Å; H203-E205 IonicContact CE1-OE1 3.92Å; H203-E205 IonicContact ND1-OE1 2.76Å; H203-E205 PolarHBondContact ND1-OE1 3.24Å
204	T	32.8	Very low	33.9	Very low	110 Å²	110	133 Å²	133	68%	0.675	71%	0.709	S	S	*	*			trans	-128.4	74	161.8	48.3	0	0	0	0	108.6	F202 S206	F202-T204 PolarHBondContact O-N 3.14Å; T204-S206 PolarHBondContact O-N 2.92Å
205	E	32.2	Very low	33.7	Very low	158 Å²	158	134.6 Å²	134.6	74%	0.738	72%	0.718	S	S	*	*			trans	-70.7	126.3	176.9	-70	174.8	-154.8	0	0	110.3	H203	H203-E205 IonicContact CE1-OE1 3.92Å; H203-E205 IonicContact ND1-OE1 2.76Å; H203-E205 PolarHBondContact ND1-OE1 3.24Å
206	S	32.6	Very low	33.6	Very low	108 Å²	108	136.5 Å²	136.5	76%	0.755	74%	0.735	S	S	*	*			trans	-150.5	82.7	171.3	52.3	0	0	0	0	110.3	T204	T204-S206 PolarHBondContact O-N 2.92Å
207	N	35.3	Very low	33.6	Very low	165 Å²	165	132.3 Å²	132.3	88%	0.882	73%	0.726	S	S	*	*			trans	-85.2	145.5	172.4	-80.5	-33.4	0	0	0	111.2
208	Y	36.3	Very low	33.5	Very low	218 Å²	218	135.6 Å²	135.6	86%	0.855	75%	0.745	S	S	*	*			trans	-74.2	138.3	-179.5	-113	-127.8	0	0	0	112.3
209	S	33	Very low	33.9	Very low	93 Å²	93	135 Å²	135	65%	0.65	74%	0.744	S	S	*	*				42.9	129.9	126.1	-48.6	0	0	0	0	120.8
210	D	33.2	Very low	34	Very low	149 Å²	149	136.5 Å²	136.5	80%	0.797	75%	0.747	S	S	*	*				-159.2	154.8	92.1	-140.7	-34.2	0	0	0	114.6
211	S	35.7	Very low	34.1	Very low	88 Å²	88	137.3 Å²	137.3	62%	0.615	75%	0.749	S	S	*	*			trans	54.8	94.1	146.6	-72	0	0	0	0	123.6
212	S	34	Very low	34.2	Very low	101 Å²	101	137.7 Å²	137.7	71%	0.706	75%	0.752	S	S	*	*				91.6	153.3	113.6	79.1	0	0	0	0	122.8
213	Q	36.1	Very low	34.5	Very low	160 Å²	160	132.4 Å²	132.4	75%	0.748	74%	0.744	S	S	*	*			trans	82	110.7	167.7	-51.1	-158.6	29.5	0	0	116
214	I	32.5	Very low	34.6	Very low	139 Å²	139	132.3 Å²	132.3	71%	0.713	76%	0.757	S	S	*	*				73.7	119.7	85	-69	162.5	0	0	0	110.3
215	N	32.5	Very low	34.6	Very low	141 Å²	141	130.5 Å²	130.5	75%	0.754	76%	0.76	S	S	*	*			cis	-144.4	166.6	13.6	-95.3	-30	0	0	0	112
216	P	33.4	Very low	34.9	Very low	122 Å²	122	130 Å²	130	79%	0.792	76%	0.762	S	S	*	*			trans	-107.4	128	164.3	35.9	-25	0	0	0	113.1
217	S	35.5	Very low	35	Very low	96 Å²	96	133.9 Å²	133.9	67%	0.671	77%	0.765	S	S	*	*			trans	-166.3	132	170.8	53.1	0	0	0	0	114.3
218	D	36	Very low	35.1	Very low	151 Å²	151	130.7 Å²	130.7	81%	0.807	76%	0.756	S	S	*	*			trans	71.8	143.1	142.1	-49.6	-20.4	0	0	0	123.9
219	S	38.6	Very low	35.2	Very low	110 Å²	110	124.5 Å²	124.5	77%	0.769	75%	0.745	S	S	*	*			trans	88.1	128.3	174.4	67.8	0	0	0	0	118.7
220	E	35.6	Very low	35.4	Very low	182 Å²	182	126.4 Å²	126.4	85%	0.85	75%	0.747	S	S	*	*			cis	-176.7	165.1	-30	-115.9	175.9	149.6	0	0	105.8
221	V	35.4	Very low	35.5	Very low	123 Å²	123	125.3 Å²	125.3	75%	0.745	74%	0.742	S	S	*	*			trans	-27.4	155.9	172.1	-81.6	0	0	0	0	118.5
222	D	35.5	Very low	35	Very low	150 Å²	150	127.1 Å²	127.1	80%	0.802	75%	0.753	S	S	*	*				-169.1	176	60.3	-140.4	-21.8	0	0	0	117.7
223	A	37.2	Very low	35	Very low	80 Å²	80	126.3 Å²	126.3	66%	0.661	75%	0.752	S	S	*	*			trans	64	113.5	167.7	0	0	0	0	0	118.8
224	C	32.9	Very low	34.8	Very low	135 Å²	135	124.1 Å²	124.1	91%	0.912	75%	0.75	S	S	*	*				62.7	129.6	73.1	-62.3	0	0	0	0	114
225	G	34	Very low	34.7	Very low	72 Å²	72	123.6 Å²	123.6	74%	0.742	75%	0.749	S	S	*	*			cis	-176.6	-179.9	1	0	0	0	0	0	107.1
226	L	36.8	Very low	34.8	Very low	146 Å²	146	124.7 Å²	124.7	76%	0.764	75%	0.749	S	S	*	*			cis	-164.2	160.5	26.5	-77.7	162.9	0	0	0	110
227	F	35.9	Very low	34.7	Very low	190 Å²	190	123.4 Å²	123.4	83%	0.833	74%	0.743	S	S	*	*			trans	59.7	145.1	162.3	-57.2	-59.2	0	0	0	119.7
228	S	36.4	Very low	34.8	Very low	98 Å²	98	126.2 Å²	126.2	69%	0.685	75%	0.75	S	S	*	*			cis	-156.7	162.9	-31.1	-153.8	0	0	0	0	110.7
229	S	38.6	Very low	34.5	Very low	88 Å²	88	126.5 Å²	126.5	62%	0.615	75%	0.752	S	S	*	*			trans	-34.3	157.3	164	67	0	0	0	0	116.2
230	D	37.4	Very low	34.1	Very low	133 Å²	133	130.6 Å²	130.6	71%	0.711	75%	0.752	S	S	*	*			cis	-158.6	161.5	38.8	-99.8	-66.9	0	0	0	110.8
231	N	34.9	Very low	33.8	Very low	126 Å²	126	126.3 Å²	126.3	67%	0.674	74%	0.738	S	S	*	*			cis	-155.9	-173	-8	-162.5	-86.8	0	0	0	108.5
232	C	25.7	Very low	33.9	Very low	127 Å²	127	128.8 Å²	128.8	86%	0.858	74%	0.742	S	S	*	*			trans	-154.3	107.2	168.4	-100.8	0	0	0	0	112.7
233	A	34.3	Very low	33.6	Very low	83 Å²	83	126.9 Å²	126.9	69%	0.686	73%	0.73	S	S	*	*			trans	-175.5	159.2	173.9	0	0	0	0	0	110.6
234	T	32.4	Very low	33.3	Very low	115 Å²	115	131.2 Å²	131.2	71%	0.706	73%	0.734	S	S	*	*			cis	-168.1	155.1	-25.1	30.7	0	0	0	0	109.3
235	N	29.7	Very low	33.3	Very low	128 Å²	128	131.7 Å²	131.7	68%	0.684	72%	0.723	S	S	*	*			trans	68.6	153	148.1	-62.5	-11.1	0	0	0	122.4
236	Q	35.4	Very low	33.1	Very low	164 Å²	164	134.9 Å²	134.9	77%	0.766	72%	0.722	S	S	*	*			trans	57.5	108.9	153.8	-72	144.1	-11.4	0	0	117
237	S	30.3	Very low	33.1	Very low	94 Å²	94	133.4 Å²	133.4	66%	0.657	72%	0.719	S	S	*	*				66.4	118.2	65.2	85.6	0	0	0	0	113.3
238	D	37.4	Very low	32.9	Very low	155 Å²	155	129 Å²	129	83%	0.829	71%	0.712	S	S	*	*				-166.2	168.5	99	-85.8	-2.6	0	0	0	110.3
239	D	30.8	Very low	33.2	Very low	157 Å²	157	129.1 Å²	129.1	84%	0.84	71%	0.711	S	S	*	*			trans	-93.1	178.7	-168.5	-93.3	-56.6	0	0	0	114.3
240	Y	29	Very low	33	Very low	196 Å²	196	131.9 Å²	131.9	77%	0.769	72%	0.718	S	S	*	*			trans	92	94.9	141.3	-123.7	-96.8	0	0	0	121.2
241	V	30.6	Very low	32.7	Very low	93 Å²	93	129.7 Å²	129.7	56%	0.564	71%	0.714	S	S	*	*				25.7	114.3	122.9	-172.1	0	0	0	0	119	I243	V241-I243 HydrophobicContact CG1-CD1 3.71Å; V241-I243 HydrophobicContact CG1-CG1 4.06Å
242	Q	35.9	Very low	32.6	Very low	174 Å²	174	128.9 Å²	128.9	81%	0.813	72%	0.718	S	S	*	*				-163.8	134	126.3	-101.2	151.5	85.5	0	0	108.6
243	I	29.7	Very low	32.7	Very low	111 Å²	111	129.3 Å²	129.3	57%	0.569	71%	0.712	S	S	*	*			cis	94.5	116	41.1	-72.2	172.4	0	0	0	112.1	V241	V241-I243 HydrophobicContact CG1-CD1 3.71Å; V241-I243 HydrophobicContact CG1-CG1 4.06Å
244	K	31.3	Very low	32.5	Very low	171 Å²	171	128.7 Å²	128.7	74%	0.743	70%	0.702	S	S	*	*			trans	66.4	171.1	174.7	-52.8	157.3	-167.3	169.8	0	113.2
245	H	32.4	Very low	32.4	Very low	144 Å²	144	130.5 Å²	130.5	67%	0.667	71%	0.707	S	S	*	*			cis	-139.9	152.7	12	-96.2	-85.1	0	0	0	111.3
246	L	30.9	Very low	32.4	Very low	140 Å²	140	128.3 Å²	128.3	73%	0.733	70%	0.702	S	S	*	*			trans	47.6	153.4	135.2	-55.8	171.8	0	0	0	119.8
247	T	35.4	Very low	32.1	Very low	114 Å²	114	126.8 Å²	126.8	70%	0.699	70%	0.699	S	S	*	*			cis	-155.8	142.6	10.3	4.5	0	0	0	0	105.5
248	S	32.7	Very low	32.2	Very low	99 Å²	99	130 Å²	130	69%	0.692	70%	0.704	S	S	*	*				60.4	150.3	80.4	-45.4	0	0	0	0	114.7
249	P	42.7	Very low	31.9	Very low	100 Å²	100	126.4 Å²	126.4	65%	0.649	69%	0.691	S	S	*	*			cis	-137.2	-158.3	-24.9	32.3	-9.1	0	0	0	111.9
250	D	33.7	Very low	32	Very low	145 Å²	145	124.7 Å²	124.7	78%	0.775	69%	0.686	S	S	*	*			trans	67.7	153.3	148.1	-66.4	-12.3	0	0	0	120
251	S	32.1	Very low	32.3	Very low	88 Å²	88	120 Å²	120	62%	0.615	68%	0.678	S	S	*	*			cis	-168.6	146.2	-21.9	54.1	0	0	0	0	109.8
252	S	31.2	Very low	32.6	Very low	108 Å²	108	123.8 Å²	123.8	76%	0.755	69%	0.687	S	S	*	*			trans	62.5	163.8	151.7	85.8	0	0	0	0	117.1
253	N	28.9	Very low	32.4	Very low	137 Å²	137	122.8 Å²	122.8	73%	0.733	69%	0.686	S	S	*	*			cis	-150.4	165.3	1.1	-152.5	-3.2	0	0	0	111.5
254	S	30	Very low	32.8	Very low	70 Å²	70	122.1 Å²	122.1	49%	0.49	69%	0.689	S	S	.	*			trans	36.5	129.3	139.3	69.8	0	0	0	0	120.8
255	N	29.4	Very low	33	Very low	152 Å²	152	119.8 Å²	119.8	81%	0.813	69%	0.689	S	S	*	*				75.3	150.6	126.8	-67.9	6	0	0	0	117.9
256	S	30.8	Very low	33.2	Very low	83 Å²	83	119.9 Å²	119.9	58%	0.58	69%	0.693	S	S	*	*			cis	-169.1	162.6	-7.1	39.2	0	0	0	0	109
257	N	29.5	Very low	33.4	Very low	131 Å²	131	118.8 Å²	118.8	70%	0.701	69%	0.692	S	S	*	*			trans	66	169.2	151.9	-72.5	19.2	0	0	0	113.8
258	E	31.3	Very low	33.5	Very low	161 Å²	161	118.7 Å²	118.7	75%	0.752	69%	0.693	S	S	*	*			cis	-154.2	164.6	-19	-110.7	169	116.6	0	0	104
259	S	32.2	Very low	33.5	Very low	81 Å²	81	120.3 Å²	120.3	57%	0.566	70%	0.698	S	S	*	*			cis	-173.2	168.7	1.2	41.7	0	0	0	0	107.8
260	T	31.9	Very low	33.3	Very low	120 Å²	120	121.3 Å²	121.3	74%	0.736	71%	0.708	S	S	*	*			trans	64.6	152.9	148.7	46.4	0	0	0	0	119.9
261	T	34.6	Very low	33.4	Very low	97 Å²	97	119.3 Å²	119.3	60%	0.595	71%	0.705	S	S	*	*			cis	-152.8	138.9	2.2	1.3	0	0	0	0	112.2
262	K	37.8	Very low	33.3	Very low	173 Å²	173	123 Å²	123	75%	0.752	72%	0.718	S	S	*	*			trans	66.4	130.4	143.8	-64.9	160.7	-171.3	167.3	0	119.6
263	I	32.8	Very low	33.4	Very low	154 Å²	154	122.4 Å²	122.4	79%	0.79	71%	0.713	S	S	*	*			cis	83.6	139.5	39.9	-65.1	164.5	0	0	0	111.4
264	P	38.3	Very low	33.6	Very low	96 Å²	96	121.7 Å²	121.7	62%	0.623	72%	0.719	S	S	*	*			cis	-140	163.8	15.7	40.6	-22.3	0	0	0	120.4
265	T	33.8	Very low	33.9	Very low	122 Å²	122	123.1 Å²	123.1	75%	0.748	74%	0.735	S	S	*	*			trans	56.1	168.7	139.3	60.5	0	0	0	0	121.8
266	I	37.2	Very low	34.3	Very low	146 Å²	146	123.1 Å²	123.1	75%	0.749	73%	0.73	S	S	*	*			cis	-143	123.8	21	-63.7	173.8	0	0	0	107.4
267	V	34.7	Very low	34.8	Very low	117 Å²	117	126.9 Å²	126.9	71%	0.709	74%	0.736	S	S	*	*				69.2	145.1	75.9	175	0	0	0	0	114.5
268	P	37.1	Very low	35	Very low	112 Å²	112	126.2 Å²	126.2	73%	0.727	74%	0.737	S	S	*	*			cis	-111.2	-172.9	-9	25.6	-2.6	0	0	0	112.8
269	V	33.4	Very low	35.3	Very low	133 Å²	133	126.4 Å²	126.4	81%	0.806	74%	0.738	S	S	*	*			cis	100	97.1	3.4	-175.1	0	0	0	0	119
270	S	38	Very low	35.4	Very low	121 Å²	121	128.9 Å²	128.9	85%	0.846	74%	0.744	S	S	*	*			trans	161.5	151	156.8	-75.2	0	0	0	0	110.7
271	S	35.8	Very low	35.5	Very low	104 Å²	104	128.9 Å²	128.9	73%	0.727	74%	0.738	S	S	*	*			cis	-166.4	123.6	-7.1	47.1	0	0	0	0	107.6
272	L	31	Very low	35.4	Very low	166 Å²	166	134 Å²	134	87%	0.869	75%	0.746	S	S	*	*				100.5	135.8	69.8	-107.9	163.6	0	0	0	115.6
273	S	32.3	Very low	35	Very low	95 Å²	95	133.4 Å²	133.4	66%	0.664	75%	0.751	S	S	*	*			trans	71.6	103.2	150.9	61.5	0	0	0	0	124.7
274	S	33.6	Very low	35.1	Very low	121 Å²	121	130.9 Å²	130.9	85%	0.846	74%	0.744	S	S	*	*				94.4	152.2	106.3	-61.5	0	0	0	0	124
275	A	37	Very low	34.6	Very low	101 Å²	101	130.6 Å²	130.6	84%	0.835	74%	0.744	S	S	*	*			trans	76.6	141.9	159.9	0	0	0	0	0	119.3
276	E	38.3	Very low	34.3	Very low	152 Å²	152	133.7 Å²	133.7	71%	0.71	75%	0.75	S	S	*	*			cis	-165.4	170.7	-25.6	-148.7	-170.5	-152.4	0	0	110.4
277	K	39.7	Very low	34.2	Very low	162 Å²	162	131.5 Å²	131.5	70%	0.704	75%	0.754	S	S	*	*			trans	74.3	112.7	162.8	-69.5	171.2	176	139.3	0	117.3
278	T	34.3	Very low	34	Very low	117 Å²	117	133 Å²	133	72%	0.718	76%	0.758	S	S	*	*				66.5	133.6	69.3	67.7	0	0	0	0	112.8
279	E	38.5	Very low	33.8	Very low	165 Å²	165	136.6 Å²	136.6	77%	0.771	77%	0.765	S	S	*	*			cis	-128.8	142	35	-80.2	-159.6	136.9	0	0	113.7
280	L	32.5	Very low	33.5	Very low	132 Å²	132	137 Å²	137	69%	0.691	76%	0.762	S	S	*	*				62.6	135.4	83.6	-56.5	173.3	0	0	0	113.3
281	I	35.8	Very low	33.1	Very low	120 Å²	120	137.1 Å²	137.1	62%	0.615	76%	0.757	S	S	*	*			cis	-152.2	146.5	25.3	-124.4	145.4	0	0	0	112.8
282	R	31.7	Very low	32.8	Very low	205 Å²	205	137.6 Å²	137.6	77%	0.774	76%	0.756	S	S	*	*			trans	32.2	130.8	154.5	-53.9	176.2	171.3	99.6	0.4	120.9
283	L	29.5	Very low	32.5	Very low	161 Å²	161	135.8 Å²	135.8	84%	0.843	75%	0.752	S	S	*	*			cis	60.9	153.5	48.5	-66.6	171	0	0	0	115.1
284	P	34.6	Very low	32.5	Very low	101 Å²	101	137.9 Å²	137.9	66%	0.656	76%	0.76	S	S	*	*			cis	-142.2	-178	-22	32.3	-9.7	0	0	0	116
285	S	27.3	Very low	32.2	Very low	89 Å²	89	139.2 Å²	139.2	62%	0.622	76%	0.758	S	S	*	*			trans	65.6	140.2	134.2	63.9	0	0	0	0	124.8
286	H	27.9	Very low	32.2	Very low	187 Å²	187	139.8 Å²	139.8	87%	0.866	75%	0.753	S	S	*	*			trans	48.2	112.8	140.5	-59	-52	0	0	0	121
287	A	35.1	Very low	31.9	Very low	100 Å²	100	137.3 Å²	137.3	83%	0.826	75%	0.753	S	S	*	*				-149.8	137.2	122.4	0	0	0	0	0	110.3
288	N	30.2	Very low	31.5	Very low	149 Å²	149	136.6 Å²	136.6	80%	0.797	75%	0.747	S	S	*	*			trans	-77.4	151.4	160.6	-54.7	-59.8	0	0	0	108.1
289	H	33.3	Very low	31.8	Very low	188 Å²	188	137.1 Å²	137.1	87%	0.87	75%	0.752	S	S	*	*				-162.8	138.1	124.9	-114.8	-78.2	0	0	0	111.9
290	L	26.6	Very low	31.7	Very low	142 Å²	142	134 Å²	134	74%	0.743	75%	0.748	S	S	*	*			trans	-72.7	149.2	160.2	-56.1	85	0	0	0	108.3
291	T	29.4	Very low	31.7	Very low	123 Å²	123	137.7 Å²	137.7	76%	0.755	75%	0.753	S	S	*	*				168	152.7	107.5	37.9	0	0	0	0	113.3
292	T	29.5	Very low	31.6	Very low	114 Å²	114	137.3 Å²	137.3	70%	0.699	76%	0.759	S	S	*	*			trans	46.1	107.6	148.8	52	0	0	0	0	121
293	T	25.7	Very low	31.6	Very low	127 Å²	127	133.5 Å²	133.5	78%	0.779	75%	0.752	S	S	*	*				29.4	124.6	117.4	58.9	0	0	0	0	119.8
294	V	33	Very low	31.8	Very low	139 Å²	139	131.6 Å²	131.6	84%	0.842	75%	0.752	S	S	*	*				-162.6	143.2	123.6	135.6	0	0	0	0	109.3
295	N	26.1	Very low	31.4	Very low	149 Å²	149	132.9 Å²	132.9	80%	0.797	76%	0.759	S	S	*	*			trans	-116.2	124.8	177.7	-153.3	17	0	0	0	108.4
296	P	37.7	Very low	31.6	Very low	114 Å²	114	134.3 Å²	134.3	74%	0.74	77%	0.767	S	S	*	*			trans	-107.9	115.2	173.3	33.1	-23.6	0	0	0	112
297	S	32.6	Very low	31.7	Very low	100 Å²	100	133.1 Å²	133.1	70%	0.699	77%	0.766	S	S	*	*			trans	-82.5	171.2	-177.7	-52.7	0	0	0	0	114.5
298	Y	30.7	Very low	31.4	Very low	147 Å²	147	132.9 Å²	132.9	58%	0.576	76%	0.759	S	S	*	*			trans	-31.7	143.2	175.4	-64.2	-96.7	0	0	0	118.6	D79	D79-Y298 VanDerWaalsContact OD1-CE2 3.24Å; D79-Y298 WeakPolarHBondContact OD1-CE2 3.18Å; D79-Y298 PolarHBondContact OD1-OH 2.94Å; D79-Y298 WeakPolarHBondContact OD2-CE2 3.23Å
299	P	40.1	Very low	31.3	Very low	127 Å²	127	132.5 Å²	132.5	83%	0.825	76%	0.756	S	S	*	*			trans	-74.3	147.9	146	34.5	-32.1	0	0	0	110.3
300	S	35.5	Very low	31.3	Very low	99 Å²	99	131.9 Å²	131.9	69%	0.692	75%	0.75	S	S	*	*			trans	-145.8	151.4	-171.3	63.2	0	0	0	0	115.5
301	R	33.8	Very low	31.6	Very low	210 Å²	210	129.8 Å²	129.8	79%	0.792	75%	0.748	S	S	*	*			trans	67.1	170.2	164.2	-76.4	175.1	-174.1	-122.4	-0.9	114.2
302	P	34.2	Very low	32	Very low	113 Å²	113	132.9 Å²	132.9	73%	0.734	75%	0.751	S	S	*	*			cis	-121	141.4	13.9	38	-21.7	0	0	0	118.2
303	I	30.8	Very low	32.2	Very low	125 Å²	125	137.4 Å²	137.4	64%	0.641	76%	0.756	S	S	*	*				37.2	112.6	110.3	-48.4	160.7	0	0	0	117.5
304	S	33.5	Very low	32.4	Very low	121 Å²	121	142.7 Å²	142.7	85%	0.846	76%	0.762	S	S	*	*				-149.9	139.8	128.4	61.4	0	0	0	0	110.5
305	T	27.2	Very low	32.5	Very low	128 Å²	128	146.9 Å²	146.9	79%	0.785	76%	0.763	S	S	*	*			trans	-103.4	132.9	-177	39.2	0	0	0	0	111.4
306	C	30	Very low	32.5	Very low	118 Å²	118	146 Å²	146	80%	0.797	77%	0.767	S	S	*	*			trans	179.2	111.1	149.5	-95.7	0	0	0	0	108.2
307	L	30.1	Very low	32.2	Very low	163 Å²	163	143.4 Å²	143.4	85%	0.853	76%	0.761	S	S	*	*				61.5	129.2	81.1	-77	168.2	0	0	0	115.9
308	S	29.4	Very low	32.3	Very low	95 Å²	95	147.6 Å²	147.6	66%	0.664	77%	0.77	S	S	*	*			trans	91.5	94.1	152.5	-62.4	0	0	0	0	122.5
309	L	28.5	Very low	32.2	Very low	141 Å²	141	147.7 Å²	147.7	74%	0.738	78%	0.779	S	S	*	*				78.6	142.7	114.3	-72.2	162.3	0	0	0	123.1
310	K	33.1	Very low	31.9	Very low	174 Å²	174	148.6 Å²	148.6	76%	0.757	78%	0.782	S	S	*	*			trans	86.7	74.3	148.4	-69.4	153.8	-174	168.5	0	122.2
311	S	33.6	Very low	31.6	Very low	99 Å²	99	151.7 Å²	151.7	69%	0.692	79%	0.79	S	S	*	*				40.8	122.3	113.3	67.6	0	0	0	0	123.7
312	K	36.5	Very low	31.6	Very low	187 Å²	187	151.3 Å²	151.3	81%	0.813	79%	0.794	S	S	*	*				78.8	106.7	125.3	-71.2	-175.9	178.3	175.8	0	123.3
313	Y	33.4	Very low	31.6	Very low	209 Å²	209	151 Å²	151	82%	0.82	79%	0.794	S	S	*	*				84.8	140.9	127.9	-83.7	-69.3	0	0	0	125.8
314	R	31.7	Very low	31.7	Very low	239 Å²	239	148.9 Å²	148.9	90%	0.902	80%	0.803	S	S	*	*			trans	107.5	151.3	152.5	-63.1	-171	-177.2	-145	2.2	118
315	R	33.9	Very low	31.6	Very low	227 Å²	227	147.7 Å²	147.7	86%	0.857	80%	0.801	S	S	*	*			cis	-178.4	149.2	-38.3	-139.1	-174.6	-166.3	175.2	5.7	109.1
316	C	26.7	Very low	31.8	Very low	129 Å²	129	146.3 Å²	146.3	87%	0.872	80%	0.797	S	S	*	*			trans	65.7	158.1	167.5	-57.9	0	0	0	0	117.1
317	G	31.7	Very low	31.8	Very low	61 Å²	61	148.2 Å²	148.2	63%	0.629	80%	0.797	S	S	*	*			cis	175.8	-169.3	-3	0	0	0	0	0	112.5
318	Q	34.3	Very low	31.9	Very low	188 Å²	188	146.4 Å²	146.4	88%	0.879	79%	0.788	S	S	*	*			trans	75.9	128.4	-175.3	-56.8	172.5	-44.9	0	0	114.3
319	I	28.8	Very low	31.9	Very low	149 Å²	149	152 Å²	152	76%	0.764	80%	0.795	S	S	*	*			cis	96.9	113.7	24	-60.2	164.6	0	0	0	114.3
320	T	33.4	Very low	31.9	Very low	146 Å²	146	151 Å²	151	90%	0.896	79%	0.794	S	S	*	*			trans	-149.6	150.7	153.9	44.1	0	0	0	0	109.8
321	L	28.9	Very low	31.9	Very low	163 Å²	163	151.5 Å²	151.5	85%	0.853	80%	0.797	S	S	*	*			trans	-110.2	157.3	-171.1	-65.9	164.8	0	0	0	113.3
322	K	35	Very low	31.8	Very low	202 Å²	202	151.5 Å²	151.5	88%	0.878	80%	0.796	S	S	*	*			trans	-177.2	149.4	151.7	-101	173.9	-178.2	-174.9	0	109.5
323	S	33.1	Very low	31.6	Very low	106 Å²	106	147 Å²	147	74%	0.741	79%	0.788	S	S	*	*			cis	-178.4	130.6	-34.4	45.5	0	0	0	0	110.2
324	G	32.2	Very low	31.4	Very low	81 Å²	81	145.3 Å²	145.3	84%	0.835	79%	0.786	S	S	*	*			trans	79.6	156.6	178.8	0	0	0	0	0	113.7
325	A	33	Very low	31.4	Very low	97 Å²	97	139.4 Å²	139.4	80%	0.802	77%	0.772	S	S	*	*			cis	-167.4	163.6	-2.6	0	0	0	0	0	108
326	S	30.5	Very low	31.3	Very low	98 Å²	98	135.8 Å²	135.8	69%	0.685	77%	0.765	S	S	*	*			cis	-175.3	171.6	-20.6	-89.5	0	0	0	0	107.7
327	I	30.9	Very low	31.5	Very low	158 Å²	158	137.1 Å²	137.1	81%	0.81	76%	0.762	S	S	*	*			trans	68.8	136.4	159.7	-76	155.9	0	0	0	115.8
328	L	31.6	Very low	31.7	Very low	126 Å²	126	142.5 Å²	142.5	66%	0.66	77%	0.768	S	S	*	*			cis	-146.9	120.5	-15.8	-96.3	167.9	0	0	0	106.7
329	R	29.4	Very low	31.6	Very low	213 Å²	213	139.5 Å²	139.5	80%	0.804	77%	0.766	S	S	*	*				69.1	116.3	100.6	-82.3	-165.4	-168.7	153.4	-1.5	119.1
330	T	28.3	Very low	31.5	Very low	120 Å²	120	136.8 Å²	136.8	74%	0.736	76%	0.759	S	S	*	*			trans	72.6	150.5	135.7	59	0	0	0	0	119.1
331	K	32.6	Very low	31.3	Very low	184 Å²	184	138.3 Å²	138.3	80%	0.8	75%	0.753	S	S	*	*			cis	-153.8	163.4	18.7	-133.1	155.9	179.7	-176.8	0	112.9
332	S	31.5	Very low	31.4	Very low	98 Å²	98	139.5 Å²	139.5	69%	0.685	75%	0.752	S	S	*	*			trans	-23	157.4	156.7	55.7	0	0	0	0	118.3
333	S	32.1	Very low	31.2	Very low	93 Å²	93	135.7 Å²	135.7	65%	0.65	75%	0.747	S	S	*	*			cis	179.1	-160.4	-2.3	51.9	0	0	0	0	108
334	F	29.6	Very low	31.1	Very low	173 Å²	173	136.6 Å²	136.6	76%	0.759	75%	0.749	S	S	*	*			cis	-165.8	156.3	3.2	-126.2	-33.3	0	0	0	109.8
335	N	32.7	Very low	31.1	Very low	115 Å²	115	142.1 Å²	142.1	62%	0.615	75%	0.75	S	S	*	*			trans	63.2	159.3	153.7	-66.5	4.1	0	0	0	118.9
336	E	30.7	Very low	30.9	Very low	152 Å²	152	143.7 Å²	143.7	71%	0.71	75%	0.75	S	S	*	*			cis	-149.6	138.2	-0.5	-131.8	154.1	-116.2	0	0	114.4
337	L	32.2	Very low	31	Very low	156 Å²	156	143.5 Å²	143.5	82%	0.817	75%	0.748	S	S	*	*			trans	31.2	104.5	148.2	-58.7	174.9	0	0	0	124.3
338	K	35.2	Very low	31.3	Very low	174 Å²	174	142.3 Å²	142.3	76%	0.757	75%	0.748	S	S	*	*				13	148.1	115.2	-83.2	-177.5	176.3	178.5	0	120.3
339	P	31.6	Very low	31.3	Very low	126 Å²	126	146.6 Å²	146.6	82%	0.818	76%	0.756	S	S	*	*				-124.5	165.8	94.4	37.1	-34.2	0	0	0	114.9
340	C	27	Very low	31.5	Very low	92 Å²	92	144.5 Å²	144.5	62%	0.622	76%	0.759	S	S	*	*			trans	-131.8	136.2	170.8	-52.2	0	0	0	0	109.5
341	F	28.8	Very low	31.7	Very low	177 Å²	177	143 Å²	143	78%	0.776	76%	0.758	S	S	*	*			trans	-107.6	118.3	167.4	-103.3	-92.1	0	0	0	111.4	I415	F341-I415 HydrophobicContact CE1-CD1 4.14Å
342	K	31.6	Very low	31.7	Very low	189 Å²	189	143.2 Å²	143.2	82%	0.822	76%	0.762	S	S	*	*			trans	-140.5	110.3	163	-83.5	-167.7	174.9	-174.9	0	108.3	T344	K342-T344 PolarHBondContact O-N 2.81Å
343	P	30.3	Very low	31.5	Very low	121 Å²	121	144.6 Å²	144.6	79%	0.786	77%	0.77	S	S	*	*			trans	-76.1	109.7	176.2	29.6	-32.1	0	0	0	110.4
344	T	30.4	Very low	31.6	Very low	126 Å²	126	143.8 Å²	143.8	77%	0.773	78%	0.776	S	S	*	*			trans	-130.9	78.3	164.3	37.9	0	0	0	0	109.4	K342 T346	K342-T344 PolarHBondContact O-N 2.81Å; T344-T346 PolarHBondContact O-N 2.88Å
345	F	32.2	Very low	31.6	Very low	197 Å²	197	145.5 Å²	145.5	86%	0.864	78%	0.784	S	S	*	*			trans	-66.4	113.7	-176.3	-117.7	-95.8	0	0	0	111.4
346	T	28.7	Very low	31.8	Very low	129 Å²	129	148.1 Å²	148.1	79%	0.791	80%	0.797	S	S	*	*			trans	-142.5	89.2	168.3	41.8	0	0	0	0	110.7	T344	T344-T346 PolarHBondContact O-N 2.88Å
347	S	33.8	Very low	32	Very low	94 Å²	94	145.3 Å²	145.3	66%	0.657	80%	0.8	S	S	*	*			trans	-159.5	145.5	178.5	-145.4	0	0	0	0	108.2
348	T	37.1	Very low	32	Very low	133 Å²	133	142.3 Å²	142.3	82%	0.816	80%	0.797	S	S	*	*			cis	-147.8	171.2	-1.1	-21.7	0	0	0	0	110.2
349	R	31.1	Very low	32.2	Very low	216 Å²	216	140.3 Å²	140.3	82%	0.815	80%	0.802	S	S	*	*			trans	-78.5	156.3	171.7	-55.7	167.9	178.7	155.4	-3.5	111.7
350	I	34.7	Very low	32.3	Very low	170 Å²	170	145.3 Å²	145.3	87%	0.872	81%	0.805	S	S	*	*				-141.1	155.3	129	-93.7	146.4	0	0	0	106.7
351	A	32.8	Very low	32.7	Very low	87 Å²	87	151 Å²	151	72%	0.719	82%	0.819	S	S	*	*			trans	-145.1	145.8	179.6	0	0	0	0	0	110.9
352	H	31.4	Very low	33.3	Very low	190 Å²	190	148.6 Å²	148.6	88%	0.88	82%	0.821	S	S	*	*			trans	-137.8	144.7	165.9	-107.7	-102.1	0	0	0	109.3
353	C	27	Very low	33.7	Very low	127 Å²	127	143.1 Å²	143.1	86%	0.858	82%	0.819	S	S	*	*			trans	-116.4	143.3	176.5	-67	0	0	0	0	110.5
354	G	35.8	Very low	33.9	Very low	75 Å²	75	142.7 Å²	142.7	77%	0.773	82%	0.819	S	S	*	*			trans	-140.1	145.7	169.5	0	0	0	0	0	109.2
355	F	28.9	Very low	34.2	Very low	210 Å²	210	146 Å²	146	92%	0.921	83%	0.828	S	S	*	*			trans	-104.2	-178.2	-173.6	-116.4	-106.8	0	0	0	112.1
356	L	36.2	Very low	34.4	Very low	169 Å²	169	144.6 Å²	144.6	89%	0.885	82%	0.821	S	S	*	*			trans	96.5	143.3	178.3	-56.7	167.1	0	0	0	113.7
357	A	34.4	Very low	34.7	Very low	93 Å²	93	146 Å²	146	77%	0.769	82%	0.819	S	S	*	*			cis	169.1	150.8	-26.8	0	0	0	0	0	104.4
358	A	33.3	Very low	34.7	Very low	93 Å²	93	146.9 Å²	146.9	77%	0.769	83%	0.825	S	S	*	*			trans	-104.8	176.1	-175	0	0	0	0	0	112.8
359	P	38.4	Very low	34.6	Very low	132 Å²	132	145 Å²	145	86%	0.857	82%	0.823	S	S	*	*				-144.8	-159.2	85.8	38.9	-20.2	0	0	0	115.2
360	R	34	Very low	34.9	Very low	231 Å²	231	141.6 Å²	141.6	87%	0.872	83%	0.826	S	S	*	*			trans	-123.6	163.9	-171.7	-50.2	163.3	173	155	-6.9	111.3
361	F	35.6	Very low	34.6	Very low	212 Å²	212	138.6 Å²	138.6	93%	0.93	82%	0.82	S	S	*	*			trans	-160.2	151.1	137.5	-100.1	-69.6	0	0	0	111.9
362	P	41.4	Very low	34.9	Very low	126 Å²	126	139.6 Å²	139.6	82%	0.818	82%	0.819	S	S	*	*			trans	-133	168.4	-177.7	42.8	-28.5	0	0	0	117
363	G	40.8	Very low	35	Very low	75 Å²	75	136.1 Å²	136.1	77%	0.773	81%	0.811	S	S	*	*			trans	159.3	172.5	160.8	0	0	0	0	0	112.1
364	S	34.3	Very low	35.2	Very low	112 Å²	112	141.7 Å²	141.7	78%	0.783	82%	0.815	S	S	*	*			cis	173.4	106.5	-28.3	167	0	0	0	0	109
365	M	37.4	Very low	34.9	Very low	194 Å²	194	146.8 Å²	146.8	96%	0.956	82%	0.816	S	S	*	*			trans	-161.1	169.8	158.8	-117	169.3	-77.7	0	0	111
366	K	35	Very low	35.4	Very low	168 Å²	168	142.7 Å²	142.7	73%	0.73	81%	0.81	S	S	*	*			trans	-131.1	178.1	-162.9	-60.7	-178	177.9	177.8	0	113.1
367	E	35.4	Very low	35.3	Very low	160 Å²	160	144.1 Å²	144.1	75%	0.748	81%	0.809	S	S	*	*			trans	71.4	145	154.8	-75.3	138.7	-146.3	0	0	115.2
368	S	35	Very low	35	Very low	112 Å²	112	145.6 Å²	145.6	78%	0.783	81%	0.808	S	S	*	*			cis	-153.6	170.2	-7.7	50.6	0	0	0	0	111.7
369	A	33.3	Very low	35	Very low	93 Å²	93	145.4 Å²	145.4	77%	0.769	81%	0.807	S	S	*	*			trans	-37.9	150.4	-177.3	0	0	0	0	0	119.3
370	V	38.7	Very low	34.3	Very low	144 Å²	144	148 Å²	148	87%	0.873	81%	0.805	S	S	*	*				-179.1	147.3	126.2	147.3	0	0	0	0	110
371	S	28.5	Very low	34.3	Very low	108 Å²	108	143.4 Å²	143.4	76%	0.755	80%	0.802	S	S	*	*			trans	-141.9	168.5	175.4	-49	0	0	0	0	108.3
372	P	38.5	Very low	33.9	Very low	107 Å²	107	139.7 Å²	139.7	70%	0.695	79%	0.792	S	S	*	*			cis	-130.8	-164	-21.2	27.5	-3.5	0	0	0	112
373	T	33	Very low	33.6	Very low	118 Å²	118	139.1 Å²	139.1	72%	0.724	79%	0.791	S	S	*	*			trans	73	125.6	164.3	77.3	0	0	0	0	118.4
374	W	32.3	Very low	33.2	Very low	244 Å²	244	142.5 Å²	142.5	92%	0.924	79%	0.791	S	S	*	*				-174.8	169.3	112.9	-116.3	26.6	0	0	0	113
375	F	28.8	Very low	33.3	Very low	182 Å²	182	143.8 Å²	143.8	80%	0.798	80%	0.795	S	S	*	*			trans	-77.7	146.4	179.1	-67.5	-106	0	0	0	112.4	K377	F375-K377 PolarHBondContact O-N 3.34Å; F375-K377 VanDerWaalsContact O-N 3.08Å
376	P	39.7	Very low	33	Very low	123 Å²	123	140 Å²	140	80%	0.799	79%	0.785	S	S	*	*			trans	-79.5	82.7	164.8	33.4	-33	0	0	0	110.7	V378	P376-V378 PolarHBondContact O-N 2.89Å
377	K	33.2	Very low	32.8	Very low	199 Å²	199	140.4 Å²	140.4	87%	0.865	79%	0.794	S	S	*	*			trans	-86	94.5	168.2	-160.1	174.1	-171.5	177.8	0	108.8	F375 A379	F375-K377 PolarHBondContact O-N 3.34Å; F375-K377 VanDerWaalsContact O-N 3.08Å; K377-A379 PolarHBondContact O-N 3.25Å
378	V	29.3	Very low	32.6	Very low	125 Å²	125	138.3 Å²	138.3	76%	0.758	79%	0.793	S	S	*	*			trans	-65.7	121.8	-174.9	-179.1	0	0	0	0	110.7	P376	P376-V378 PolarHBondContact O-N 2.89Å
379	A	31.8	Very low	32.4	Very low	89 Å²	89	140.3 Å²	140.3	74%	0.736	79%	0.793	S	S	*	*			trans	-111.6	136.8	169.8	0	0	0	0	0	109.7	K377	K377-A379 PolarHBondContact O-N 3.25Å
380	F	24	Very low	32.3	Very low	185 Å²	185	147.1 Å²	147.1	81%	0.811	80%	0.799	S	S	*	*			trans	-78	138.4	179.6	-79.2	-106	0	0	0	111.6
381	V	33.7	Very low	31.8	Very low	136 Å²	136	149.9 Å²	149.9	82%	0.824	80%	0.8	S	S	*	*			trans	-132.1	106.5	157.3	-179	0	0	0	0	108
382	N	28.4	Very low	31.8	Very low	133 Å²	133	149.8 Å²	149.8	71%	0.711	80%	0.796	S	S	*	*			trans	-77.7	136.2	171.9	-81.2	-18.7	0	0	0	110.1
383	S	34.2	Very low	31.2	Very low	115 Å²	115	149.3 Å²	149.3	80%	0.804	80%	0.801	S	S	*	*			trans	-140	104.8	155.7	50.3	0	0	0	0	109.6
384	N	33.7	Very low	31.2	Very low	145 Å²	145	150.8 Å²	150.8	78%	0.775	80%	0.803	S	S	*	*			trans	-89.5	126.6	176.1	-70.1	-26.2	0	0	0	109.5
385	T	35.3	Very low	30.8	Very low	140 Å²	140	144.8 Å²	144.8	86%	0.859	79%	0.793	S	S	*	*				-172.1	141.8	127.5	15.9	0	0	0	0	110.8
386	P	30.9	Very low	30.7	Very low	115 Å²	115	143.6 Å²	143.6	75%	0.747	79%	0.793	S	S	*	*			trans	-96.9	153.1	-174.8	37	-34.1	0	0	0	113.3
387	L	31.7	Very low	30	Very low	175 Å²	175	140.9 Å²	140.9	92%	0.916	78%	0.781	S	S	*	*			trans	-122.9	155.3	158.4	-86.7	172.1	0	0	0	110.5
388	T	30	Very low	29.6	Very low	117 Å²	117	137.2 Å²	137.2	72%	0.718	78%	0.781	S	S	*	*			trans	-105.7	178.7	-158.8	55.1	0	0	0	0	113.6
389	L	32.1	Very low	29.6	Very low	153 Å²	153	135.7 Å²	135.7	80%	0.801	78%	0.776	S	S	*	*			trans	96.4	135.6	156.6	-67.7	156.4	0	0	0	120
390	R	30.9	Very low	29.3	Very low	237 Å²	237	140.3 Å²	140.3	89%	0.894	78%	0.775	S	S	*	*			trans	74.9	108.9	161.5	-69.1	177.5	176.2	179.2	-1.4	118.7
391	K	27.2	Very low	29.7	Very low	202 Å²	202	137.9 Å²	137.9	88%	0.878	78%	0.778	S	S	*	*			trans	-57.1	144.1	162.6	-50.2	170.7	-179.1	178.7	0	111.3
392	P	28.8	Very low	29.3	Very low	106 Å²	106	137.8 Å²	137.8	69%	0.688	77%	0.773	S	S	*	*			trans	-92.5	127.2	138.6	32.9	-26.9	0	0	0	109.5	I394	P392-I394 HydrophobicContact CB-CG1 4.26Å; P392-I394 PolarHBondContact O-N 2.8Å
393	A	27.1	Very low	29.5	Very low	96 Å²	96	136.4 Å²	136.4	79%	0.793	77%	0.774	S	S	*	*			trans	-84	102.9	162.6	0	0	0	0	0	107.9	V395	A393-V395 PolarHBondContact O-N 3.21Å
394	I	32	Very low	29.4	Very low	150 Å²	150	141.6 Å²	141.6	77%	0.769	78%	0.776	S	S	*	*			trans	-90	95.9	175	-59.6	-177.4	0	0	0	108.4	P392	P392-I394 HydrophobicContact CB-CG1 4.26Å; P392-I394 PolarHBondContact O-N 2.8Å
395	V	24.7	Very low	29.2	Very low	118 Å²	118	139.3 Å²	139.3	72%	0.715	77%	0.771	S	S	*	*			trans	-72.6	168.2	159	-176.9	0	0	0	0	108.1	A393	A393-V395 PolarHBondContact O-N 3.21Å
396	I	25.9	Very low	28.9	Very low	156 Å²	156	139.4 Å²	139.4	80%	0.8	77%	0.767	S	S	*	*			trans	84.9	121.1	178.7	-48.3	159.4	0	0	0	112.4
397	A	24.5	Very low	28.8	Very low	66 Å²	66	138.2 Å²	138.2	55%	0.545	77%	0.767	S	S	.	*			cis	-161.7	160.3	-14.9	0	0	0	0	0	111	S399	A397-S399 PolarHBondContact O-N 3.36Å
398	S	24.8	Very low	28.8	Very low	123 Å²	123	135.9 Å²	135.9	86%	0.86	76%	0.76	S	S	*	*			trans	-71.1	60.2	153	42.6	0	0	0	0	110.8	Y400	S398-Y400 PolarHBondContact O-N 3.39Å
399	S	30.6	Very low	28.8	Very low	92 Å²	92	140.1 Å²	140.1	64%	0.643	76%	0.764	S	S	*	*			trans	-96.5	96.4	-173	53.2	0	0	0	0	112.8	A397	A397-S399 PolarHBondContact O-N 3.36Å
400	Y	24.6	Very low	28.5	Very low	186 Å²	186	140.1 Å²	140.1	73%	0.729	76%	0.764	S	S	*	*			trans	-50.3	153.9	154.4	-66.5	-111.2	0	0	0	111.4	S398 N402	S398-Y400 PolarHBondContact O-N 3.39Å; Y400-N402 HydrophobicContact CD1-CB 4.46Å; Y400-N402 HydrophobicContact CG-CB 4.12Å; Y400-N402 PolarHBondContact O-N 3.32Å
401	P	31.5	Very low	28.5	Very low	134 Å²	134	138.6 Å²	138.6	87%	0.87	76%	0.764	S	S	*	*			trans	-73.6	60.9	149.3	35	-34	0	0	0	110	S403	P401-S403 PolarHBondContact O-N 3.24Å
402	N	27.1	Very low	28.5	Very low	134 Å²	134	134.4 Å²	134.4	72%	0.717	76%	0.76	S	S	*	*			trans	-94.6	84.5	179.7	-162.9	3.4	0	0	0	110.4	Y400	Y400-N402 HydrophobicContact CD1-CB 4.46Å; Y400-N402 HydrophobicContact CG-CB 4.12Å; Y400-N402 PolarHBondContact O-N 3.32Å
403	S	32.3	Very low	28.7	Very low	105 Å²	105	138.5 Å²	138.5	73%	0.734	77%	0.77	S	S	*	*			trans	-147.9	131.5	168.2	63.4	0	0	0	0	111.2	P401	P401-S403 PolarHBondContact O-N 3.24Å
404	R	31.2	Very low	28.8	Very low	223 Å²	223	137 Å²	137	84%	0.842	77%	0.765	S	S	*	*			cis	-169.7	136.2	-15	-167.4	175	-178.2	166.5	-0.7	105.9
405	S	29.2	Very low	28.8	Very low	97 Å²	97	136.6 Å²	136.6	68%	0.678	76%	0.762	S	S	*	*			trans	60.8	136.2	173.6	25.7	0	0	0	0	115.4
406	D	29.7	Very low	29	Very low	143 Å²	143	138.1 Å²	138.1	77%	0.765	77%	0.767	S	S	*	*			cis	-136.1	150	1.1	-67.2	-55.7	0	0	0	108.8
407	A	28.1	Very low	28.9	Very low	90 Å²	90	139.7 Å²	139.7	74%	0.744	77%	0.768	S	S	*	*			cis	82.9	44.1	33.6	0	0	0	0	0	116.3
408	T	32.6	Very low	29.2	Very low	126 Å²	126	145.4 Å²	145.4	77%	0.773	79%	0.786	S	S	*	*			trans	-135.2	107.9	159.2	56.4	0	0	0	0	114.7
409	Y	28.9	Very low	29.4	Very low	206 Å²	206	144.5 Å²	144.5	81%	0.808	78%	0.775	S	S	*	*			trans	43.8	107.7	140.2	-77.2	-94.8	0	0	0	121.7
410	L	26.9	Very low	29.3	Very low	153 Å²	153	149.3 Å²	149.3	80%	0.801	79%	0.787	S	S	*	*				31.4	121.6	114.9	-66.2	166.7	0	0	0	119
411	K	30.3	Very low	29.5	Very low	204 Å²	204	145.5 Å²	145.5	89%	0.887	79%	0.787	S	S	*	*				-163.6	155.8	106.2	-110.3	179.9	179.3	-169.8	0	113.4
412	S	26.8	Very low	29.4	Very low	115 Å²	115	144.9 Å²	144.9	80%	0.804	79%	0.786	S	S	*	*			trans	-108.6	109.7	-174.8	52.5	0	0	0	0	112.1
413	E	33	Very low	29.4	Very low	191 Å²	191	143.6 Å²	143.6	89%	0.893	78%	0.783	S	S	*	*			trans	-142.7	141.9	161.5	-64.3	178.8	-168.7	0	0	105.6
414	G	29.6	Very low	29.3	Very low	66 Å²	66	147.4 Å²	147.4	68%	0.68	79%	0.792	S	S	*	*			cis	135.5	77.4	13	0	0	0	0	0	108.4
415	I	31.7	Very low	29.3	Very low	141 Å²	141	145.4 Å²	145.4	72%	0.723	79%	0.792	S	S	*	*			trans	-121.2	116.9	177.2	-62.8	179.2	0	0	0	107.8	F341	F341-I415 HydrophobicContact CE1-CD1 4.14Å
416	N	29.2	Very low	29.4	Very low	150 Å²	150	146.5 Å²	146.5	80%	0.802	80%	0.799	S	S	*	*			trans	-76.7	149.8	-169.5	-65.5	-24.7	0	0	0	112.7
417	F	24.9	Very low	29.4	Very low	188 Å²	188	146 Å²	146	83%	0.825	80%	0.801	S	S	*	*			trans	-62	144.2	155.6	-77.8	-111.7	0	0	0	109.6
418	M	30.1	Very low	29.6	Very low	187 Å²	187	149.2 Å²	149.2	92%	0.921	81%	0.806	S	S	*	*			trans	-113.1	94.3	152.3	-80.5	-177.8	65	0	0	107.5
419	T	28.6	Very low	29.5	Very low	104 Å²	104	151.2 Å²	151.2	64%	0.638	81%	0.811	S	S	*	*			trans	-70.4	133.1	168	46.8	0	0	0	0	109.7
420	H	28.7	Very low	29.5	Very low	193 Å²	193	150.4 Å²	150.4	89%	0.894	82%	0.815	S	S	*	*			trans	-127.8	111.2	147.5	-114.9	-86.7	0	0	0	107.9
421	S	28.1	Very low	29.6	Very low	105 Å²	105	148.8 Å²	148.8	73%	0.734	82%	0.816	S	S	*	*			trans	-80.6	130.4	-179.7	-53.7	0	0	0	0	110.2
422	S	29.8	Very low	29.6	Very low	121 Å²	121	144.5 Å²	144.5	85%	0.846	81%	0.812	S	S	*	*			trans	-128.1	133.9	146.6	48.9	0	0	0	0	107.1
423	V	28.6	Very low	29.7	Very low	107 Å²	107	147 Å²	147	65%	0.648	82%	0.816	S	S	*	*			trans	-92.8	127.6	-163	177.4	0	0	0	0	110.6	Q425	V423-Q425 HydrophobicContact CG1-CG 3.78Å
424	M	30	Very low	29.5	Very low	186 Å²	186	146.2 Å²	146.2	92%	0.916	82%	0.816	S	S	*	*			trans	-130.1	116.4	156.1	-90.9	-69.2	159.5	0	0	107.9
425	Q	29.6	Very low	29.5	Very low	181 Å²	181	154 Å²	154	85%	0.846	83%	0.827	S	S	*	*			trans	-102.2	106.6	179.9	-75.3	174	-21	0	0	109.8	V423	V423-Q425 HydrophobicContact CG1-CG 3.78Å
426	S	31.4	Very low	29.4	Very low	119 Å²	119	151.5 Å²	151.5	83%	0.832	82%	0.822	S	S	*	*			trans	-152.3	137.6	151.1	48.8	0	0	0	0	110.5
427	T	31	Very low	29.5	Very low	132 Å²	132	152.2 Å²	152.2	81%	0.81	82%	0.821	S	S	*	*			trans	-63.3	130.2	-174.5	45.9	0	0	0	0	113.5
428	D	31.1	Very low	29.6	Very low	159 Å²	159	150.6 Å²	150.6	85%	0.85	82%	0.821	S	S	*	*			trans	-153.9	107.6	144.7	-129.9	-14.8	0	0	0	111.1
429	L	30.9	Very low	29.7	Very low	167 Å²	167	145.2 Å²	145.2	87%	0.874	81%	0.814	S	S	*	*			trans	-117.7	65.2	-162.5	-106	173.8	0	0	0	113
430	Q	30	Very low	29.8	Very low	189 Å²	189	147.9 Å²	147.9	88%	0.883	82%	0.817	S	S	*	*	S	Bend	trans	-150.9	-5.6	166.4	-122.2	175.4	28.6	0	0	118.9
431	S	28.7	Very low	29.7	Very low	119 Å²	119	149 Å²	149	83%	0.832	81%	0.814	S	S	*	*	S	Bend	trans	-95.9	9	-163.9	-54.2	0	0	0	0	117.4
432	S	28.9	Very low	29.7	Very low	115 Å²	115	149.6 Å²	149.6	80%	0.804	81%	0.808	S	S	*	*			trans	-117	11	-154.8	-53.5	0	0	0	0	117.4
433	L	30.1	Very low	29.7	Very low	167 Å²	167	147.8 Å²	147.8	87%	0.874	80%	0.795	S	S	*	*	S	Bend	trans	-110.5	-4.9	-175	-81.9	171.2	0	0	0	116.6	Y435	L433-Y435 PolarHBondContact O-N 3.43Å
434	L	28.9	Very low	29.7	Very low	174 Å²	174	148.5 Å²	148.5	91%	0.911	80%	0.8	S	S	*	*	S	Bend	trans	-100.9	46.1	-178.3	-67.8	177.7	0	0	0	113.9
435	Y	29.3	Very low	29.6	Very low	229 Å²	229	148 Å²	148	90%	0.898	80%	0.798	S	S	*	*			trans	-137.7	44.6	171.5	-130.2	-88.4	0	0	0	114.1	L433	L433-Y435 PolarHBondContact O-N 3.43Å
436	S	29.3	Very low	29.7	Very low	90 Å²	90	150 Å²	150	63%	0.629	80%	0.798	S	S	*	*	S	Bend	trans	-126.8	120.4	172.5	-169.4	0	0	0	0	111.9
437	Q	30.6	Very low	29.6	Very low	164 Å²	164	153.1 Å²	153.1	77%	0.766	80%	0.799	S	S	*	*	S	Bend	trans	52	100.3	153.7	-57	178.1	35.6	0	0	118.6	G439	Q437-G439 PolarHBondContact O-N 3.07Å; Q437-G439 VanDerWaalsContact O-N 3.09Å
438	N	29	Very low	29.6	Very low	154 Å²	154	154 Å²	154	82%	0.824	80%	0.798	S	S	*	*			trans	63.4	18.7	146.1	-54.3	-26.2	0	0	0	119	F440	N438-F440 PolarHBondContact O-N 3.2Å; N438-F440 VanDerWaalsContact O-N 3.11Å
439	G	31.6	Very low	29.7	Very low	75 Å²	75	152.4 Å²	152.4	77%	0.773	80%	0.8	S	S	*	*			trans	-66.4	104.2	173.8	0	0	0	0	0	113.7	Q437	Q437-G439 PolarHBondContact O-N 3.07Å; Q437-G439 VanDerWaalsContact O-N 3.09Å
440	F	29.9	Very low	30.1	Very low	160 Å²	160	152.9 Å²	152.9	70%	0.702	80%	0.802	S	S	*	*			trans	-76.6	120.8	167.1	-84.8	-101.5	0	0	0	110.2	N438	N438-F440 PolarHBondContact O-N 3.2Å; N438-F440 VanDerWaalsContact O-N 3.11Å
441	Y	26.8	Very low	30.3	Very low	215 Å²	215	147.5 Å²	147.5	84%	0.843	80%	0.797	S	S	*	*			trans	-110.9	105.4	168	-126.6	-86.9	0	0	0	110.2	S443	Y441-S443 WeakPolarHBondContact CD1-OG 3.31Å
442	I	28.1	Very low	30.6	Very low	118 Å²	118	144.7 Å²	144.7	61%	0.605	79%	0.787	S	S	*	*			trans	-112.1	87.3	172.8	-57.3	177.8	0	0	0	107.1	T444	I442-T444 PolarHBondContact O-N 3.3Å
443	S	30.2	Very low	30.9	Very low	83 Å²	83	146.4 Å²	146.4	58%	0.58	79%	0.787	S	S	*	*			trans	-79	99.2	178.5	-68.5	0	0	0	0	111.4	Y441 M445	Y441-S443 WeakPolarHBondContact CD1-OG 3.31Å; S443-M445 PolarHBondContact O-N 2.99Å; S443-M445 VanDerWaalsContact O-N 3.09Å
444	T	28.7	Very low	31.2	Very low	122 Å²	122	145.2 Å²	145.2	75%	0.748	78%	0.782	S	S	*	*			trans	-73.8	92.3	166.1	52.7	0	0	0	0	110.1	I442 R446	I442-T444 PolarHBondContact O-N 3.3Å; T444-R446 PolarHBondContact O-N 2.92Å; T444-R446 VanDerWaalsContact O-N 3.09Å
445	M	27.3	Very low	31.5	Very low	175 Å²	175	143.4 Å²	143.4	86%	0.862	78%	0.781	S	S	*	*			trans	-68.2	101.8	173.1	-71.7	-87.6	-84.2	0	0	110	S443	S443-M445 PolarHBondContact O-N 2.99Å; S443-M445 VanDerWaalsContact O-N 3.09Å
446	R	31.5	Very low	32	Very low	225 Å²	225	135.3 Å²	135.3	85%	0.849	77%	0.767	S	S	*	*			trans	-76.5	122.7	167.5	-80.2	-179	169.6	163.1	-5	109.4	T444	T444-R446 PolarHBondContact O-N 2.92Å; T444-R446 VanDerWaalsContact O-N 3.09Å
447	H	29.3	Very low	32.4	Very low	184 Å²	184	138 Å²	138	85%	0.852	77%	0.774	S	S	*	*			trans	-73.2	122.2	157.5	-77.3	-100.1	0	0	0	108.4
448	N	32	Very low	32.6	Very low	150 Å²	150	137.2 Å²	137.2	80%	0.802	78%	0.775	S	S	*	*			trans	-142.2	94.7	167.8	-103.4	9.7	0	0	0	108.5
449	S	33.4	Very low	33.1	Very low	126 Å²	126	134.4 Å²	134.4	88%	0.881	77%	0.773	S	S	*	*			trans	-113.1	87.4	163.8	-71.8	0	0	0	0	108.6
450	L	38.1	Very low	33.4	Very low	177 Å²	177	136 Å²	136	93%	0.927	77%	0.772	S	S	*	*			trans	-164.1	120.4	160.3	-104.4	165.8	0	0	0	106.1
451	G	34.4	Very low	33.6	Very low	75 Å²	75	135.6 Å²	135.6	77%	0.773	78%	0.776	S	S	*	*			trans	-99.3	163.2	-172.6	0	0	0	0	0	113.4
452	G	35.3	Very low	33.9	Very low	61 Å²	61	131.3 Å²	131.3	63%	0.629	77%	0.772	S	S	*	*			trans	75.2	91.5	162.5	0	0	0	0	0	116.6
453	N	35.8	Very low	34.3	Very low	150 Å²	150	132 Å²	132	80%	0.802	78%	0.782	S	S	*	*				166.9	158.1	87.3	-78.9	-25.7	0	0	0	112.7
454	N	36.5	Very low	34.5	Very low	142 Å²	142	131.9 Å²	131.9	76%	0.759	79%	0.786	S	S	*	*			trans	60	99	161.8	-59.3	-9.8	0	0	0	118.9	G456	N454-G456 PolarHBondContact O-N 2.98Å
455	P	34.2	Very low	34.9	Very low	137 Å²	137	132.2 Å²	132.2	89%	0.89	79%	0.788	S	S	*	*	S	Bend	trans	-78	83.1	168.1	33.1	-33.2	0	0	0	111.4
456	G	40.9	Very low	35.4	Very low	59 Å²	59	130.5 Å²	130.5	61%	0.608	78%	0.781	S	S	*	*			trans	-124.8	-58.4	178.3	0	0	0	0	0	114.6	N454 L458	N454-G456 PolarHBondContact O-N 2.98Å; G456-L458 PolarHBondContact O-N 3.28Å
457	D	36.4	Very low	35.4	Very low	147 Å²	147	123.6 Å²	123.6	79%	0.786	77%	0.765	S	S	*	*			trans	-89.8	16.7	-162.6	-64.4	-62.8	0	0	0	116.3	A459 S460	D457-A459 PolarHBondContact O-N 3.12Å; D457-S460 PolarHBondContact O-N 3.16Å
458	L	36.2	Very low	35.8	Very low	147 Å²	147	119 Å²	119	77%	0.77	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-2.2	-171.9	-94.8	167.2	0	0	0	115.8	G456	G456-L458 PolarHBondContact O-N 3.28Å
459	A	38.7	Very low	36	Very low	95 Å²	95	118.2 Å²	118.2	79%	0.785	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	-20	177	0	0	0	0	0	114.5	D457	D457-A459 PolarHBondContact O-N 3.12Å
460	S	37.1	Very low	36.4	Very low	108 Å²	108	120.8 Å²	120.8	76%	0.755	75%	0.745	S	S	*	*	S	Bend	trans	-106	0.7	-165.5	-63.3	0	0	0	0	115.9	D457	D457-S460 PolarHBondContact O-N 3.16Å
461	L	34.5	Very low	36.4	Very low	152 Å²	152	118.5 Å²	118.5	80%	0.796	74%	0.739	S	S	*	*			trans	-119.2	40	-172	-155.6	74.1	0	0	0	114.3
462	V	34	Very low	37	Very low	124 Å²	124	120.1 Å²	120.1	75%	0.752	74%	0.738	S	S	*	*			trans	-101.1	-15.6	-179.1	-178.3	0	0	0	0	113	A464	V462-A464 PolarHBondContact O-N 3.02Å
463	T	36.5	Very low	37.9	Very low	133 Å²	133	120.8 Å²	120.8	82%	0.816	73%	0.728	S	S	*	*			trans	-97	36	-177.2	-32.1	0	0	0	0	113.3	T465	T463-T465 PolarHBondContact O-N 2.76Å; T463-T465 VanDerWaalsContact O-N 3.13Å
464	A	34.1	Very low	39.4	Very low	80 Å²	80	122.4 Å²	122.4	66%	0.661	72%	0.722	S	S	*	*			trans	-73.8	100	168.2	0	0	0	0	0	108.9	V462 I466	V462-A464 PolarHBondContact O-N 3.02Å; A464-I466 PolarHBondContact O-N 3.26Å
465	T	37.5	Very low	41.7	Very low	129 Å²	129	118.5 Å²	118.5	79%	0.791	70%	0.704	S	S	*	*			trans	-56.5	107	-176.1	-45.9	0	0	0	0	111.2	T463 P467	T463-T465 PolarHBondContact O-N 2.76Å; T463-T465 VanDerWaalsContact O-N 3.13Å; T465-P467 WeakPolarHBondContact O-CD 3.46Å
466	I	36.1	Very low	44.1	Very low	140 Å²	140	113.7 Å²	113.7	72%	0.718	67%	0.672	S	S	*	*			trans	-60.9	124.9	171.8	-59.8	174.3	0	0	0	107.4	A464 S468	A464-I466 PolarHBondContact O-N 3.26Å; I466-S468 PolarHBondContact O-N 3.5Å
467	P	33.2	Very low	46.3	Very low	79 Å²	79	117.4 Å²	117.4	51%	0.513	67%	0.672	S	S	.	*			trans	-56.3	124.9	175.4	-26.1	35.4	0	0	0	110.5	T465 D469 F470	T465-P467 WeakPolarHBondContact O-CD 3.46Å; P467-D469 PolarHBondContact O-N 2.95Å; P467-F470 PolarHBondContact O-N 3.26Å
468	S	37.4	Very low	49	Very low	89 Å²	89	111.1 Å²	111.1	62%	0.622	64%	0.639	S	S	*	*	G	3₁₀ helix	trans	-57.4	-20.7	-177.3	40.5	0	0	0	0	113.8	I466 F470 T471	I466-S468 PolarHBondContact O-N 3.5Å; S468-F470 PolarHBondContact O-N 2.85Å; S468-T471 PolarHBondContact O-OG1 3.41Å
469	D	36.1	Very low	51.5	Low	133 Å²	133	109 Å²	109	71%	0.711	63%	0.634	S	S	*	*	G	3₁₀ helix	trans	-76.7	-9.4	-172.1	-45.6	-32.5	0	0	0	112.9	P467 T471	P467-D469 PolarHBondContact O-N 2.95Å; D469-T471 PolarHBondContact O-N 3.11Å
470	F	40.6	Very low	53.8	Low	180 Å²	180	108.7 Å²	108.7	79%	0.789	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-72	8.8	177.5	-112	-87.5	0	0	0	114.8	P467 S468	P467-F470 PolarHBondContact O-N 3.26Å; S468-F470 PolarHBondContact O-N 2.85Å
471	T	38.4	Very low	56.1	Low	128 Å²	128	111.5 Å²	111.5	79%	0.785	62%	0.621	S	S	*	*	S	Bend	trans	-107.4	39	-167.1	57	0	0	0	0	115	S468 D469	S468-T471 PolarHBondContact O-OG1 3.41Å; D469-T471 PolarHBondContact O-N 3.11Å
472	S	48.2	Very low	58.5	Low	109 Å²	109	108.2 Å²	108.2	76%	0.762	63%	0.625	S	S	*	*	S	Bend	trans	-130.2	-34.8	-179.7	63.7	0	0	0	0	117.2
473	N	54.4	Low	61.1	Low	76 Å²	76	103.7 Å²	103.7	41%	0.406	60%	0.598	S	S	.	*			trans	-120.6	73.6	-167.1	-152.2	19.7	0	0	0	113.9	F54 T475	F54-N473 VanDerWaalsContact CD1-ND2 3.29Å; F54-N473 WeakPolarHBondContact CD1-ND2 3.31Å; F54-N473 HydrophobicContact CE1-CB 4.27Å; F54-N473 WeakPolarHBondContact CE1-ND2 3.49Å; N473-T475 PolarHBondContact O-N 2.8Å; N473-T475 VanDerWaalsContact O-N 3.09Å
474	R	65.8	Low	63.5	Low	183 Å²	183	100.5 Å²	100.5	69%	0.691	59%	0.592	S	S	*	*			trans	-82	78.9	179.9	-173	-174	-73.5	-164.9	-4.4	111.6
475	T	84.7	Confident	66	Low	61 Å²	61	99.9 Å²	99.9	37%	0.374	57%	0.574	S	S	.	*			trans	-64.2	156.2	173.9	56.2	0	0	0	0	112.4	N473 F487	N473-T475 PolarHBondContact O-N 2.8Å; N473-T475 VanDerWaalsContact O-N 3.09Å; T475-F487 CarbonylContact C-O 3.51Å; T475-F487 VanDerWaalsContact CA-O 3.3Å; T475-F487 WeakPolarHBondContact CA-O 3.39Å
476	V	84.8	Confident	68.5	Low	35 Å²	35	95.9 Å²	95.9	21%	0.212	55%	0.55	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	123.7	-172.7	-170.9	0	0	0	0	109.7	T486 F487 T490 M493	V476-T486 CarbonylContact O-C 3.51Å; V476-T486 WeakPolarHBondContact O-CA 3.49Å; V476-F487 PolarHBondContact N-O 3.03Å; V476-F487 PolarHBondContact O-N 3.02Å; V476-T490 HydrophobicContact CG1-CG2 4.29Å; V476-T490 HydrophobicContact CG2-CG2 3.77Å; V476-M493 HydrophobicContact CB-CB 4.37Å; V476-M493 HydrophobicContact CG1-CB 4Å; V476-M493 HydrophobicContact CG1-CG 3.97Å
477	F	88.2	Confident	71.1	Confident	138 Å²	138	90.5 Å²	90.5	61%	0.605	52%	0.521	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.9	153.1	-179.6	-63.6	-97.4	0	0	0	111.6	P479 T486 M493	F477-P479 WeakPolarHBondContact O-CD 3.45Å; F477-T486 HydrophobicContact CD1-CG2 3.45Å; F477-T486 VanDerWaalsContact CD1-CG2 3.45Å; F477-T486 HydrophobicContact CE1-CG2 3.45Å; F477-T486 VanDerWaalsContact CE1-CG2 3.45Å; F477-T486 HydrophobicContact CG-CG2 4.14Å; F477-T486 HydrophobicContact CZ-CG2 4.15Å; F477-M493 WeakPolarHBondContact O-CG 3.34Å
478	C	92.6	Very high	73.7	Confident	15 Å²	15	91.2 Å²	91.2	10%	0.101	51%	0.513	C	S	.	.			trans	-74.3	126.5	168.5	-171.5	0	0	0	0	111.3	H480 C483 K485 F487 M493 H496	C478-H480 PolarHBondContact O-N 2.95Å; C478-C483 HydrophobicContact CB-CB 4.28Å; C478-K485 PolarHBondContact N-O 2.9Å; C478-F487 HydrophobicContact CB-CE2 4.34Å; C478-M493 HydrophobicContact CB-CE 3.91Å; C478-M493 WeakPolarHBondContact SG-CE 3.42Å; C478-H496 VanDerWaalsContact SG-CD2 3.56Å; C478-H496 PolarHBondContact SG-NE2 3.15Å
479	P	87.7	Confident	76	Confident	102 Å²	102	92 Å²	92	66%	0.662	51%	0.511	S	S	*	.			trans	-68	-13.5	175.6	-22.2	34.4	0	0	0	114.8	F477 L481 M493	F477-P479 WeakPolarHBondContact O-CD 3.45Å; P479-L481 PolarHBondContact O-N 3.02Å; P479-M493 VanDerWaalsContact CD-SD 3.53Å; P479-M493 HydrophobicContact CG-SD 4.38Å
480	H	87.8	Confident	78.5	Confident	89 Å²	89	89.2 Å²	89.2	41%	0.412	50%	0.499	S	S	.	.	S	Bend	trans	-73.2	122.7	-178.6	-168.5	-77.7	0	0	0	111	C478 C483 H500	C478-H480 PolarHBondContact O-N 2.95Å; H480-C483 HydrophobicContact CB-CB 4.02Å; H480-C483 VanDerWaalsContact O-CB 3.25Å; H480-C483 WeakPolarHBondContact O-CB 3.39Å; H480-C483 PolarHBondContact O-N 3.12Å; H480-C483 VanDerWaalsContact O-N 3.09Å; H480-H500 HydrophobicContact CB-CB 4.34Å; H480-H500 AromaticContact CD2-CG 3.6Å; H480-H500 AromaticContact CD2-ND1 3.8Å; H480-H500 AromaticContact CG-CD2 3.94Å; H480-H500 AromaticContact CG-CE1 3.94Å; H480-H500 AromaticContact CG-CG 3.61Å; H480-H500 AromaticContact CG-ND1 3.65Å; H480-H500 AromaticContact ND1-ND1 3.89Å
481	L	84.8	Confident	80.9	Confident	166 Å²	166	83.2 Å²	83.2	87%	0.869	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	140.5	178.4	-169.4	62.9	0	0	0	110.7	P479 C483	P479-L481 PolarHBondContact O-N 3.02Å; L481-C483 PolarHBondContact O-N 3.27Å
482	G	84.8	Confident	83.3	Confident	84 Å²	84	78.9 Å²	78.9	87%	0.866	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.5	-9.4	-176.7	0	0	0	0	0	116.2
483	C	89.4	Confident	85.4	Confident	29 Å²	29	74.2 Å²	74.2	20%	0.196	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-40.6	-178.5	-177.5	0	0	0	0	113.4	C478 H480 L481 K485 H496 H500	C478-C483 HydrophobicContact CB-CB 4.28Å; H480-C483 HydrophobicContact CB-CB 4.02Å; H480-C483 VanDerWaalsContact O-CB 3.25Å; H480-C483 WeakPolarHBondContact O-CB 3.39Å; H480-C483 PolarHBondContact O-N 3.12Å; H480-C483 VanDerWaalsContact O-N 3.09Å; L481-C483 PolarHBondContact O-N 3.27Å; C483-K485 PolarHBondContact O-N 2.81Å; C483-H496 PolarHBondContact SG-NE2 3.39Å; C483-H500 VanDerWaalsContact SG-CE1 3.51Å; C483-H500 PolarHBondContact SG-NE2 3.18Å
484	G	85.9	Confident	87	Confident	66 Å²	66	78.7 Å²	78.7	68%	0.68	44%	0.437	S	S	*	.			trans	65	-11	175.4	0	0	0	0	0	117.9
485	K	87.9	Confident	88	Confident	67 Å²	67	77.8 Å²	77.8	29%	0.291	44%	0.438	S	S	.	.			trans	-64	144.4	-175.6	-66.4	-173.3	-169.2	180	0	112.7	E190 C478 C483 F487	E190-K485 IonicContact OE1-NZ 2.74Å; E190-K485 IonicContact OE2-NZ 3.22Å; E190-K485 PolarHBondContact OE2-NZ 2.89Å; C478-K485 PolarHBondContact N-O 2.9Å; C483-K485 PolarHBondContact O-N 2.81Å; K485-F487 HydrophobicContact CB-CE2 3.63Å; K485-F487 HydrophobicContact CB-CZ 3.68Å; K485-F487 HydrophobicContact CD-CZ 4.04Å
486	T	90.1	Very high	88.3	Confident	45 Å²	45	75.5 Å²	75.5	28%	0.276	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	149.9	174.3	61.8	0	0	0	0	110.4	V476 F477	V476-T486 CarbonylContact O-C 3.51Å; V476-T486 WeakPolarHBondContact O-CA 3.49Å; F477-T486 HydrophobicContact CD1-CG2 3.45Å; F477-T486 VanDerWaalsContact CD1-CG2 3.45Å; F477-T486 HydrophobicContact CE1-CG2 3.45Å; F477-T486 VanDerWaalsContact CE1-CG2 3.45Å; F477-T486 HydrophobicContact CG-CG2 4.14Å; F477-T486 HydrophobicContact CZ-CG2 4.15Å
487	F	90.1	Very high	88.4	Confident	26 Å²	26	76.9 Å²	76.9	11%	0.114	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	148	-174.3	-61.9	-83.4	0	0	0	110.1	T475 V476 C478 K485 D489 A492 M493 H496	T475-F487 CarbonylContact C-O 3.51Å; T475-F487 VanDerWaalsContact CA-O 3.3Å; T475-F487 WeakPolarHBondContact CA-O 3.39Å; V476-F487 PolarHBondContact N-O 3.03Å; V476-F487 PolarHBondContact O-N 3.02Å; C478-F487 HydrophobicContact CB-CE2 4.34Å; K485-F487 HydrophobicContact CB-CE2 3.63Å; K485-F487 HydrophobicContact CB-CZ 3.68Å; K485-F487 HydrophobicContact CD-CZ 4.04Å; F487-D489 VanDerWaalsContact C-N 3.26Å; F487-D489 PolarHBondContact O-N 2.84Å; F487-A492 HydrophobicContact CB-CB 4.07Å; F487-A492 HydrophobicContact CD1-CB 4.06Å; F487-A492 HydrophobicContact CG-CB 4.39Å; F487-M493 HydrophobicContact CB-CB 4.2Å; F487-M493 HydrophobicContact CD2-CB 3.87Å; F487-M493 HydrophobicContact CD2-CG 3.86Å; F487-M493 HydrophobicContact CE2-CG 4.43Å; F487-M493 HydrophobicContact CG-CB 4.12Å; F487-H496 HydrophobicContact CE1-CB 3.74Å; F487-H496 HydrophobicContact CE2-CB 4.05Å; F487-H496 AromaticContact CE2-CD2 3.29Å; F487-H496 WeakPolarHBondContact CE2-CD2 3.42Å; F487-H496 AromaticContact CE2-CG 3.86Å; F487-H496 HydrophobicContact CZ-CB 3.44Å; F487-H496 VanDerWaalsContact CZ-CB 3.44Å; F487-H496 AromaticContact CZ-CD2 3.16Å; F487-H496 WeakPolarHBondContact CZ-CD2 3.44Å; F487-H496 AromaticContact CZ-CG 3.29Å
488	R	88.2	Confident	88.2	Confident	94 Å²	94	74.8 Å²	74.8	36%	0.355	42%	0.421	S	S	.	.	S	Bend	trans	-60.2	-36.9	172.3	-67.8	178.6	172	156.8	-15.8	112.5	D57	D57-R488 VanDerWaalsContact O-CZ 3.29Å; D57-R488 PolarHBondContact O-NH1 3.16Å; D57-R488 PolarHBondContact O-NH2 2.94Å; D57-R488 IonicContact OD1-CZ 3.36Å; D57-R488 IonicContact OD1-NE 3.53Å; D57-R488 IonicContact OD1-NH1 2.68Å; D57-R488 WeakPolarHBondContact OD2-CD 3.07Å; D57-R488 IonicContact OD2-CZ 2.79Å; D57-R488 IonicContact OD2-NE 3.95Å; D57-R488 IonicContact OD2-NH1 4Å; D57-R488 PolarHBondContact OD2-NH1 3.39Å
489	D	86.2	Confident	88	Confident	105 Å²	105	75.8 Å²	75.8	56%	0.561	43%	0.427	S	S	*	.	S	Bend	trans	-130.1	150.1	-171.2	-87.8	-51.3	0	0	0	114.3	F487 A491 A492 M493	F487-D489 VanDerWaalsContact C-N 3.26Å; F487-D489 PolarHBondContact O-N 2.84Å; D489-A491 HydrophobicContact CB-CB 4.47Å; D489-A491 PolarHBondContact O-N 2.86Å; D489-A491 VanDerWaalsContact O-N 3.15Å; D489-A492 HydrophobicContact CB-CB 4.26Å; D489-A492 PolarHBondContact O-N 3.48Å; D489-A492 VanDerWaalsContact O-N 3.12Å; D489-M493 PolarHBondContact O-N 3.38Å
490	T	88.9	Confident	88	Confident	75 Å²	75	73.7 Å²	73.7	46%	0.46	41%	0.408	S	S	.	.	H	α-helix	trans	-62.5	-20.1	169.7	71.5	0	0	0	0	113.2	V476 R494	V476-T490 HydrophobicContact CG1-CG2 4.29Å; V476-T490 HydrophobicContact CG2-CG2 3.77Å; T490-R494 WeakPolarHBondContact O-CB 3.38Å; T490-R494 PolarHBondContact O-N 3.25Å; T490-R494 PolarHBondContact O-NE 3.16Å; T490-R494 VanDerWaalsContact O-NE 3.14Å; T490-R494 PolarHBondContact OG1-NH2 3.2Å
491	A	89	Confident	87.9	Confident	54 Å²	54	70.4 Å²	70.4	45%	0.446	40%	0.398	S	S	.	.	H	α-helix	trans	-80.9	-36.8	175.6	0	0	0	0	0	112.1	D489 K495	D489-A491 HydrophobicContact CB-CB 4.47Å; D489-A491 PolarHBondContact O-N 2.86Å; D489-A491 VanDerWaalsContact O-N 3.15Å; A491-K495 WeakPolarHBondContact O-CG 3.39Å; A491-K495 PolarHBondContact O-N 3.33Å; A491-K495 VanDerWaalsContact O-N 3.16Å
492	A	90.2	Very high	88	Confident	38 Å²	38	66.5 Å²	66.5	31%	0.314	38%	0.382	S	S	.	.	H	α-helix	trans	-67.6	-44.2	171.3	0	0	0	0	0	110.4	F487 D489 K495 H496	F487-A492 HydrophobicContact CB-CB 4.07Å; F487-A492 HydrophobicContact CD1-CB 4.06Å; F487-A492 HydrophobicContact CG-CB 4.39Å; D489-A492 HydrophobicContact CB-CB 4.26Å; D489-A492 PolarHBondContact O-N 3.48Å; D489-A492 VanDerWaalsContact O-N 3.12Å; A492-K495 PolarHBondContact O-N 3.06Å; A492-H496 PolarHBondContact O-N 3.35Å
493	M	91.7	Very high	88.2	Confident	10 Å²	10	67.5 Å²	67.5	5%	0.049	36%	0.36	C	S	.	.	H	α-helix	trans	-56.1	-54.8	171.2	-163.3	-66.3	113.6	0	0	111.1	V476 F477 C478 P479 F487 D489 K495 H496 L497	V476-M493 HydrophobicContact CB-CB 4.37Å; V476-M493 HydrophobicContact CG1-CB 4Å; V476-M493 HydrophobicContact CG1-CG 3.97Å; F477-M493 WeakPolarHBondContact O-CG 3.34Å; C478-M493 HydrophobicContact CB-CE 3.91Å; C478-M493 WeakPolarHBondContact SG-CE 3.42Å; P479-M493 VanDerWaalsContact CD-SD 3.53Å; P479-M493 HydrophobicContact CG-SD 4.38Å; F487-M493 HydrophobicContact CB-CB 4.2Å; F487-M493 HydrophobicContact CD2-CB 3.87Å; F487-M493 HydrophobicContact CD2-CG 3.86Å; F487-M493 HydrophobicContact CE2-CG 4.43Å; F487-M493 HydrophobicContact CG-CB 4.12Å; D489-M493 PolarHBondContact O-N 3.38Å; M493-K495 PolarHBondContact O-N 2.86Å; M493-K495 VanDerWaalsContact O-N 3.12Å; M493-H496 CarbonylContact O-C 3.58Å; M493-H496 WeakPolarHBondContact O-CA 2.94Å; M493-H496 WeakPolarHBondContact O-CB 3.35Å; M493-H496 PolarHBondContact O-N 2.98Å; M493-L497 HydrophobicContact CE-CB 3.66Å; M493-L497 HydrophobicContact CE-CD1 4.18Å; M493-L497 HydrophobicContact CE-CG 4.42Å; M493-L497 PolarHBondContact O-N 3.08Å; M493-L497 HydrophobicContact SD-CB 4.21Å
494	R	87.9	Confident	88.2	Confident	170 Å²	170	70.5 Å²	70.5	64%	0.642	38%	0.377	S	S	*	.	H	α-helix	trans	-60.2	-26.5	-179.3	-90.2	176.5	-73.4	160	-7.6	114.8	T490	T490-R494 WeakPolarHBondContact O-CB 3.38Å; T490-R494 PolarHBondContact O-N 3.25Å; T490-R494 PolarHBondContact O-NE 3.16Å; T490-R494 VanDerWaalsContact O-NE 3.14Å; T490-R494 PolarHBondContact OG1-NH2 3.2Å
495	K	87.8	Confident	88.5	Confident	165 Å²	165	70.3 Å²	70.3	72%	0.717	36%	0.358	S	S	*	.	H	α-helix	trans	-69	-48.3	168.1	-73.1	174.1	179.5	179.6	0	111.2	A491 A492 M493 L497 H498	A491-K495 WeakPolarHBondContact O-CG 3.39Å; A491-K495 PolarHBondContact O-N 3.33Å; A491-K495 VanDerWaalsContact O-N 3.16Å; A492-K495 PolarHBondContact O-N 3.06Å; M493-K495 PolarHBondContact O-N 2.86Å; M493-K495 VanDerWaalsContact O-N 3.12Å; K495-L497 VanDerWaalsContact C-N 3.3Å; K495-L497 PolarHBondContact O-N 3.09Å; K495-H498 VanDerWaalsContact O-CB 3.23Å; K495-H498 WeakPolarHBondContact O-CB 3.24Å; K495-H498 PolarHBondContact O-N 2.95Å; K495-H498 VanDerWaalsContact O-N 3.16Å
496	H	89.5	Confident	88.7	Confident	12 Å²	12	72.2 Å²	72.2	6%	0.056	37%	0.371	C	S	.	.	H	α-helix	trans	-61.3	-34.8	176.2	169.5	49.4	0	0	0	113	C478 C483 F487 A492 M493 H498 T499 H500	C478-H496 VanDerWaalsContact SG-CD2 3.56Å; C478-H496 PolarHBondContact SG-NE2 3.15Å; C483-H496 PolarHBondContact SG-NE2 3.39Å; F487-H496 HydrophobicContact CE1-CB 3.74Å; F487-H496 HydrophobicContact CE2-CB 4.05Å; F487-H496 AromaticContact CE2-CD2 3.29Å; F487-H496 WeakPolarHBondContact CE2-CD2 3.42Å; F487-H496 AromaticContact CE2-CG 3.86Å; F487-H496 HydrophobicContact CZ-CB 3.44Å; F487-H496 VanDerWaalsContact CZ-CB 3.44Å; F487-H496 AromaticContact CZ-CD2 3.16Å; F487-H496 WeakPolarHBondContact CZ-CD2 3.44Å; F487-H496 AromaticContact CZ-CG 3.29Å; A492-H496 PolarHBondContact O-N 3.35Å; M493-H496 CarbonylContact O-C 3.58Å; M493-H496 WeakPolarHBondContact O-CA 2.94Å; M493-H496 WeakPolarHBondContact O-CB 3.35Å; M493-H496 PolarHBondContact O-N 2.98Å; H496-H498 PolarHBondContact O-N 3.28Å; H496-T499 PolarHBondContact CE1-OG1 3.46Å; H496-T499 PolarHBondContact ND1-OG1 3.42Å; H496-T499 PolarHBondContact O-N 3.01Å; H496-T499 PolarHBondContact O-OG1 3.27Å; H496-H500 AromaticContact CE1-CD2 3.7Å; H496-H500 AromaticContact CE1-CE1 3.89Å; H496-H500 AromaticContact CE1-NE2 3.08Å; H496-H500 PolarHBondContact CE1-NE2 3.23Å; H496-H500 AromaticContact NE2-CD2 3.6Å; H496-H500 AromaticContact NE2-NE2 2.98Å; H496-H500 PolarHBondContact NE2-NE2 3.27Å
497	L	87.6	Confident	88.9	Confident	64 Å²	64	70.1 Å²	70.1	34%	0.335	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-56.6	-26.4	177.2	-170.8	58.9	0	0	0	112.3	M493 K495 T499 H500 G501	M493-L497 HydrophobicContact CE-CB 3.66Å; M493-L497 HydrophobicContact CE-CD1 4.18Å; M493-L497 HydrophobicContact CE-CG 4.42Å; M493-L497 PolarHBondContact O-N 3.08Å; M493-L497 HydrophobicContact SD-CB 4.21Å; K495-L497 VanDerWaalsContact C-N 3.3Å; K495-L497 PolarHBondContact O-N 3.09Å; L497-T499 VanDerWaalsContact C-N 3.29Å; L497-T499 PolarHBondContact O-N 3.28Å; L497-H500 PolarHBondContact O-N 3.21Å; L497-G501 PolarHBondContact O-N 3.27Å
498	H	85	Confident	89	Confident	94 Å²	94	74 Å²	74	44%	0.435	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-61.2	-33.4	172.9	-170.2	20.6	0	0	0	112.8	K495 H496 H500 G501 V515	K495-H498 VanDerWaalsContact O-CB 3.23Å; K495-H498 WeakPolarHBondContact O-CB 3.24Å; K495-H498 PolarHBondContact O-N 2.95Å; K495-H498 VanDerWaalsContact O-N 3.16Å; H496-H498 PolarHBondContact O-N 3.28Å; H498-H500 PolarHBondContact O-N 2.99Å; H498-G501 WeakPolarHBondContact O-CA 3.34Å; H498-G501 PolarHBondContact O-N 3.37Å; H498-V515 PolarHBondContact CE1-O 3.05Å; H498-V515 WeakPolarHBondContact O-CG1 3.45Å
499	T	88.4	Confident	89.2	Confident	36 Å²	36	75.1 Å²	75.1	22%	0.221	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-67.7	-19	178.8	73.3	0	0	0	0	113.3	H496 L497	H496-T499 PolarHBondContact CE1-OG1 3.46Å; H496-T499 PolarHBondContact ND1-OG1 3.42Å; H496-T499 PolarHBondContact O-N 3.01Å; H496-T499 PolarHBondContact O-OG1 3.27Å; L497-T499 VanDerWaalsContact C-N 3.29Å; L497-T499 PolarHBondContact O-N 3.28Å
500	H	87.6	Confident	89.5	Confident	59 Å²	59	72.9 Å²	72.9	27%	0.273	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-97	3	170	-57.6	-60.6	0	0	0	112.7	H480 C483 H496 L497 H498	H480-H500 HydrophobicContact CB-CB 4.34Å; H480-H500 AromaticContact CD2-CG 3.6Å; H480-H500 AromaticContact CD2-ND1 3.8Å; H480-H500 AromaticContact CG-CD2 3.94Å; H480-H500 AromaticContact CG-CE1 3.94Å; H480-H500 AromaticContact CG-CG 3.61Å; H480-H500 AromaticContact CG-ND1 3.65Å; H480-H500 AromaticContact ND1-ND1 3.89Å; C483-H500 VanDerWaalsContact SG-CE1 3.51Å; C483-H500 PolarHBondContact SG-NE2 3.18Å; H496-H500 AromaticContact CE1-CD2 3.7Å; H496-H500 AromaticContact CE1-CE1 3.89Å; H496-H500 AromaticContact CE1-NE2 3.08Å; H496-H500 PolarHBondContact CE1-NE2 3.23Å; H496-H500 AromaticContact NE2-CD2 3.6Å; H496-H500 AromaticContact NE2-NE2 2.98Å; H496-H500 PolarHBondContact NE2-NE2 3.27Å; L497-H500 PolarHBondContact O-N 3.21Å; H498-H500 PolarHBondContact O-N 2.99Å
501	G	85.3	Confident	89.7	Confident	19 Å²	19	71.8 Å²	71.8	20%	0.196	40%	0.399	C	S	.	.	S	Bend	trans	-72.8	164.3	175.7	0	0	0	0	0	111.9	L497 H498 R503	L497-G501 PolarHBondContact O-N 3.27Å; H498-G501 WeakPolarHBondContact O-CA 3.34Å; H498-G501 PolarHBondContact O-N 3.37Å; G501-R503 PolarHBondContact O-N 3.21Å
502	P	85.8	Confident	89.8	Confident	84 Å²	84	73.2 Å²	73.2	55%	0.545	40%	0.395	S	S	.	.			trans	-57.7	135.8	178.3	24.2	-33.7	0	0	0	111	V504	P502-V504 HydrophobicContact CB-CG1 3.91Å; P502-V504 HydrophobicContact CG-CG1 3.9Å; P502-V504 PolarHBondContact O-N 2.8Å
503	R	89.7	Confident	89.9	Confident	105 Å²	105	73.3 Å²	73.3	40%	0.396	40%	0.396	S	S	.	.			trans	-72.4	64.8	176.2	-76.2	175.4	168.8	-178	-3	110.9	D185 D186 G501 H505 A513 F514 V515	D185-R503 IonicContact OD1-CZ 3.72Å; D185-R503 VanDerWaalsContact OD1-CZ 3.32Å; D185-R503 IonicContact OD1-NH1 3.91Å; D185-R503 PolarHBondContact OD1-NH1 2.91Å; D185-R503 IonicContact OD1-NH2 2.74Å; D185-R503 PolarHBondContact OD1-NH2 2.87Å; D186-R503 IonicContact OD2-CZ 3.87Å; D186-R503 IonicContact OD2-NE 3.32Å; D186-R503 IonicContact OD2-NH2 2.82Å; D186-R503 PolarHBondContact OD2-NH2 3.4Å; G501-R503 PolarHBondContact O-N 3.21Å; R503-H505 VanDerWaalsContact C-N 3.32Å; R503-H505 PolarHBondContact O-N 3.09Å; R503-A513 HydrophobicContact CB-CB 3.81Å; R503-A513 WeakPolarHBondContact CD-O 3.28Å; R503-A513 WeakPolarHBondContact O-CB 3.48Å; R503-F514 CarbonylContact C-O 3.12Å; R503-F514 VanDerWaalsContact CA-O 3.31Å; R503-F514 WeakPolarHBondContact CA-O 3.47Å; R503-V515 HydrophobicContact CG-CG2 3.69Å
504	V	90.5	Very high	89.9	Confident	92 Å²	92	74 Å²	74	56%	0.558	40%	0.399	S	S	*	.			trans	-71.9	-15.7	-170.5	-64.6	0	0	0	0	115.3	P502 I506 F514	P502-V504 HydrophobicContact CB-CG1 3.91Å; P502-V504 HydrophobicContact CG-CG1 3.9Å; P502-V504 PolarHBondContact O-N 2.8Å; V504-I506 PolarHBondContact O-N 2.82Å; V504-F514 PolarHBondContact N-O 3.38Å
505	H	91.6	Very high	90.1	Very high	62 Å²	62	66.3 Å²	66.3	29%	0.287	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	86.4	-177.7	-66	-61.4	0	0	0	110.5	R503 F514 V515 S517 L520	R503-H505 VanDerWaalsContact C-N 3.32Å; R503-H505 PolarHBondContact O-N 3.09Å; H505-F514 HydrophobicContact CB-CB 4.32Å; H505-F514 WeakPolarHBondContact CB-O 3.45Å; H505-F514 PolarHBondContact N-O 3.09Å; H505-F514 WeakPolarHBondContact O-CD2 3.4Å; H505-F514 PolarHBondContact O-N 2.85Å; H505-V515 PolarHBondContact CD2-O 2.9Å; H505-S517 PolarHBondContact CD2-N 3.38Å; H505-S517 PolarHBondContact NE2-N 3.48Å; H505-L520 HydrophobicContact CB-CB 4.02Å; H505-L520 HydrophobicContact CB-CD2 3.88Å
506	I	91.4	Very high	90.2	Very high	108 Å²	108	61.6 Å²	61.6	55%	0.554	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.9	134.9	-178.9	-58.3	172.4	0	0	0	110.6	V504 K512 A513	V504-I506 PolarHBondContact O-N 2.82Å; I506-K512 CarbonylContact C-O 3.51Å; I506-K512 WeakPolarHBondContact CA-O 3.02Å; I506-A513 HydrophobicContact CG1-CB 4.19Å
507	C	94.7	Very high	90.4	Very high	1 Å²	1	64 Å²	64	1%	0.007	37%	0.37	C	S	.	.			trans	-75	121.2	169.6	-171.7	0	0	0	0	110.5	E509 G511 K512 L520 H523	C507-E509 PolarHBondContact O-N 2.74Å; C507-G511 VanDerWaalsContact O-CA 3.31Å; C507-G511 WeakPolarHBondContact O-CA 3.4Å; C507-G511 PolarHBondContact O-N 2.79Å; C507-K512 HydrophobicContact CB-CB 4.46Å; C507-K512 PolarHBondContact N-O 3.2Å; C507-L520 HydrophobicContact CB-CD1 3.67Å; C507-H523 PolarHBondContact SG-NE2 2.8Å; C507-H523 VanDerWaalsContact SG-NE2 3.41Å
508	A	92.5	Very high	90.6	Very high	106 Å²	106	64 Å²	64	88%	0.876	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-24.5	-179.8	0	0	0	0	0	113.4
509	E	91.2	Very high	90.9	Very high	118 Å²	118	62.8 Å²	62.8	55%	0.551	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-19.3	-172.5	-63.7	177.2	-119.1	0	0	114.4	C507 H527	C507-E509 PolarHBondContact O-N 2.74Å; E509-H527 WeakPolarHBondContact CB-CE1 3.45Å; E509-H527 WeakPolarHBondContact CB-ND1 3.33Å; E509-H527 IonicContact OE1-CG 3.89Å; E509-H527 IonicContact OE1-ND1 3.99Å; E509-H527 WeakPolarHBondContact OE2-CB 3.49Å; E509-H527 IonicContact OE2-CE1 2.89Å; E509-H527 IonicContact OE2-CG 3.34Å; E509-H527 IonicContact OE2-ND1 2.8Å; E509-H527 PolarHBondContact OE2-ND1 3.43Å
510	C	93.2	Very high	91.2	Very high	59 Å²	59	62.2 Å²	62.2	40%	0.399	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.5	8.1	179.3	78	0	0	0	0	115	K512 H523 H527	C510-K512 PolarHBondContact O-N 3.05Å; C510-K512 VanDerWaalsContact SG-CG 3.54Å; C510-H523 PolarHBondContact SG-NE2 3.4Å; C510-H527 PolarHBondContact SG-NE2 2.87Å
511	G	92.2	Very high	91.4	Very high	51 Å²	51	66.6 Å²	66.6	53%	0.526	38%	0.382	S	S	.	.			trans	68.3	-2.2	179.6	0	0	0	0	0	116.2	C507 A513	C507-G511 VanDerWaalsContact O-CA 3.31Å; C507-G511 WeakPolarHBondContact O-CA 3.4Å; C507-G511 PolarHBondContact O-N 2.79Å; G511-A513 PolarHBondContact O-N 2.86Å
512	K	91.9	Very high	91.7	Very high	84 Å²	84	69.7 Å²	69.7	37%	0.365	39%	0.388	S	S	.	.			trans	-62.3	127.9	-179.2	-79.3	-174	178.6	-167.3	0	111	D183 I506 C507 C510 F514	D183-K512 HydrophobicContact CB-CD 4.49Å; D183-K512 PolarHBondContact O-NZ 2.99Å; I506-K512 CarbonylContact C-O 3.51Å; I506-K512 WeakPolarHBondContact CA-O 3.02Å; C507-K512 HydrophobicContact CB-CB 4.46Å; C507-K512 PolarHBondContact N-O 3.2Å; C510-K512 PolarHBondContact O-N 3.05Å; C510-K512 VanDerWaalsContact SG-CG 3.54Å; K512-F514 HydrophobicContact CB-CE2 3.75Å; K512-F514 HydrophobicContact CB-CZ 4.07Å; K512-F514 WeakPolarHBondContact O-CD2 3.47Å; K512-F514 WeakPolarHBondContact O-CE2 3.41Å
513	A	91.6	Very high	92	Very high	40 Å²	40	65.9 Å²	65.9	33%	0.331	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	130.7	-172.4	0	0	0	0	0	111.4	R503 I506 G511	R503-A513 HydrophobicContact CB-CB 3.81Å; R503-A513 WeakPolarHBondContact CD-O 3.28Å; R503-A513 WeakPolarHBondContact O-CB 3.48Å; I506-A513 HydrophobicContact CG1-CB 4.19Å; G511-A513 PolarHBondContact O-N 2.86Å
514	F	91.8	Very high	92.1	Very high	25 Å²	25	64.4 Å²	64.4	11%	0.11	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	148.9	-177.2	-60.8	-90.7	0	0	0	112.5	D183 R503 V504 H505 K512 K519 L520 H523	D183-F514 HydrophobicContact CB-CE1 4.01Å; D183-F514 HydrophobicContact CB-CZ 3.95Å; R503-F514 CarbonylContact C-O 3.12Å; R503-F514 VanDerWaalsContact CA-O 3.31Å; R503-F514 WeakPolarHBondContact CA-O 3.47Å; V504-F514 PolarHBondContact N-O 3.38Å; H505-F514 HydrophobicContact CB-CB 4.32Å; H505-F514 WeakPolarHBondContact CB-O 3.45Å; H505-F514 PolarHBondContact N-O 3.09Å; H505-F514 WeakPolarHBondContact O-CD2 3.4Å; H505-F514 PolarHBondContact O-N 2.85Å; K512-F514 HydrophobicContact CB-CE2 3.75Å; K512-F514 HydrophobicContact CB-CZ 4.07Å; K512-F514 WeakPolarHBondContact O-CD2 3.47Å; K512-F514 WeakPolarHBondContact O-CE2 3.41Å; F514-K519 HydrophobicContact CB-CB 4.1Å; F514-K519 HydrophobicContact CD1-CB 3.75Å; F514-K519 HydrophobicContact CG-CB 4.17Å; F514-L520 HydrophobicContact CB-CB 4.45Å; F514-L520 HydrophobicContact CD2-CB 4.09Å; F514-L520 HydrophobicContact CD2-CD1 4.13Å; F514-L520 HydrophobicContact CE2-CD1 4.31Å; F514-L520 HydrophobicContact CG-CB 4.46Å; F514-H523 HydrophobicContact CE1-CB 4.11Å; F514-H523 HydrophobicContact CE2-CB 3.84Å; F514-H523 AromaticContact CE2-CD2 3.38Å; F514-H523 WeakPolarHBondContact CE2-CD2 3.16Å; F514-H523 AromaticContact CE2-CG 3.58Å; F514-H523 HydrophobicContact CZ-CB 3.47Å; F514-H523 VanDerWaalsContact CZ-CB 3.47Å; F514-H523 AromaticContact CZ-CD2 3.62Å; F514-H523 AromaticContact CZ-CG 3.31Å; F514-H523 AromaticContact CZ-ND1 3.86Å
515	V	92.1	Very high	92.2	Very high	9 Å²	9	61.6 Å²	61.6	6%	0.055	34%	0.342	C	S	.	.	S	Bend	trans	-67.7	-41.6	175.4	174.9	0	0	0	0	112	H498 R503 H505	H498-V515 PolarHBondContact CE1-O 3.05Å; H498-V515 WeakPolarHBondContact O-CG1 3.45Å; R503-V515 HydrophobicContact CG-CG2 3.69Å; H505-V515 PolarHBondContact CD2-O 2.9Å
516	E	91.1	Very high	92.2	Very high	66 Å²	66	62 Å²	62	31%	0.308	35%	0.349	S	S	.	.	S	Bend	trans	-117.8	140.9	-174.6	-45.5	176.3	154.4	0	0	111.7	S518 K519 L520	E516-S518 WeakPolarHBondContact CB-OG 3.48Å; E516-S518 PolarHBondContact O-N 3.49Å; E516-S518 PolarHBondContact OE2-OG 2.9Å; E516-K519 HydrophobicContact CB-CG 3.91Å; E516-K519 HydrophobicContact CG-CG 4.27Å; E516-K519 WeakPolarHBondContact O-CB 3.46Å; E516-K519 PolarHBondContact O-N 3.38Å; E516-K519 WeakPolarHBondContact OE2-CE 3.25Å; E516-L520 PolarHBondContact O-N 3.09Å
517	S	92.6	Very high	92.1	Very high	62 Å²	62	59.8 Å²	59.8	43%	0.434	34%	0.336	S	S	.	.	H	α-helix	trans	-64.7	-23.4	176	56.2	0	0	0	0	113.9	H505 K521	H505-S517 PolarHBondContact CD2-N 3.38Å; H505-S517 PolarHBondContact NE2-N 3.48Å; S517-K521 WeakPolarHBondContact O-CB 3.42Å; S517-K521 WeakPolarHBondContact O-CG 3.28Å; S517-K521 PolarHBondContact O-N 3.2Å
518	S	92	Very high	91.9	Very high	63 Å²	63	63.6 Å²	63.6	44%	0.441	36%	0.359	S	S	.	.	H	α-helix	trans	-58.4	-43.7	168.1	43.1	0	0	0	0	112	E516 R522	E516-S518 WeakPolarHBondContact CB-OG 3.48Å; E516-S518 PolarHBondContact O-N 3.49Å; E516-S518 PolarHBondContact OE2-OG 2.9Å; S518-R522 WeakPolarHBondContact O-CB 3.44Å; S518-R522 PolarHBondContact O-N 3.18Å; S518-R522 VanDerWaalsContact O-N 3.07Å
519	K	91.8	Very high	91.8	Very high	70 Å²	70	61 Å²	61	30%	0.304	34%	0.342	S	S	.	.	H	α-helix	trans	-71.3	-43.8	-179.2	-52.9	-80.3	175.6	159.8	0	110.1	F514 E516 K521 R522 H523	F514-K519 HydrophobicContact CB-CB 4.1Å; F514-K519 HydrophobicContact CD1-CB 3.75Å; F514-K519 HydrophobicContact CG-CB 4.17Å; E516-K519 HydrophobicContact CB-CG 3.91Å; E516-K519 HydrophobicContact CG-CG 4.27Å; E516-K519 WeakPolarHBondContact O-CB 3.46Å; E516-K519 PolarHBondContact O-N 3.38Å; E516-K519 WeakPolarHBondContact OE2-CE 3.25Å; K519-K521 PolarHBondContact O-N 3.02Å; K519-R522 WeakPolarHBondContact O-CB 3.35Å; K519-R522 PolarHBondContact O-N 2.89Å; K519-H523 WeakPolarHBondContact O-CB 3.32Å; K519-H523 PolarHBondContact O-N 3.03Å
520	L	93.9	Very high	91.8	Very high	24 Å²	24	60.8 Å²	60.8	13%	0.126	34%	0.341	C	S	.	.	H	α-helix	trans	-57.5	-49.5	173.2	172.9	58.7	0	0	0	111.8	H505 C507 F514 E516 R522 H523 Q524	H505-L520 HydrophobicContact CB-CB 4.02Å; H505-L520 HydrophobicContact CB-CD2 3.88Å; C507-L520 HydrophobicContact CB-CD1 3.67Å; F514-L520 HydrophobicContact CB-CB 4.45Å; F514-L520 HydrophobicContact CD2-CB 4.09Å; F514-L520 HydrophobicContact CD2-CD1 4.13Å; F514-L520 HydrophobicContact CE2-CD1 4.31Å; F514-L520 HydrophobicContact CG-CB 4.46Å; E516-L520 PolarHBondContact O-N 3.09Å; L520-R522 VanDerWaalsContact C-N 3.26Å; L520-R522 PolarHBondContact O-N 3.31Å; L520-H523 WeakPolarHBondContact O-CB 3.49Å; L520-H523 PolarHBondContact O-N 3.18Å; L520-H523 VanDerWaalsContact O-N 3.11Å; L520-Q524 HydrophobicContact CD1-CG 4.32Å; L520-Q524 WeakPolarHBondContact O-CG 3.29Å; L520-Q524 PolarHBondContact O-N 3.05Å
521	K	92.4	Very high	91.8	Very high	150 Å²	150	61.6 Å²	61.6	65%	0.652	34%	0.338	S	S	*	.	H	α-helix	trans	-60.6	-35.1	177.2	-76.9	-176.7	175.5	-169.1	0	113.4	S517 K519	S517-K521 WeakPolarHBondContact O-CB 3.42Å; S517-K521 WeakPolarHBondContact O-CG 3.28Å; S517-K521 PolarHBondContact O-N 3.2Å; K519-K521 PolarHBondContact O-N 3.02Å
522	R	92.1	Very high	91.7	Very high	85 Å²	85	62.3 Å²	62.3	32%	0.321	33%	0.333	S	S	.	.	H	α-helix	trans	-69.5	-39.5	175.2	-169.1	-169	69.4	160.6	8.4	111.4	D183 S518 K519 L520 L525 L546	D183-R522 IonicContact OD1-NH2 2.86Å; D183-R522 PolarHBondContact OD1-NH2 3.07Å; S518-R522 WeakPolarHBondContact O-CB 3.44Å; S518-R522 PolarHBondContact O-N 3.18Å; S518-R522 VanDerWaalsContact O-N 3.07Å; K519-R522 WeakPolarHBondContact O-CB 3.35Å; K519-R522 PolarHBondContact O-N 2.89Å; L520-R522 VanDerWaalsContact C-N 3.26Å; L520-R522 PolarHBondContact O-N 3.31Å; R522-L525 WeakPolarHBondContact O-CB 3.29Å; R522-L525 WeakPolarHBondContact O-CG 3.42Å; R522-L525 PolarHBondContact O-N 2.86Å; R522-L546 HydrophobicContact CG-CD1 4.44Å; R522-L546 HydrophobicContact CG-CD2 3.4Å; R522-L546 VanDerWaalsContact CG-CD2 3.4Å
523	H	91.9	Very high	91.8	Very high	3 Å²	3	62.8 Å²	62.8	1%	0.014	33%	0.334	C	S	.	.	H	α-helix	trans	-65.5	-34.5	175.9	167.2	60.1	0	0	0	112.6	D183 C507 C510 F514 K519 L520 L525 V526 H527	D183-H523 WeakPolarHBondContact OD2-CA 3.44Å; D183-H523 WeakPolarHBondContact OD2-CB 3.3Å; D183-H523 IonicContact OD2-CG 3.42Å; D183-H523 IonicContact OD2-ND1 3.21Å; D183-H523 PolarHBondContact OD2-ND1 3.49Å; C507-H523 PolarHBondContact SG-NE2 2.8Å; C507-H523 VanDerWaalsContact SG-NE2 3.41Å; C510-H523 PolarHBondContact SG-NE2 3.4Å; F514-H523 HydrophobicContact CE1-CB 4.11Å; F514-H523 HydrophobicContact CE2-CB 3.84Å; F514-H523 AromaticContact CE2-CD2 3.38Å; F514-H523 WeakPolarHBondContact CE2-CD2 3.16Å; F514-H523 AromaticContact CE2-CG 3.58Å; F514-H523 HydrophobicContact CZ-CB 3.47Å; F514-H523 VanDerWaalsContact CZ-CB 3.47Å; F514-H523 AromaticContact CZ-CD2 3.62Å; F514-H523 AromaticContact CZ-CG 3.31Å; F514-H523 AromaticContact CZ-ND1 3.86Å; K519-H523 WeakPolarHBondContact O-CB 3.32Å; K519-H523 PolarHBondContact O-N 3.03Å; L520-H523 WeakPolarHBondContact O-CB 3.49Å; L520-H523 PolarHBondContact O-N 3.18Å; L520-H523 VanDerWaalsContact O-N 3.11Å; H523-L525 PolarHBondContact O-N 3.07Å; H523-V526 VanDerWaalsContact O-CB 3.28Å; H523-V526 WeakPolarHBondContact O-CB 3.44Å; H523-V526 WeakPolarHBondContact O-CG2 3.37Å; H523-V526 PolarHBondContact O-N 3.5Å; H523-H527 AromaticContact CE1-CD2 3.73Å; H523-H527 AromaticContact CE1-NE2 3.71Å; H523-H527 AromaticContact NE2-CD2 3.6Å; H523-H527 AromaticContact NE2-NE2 3.52Å
524	Q	91.1	Very high	91.8	Very high	74 Å²	74	64.2 Å²	64.2	35%	0.346	33%	0.333	S	S	.	.	H	α-helix	trans	-60.8	-14.7	174.3	-71	177.7	-66.2	0	0	114	L520 V526 H527 T528	L520-Q524 HydrophobicContact CD1-CG 4.32Å; L520-Q524 WeakPolarHBondContact O-CG 3.29Å; L520-Q524 PolarHBondContact O-N 3.05Å; Q524-V526 VanDerWaalsContact C-N 3.29Å; Q524-H527 PolarHBondContact O-N 3.41Å; Q524-T528 PolarHBondContact O-N 3.31Å; Q524-T528 PolarHBondContact O-OG1 3.32Å
525	L	92.1	Very high	92	Very high	34 Å²	34	63.2 Å²	63.2	18%	0.178	33%	0.329	C	S	.	.	H	α-helix	trans	-70.7	-24.4	170.7	-58.9	171.7	0	0	0	112.8	R522 H523 H527 T528 G529 E530 S545 L546	R522-L525 WeakPolarHBondContact O-CB 3.29Å; R522-L525 WeakPolarHBondContact O-CG 3.42Å; R522-L525 PolarHBondContact O-N 2.86Å; H523-L525 PolarHBondContact O-N 3.07Å; L525-H527 VanDerWaalsContact C-N 3.31Å; L525-T528 WeakPolarHBondContact CA-OG1 3.37Å; L525-G529 PolarHBondContact O-N 3.31Å; L525-E530 HydrophobicContact CD2-CB 3.85Å; L525-E530 PolarHBondContact O-N 2.68Å; L525-S545 WeakPolarHBondContact CD1-O 3.31Å; L525-L546 HydrophobicContact CD1-CD2 3.98Å
526	V	91.6	Very high	92	Very high	70 Å²	70	66 Å²	66	42%	0.424	35%	0.353	S	S	.	.	H	α-helix	trans	-69	-35	171.8	-175.4	0	0	0	0	110.4	H523 Q524	H523-V526 VanDerWaalsContact O-CB 3.28Å; H523-V526 WeakPolarHBondContact O-CB 3.44Å; H523-V526 WeakPolarHBondContact O-CG2 3.37Å; H523-V526 PolarHBondContact O-N 3.5Å; Q524-V526 VanDerWaalsContact C-N 3.29Å
527	H	91.1	Very high	91.9	Very high	61 Å²	61	68 Å²	68	28%	0.282	36%	0.361	S	S	.	.	H	α-helix	trans	-79	-51.5	-178	-84.7	-86.6	0	0	0	113.3	E509 C510 H523 Q524 L525 G529	E509-H527 WeakPolarHBondContact CB-CE1 3.45Å; E509-H527 WeakPolarHBondContact CB-ND1 3.33Å; E509-H527 IonicContact OE1-CG 3.89Å; E509-H527 IonicContact OE1-ND1 3.99Å; E509-H527 WeakPolarHBondContact OE2-CB 3.49Å; E509-H527 IonicContact OE2-CE1 2.89Å; E509-H527 IonicContact OE2-CG 3.34Å; E509-H527 IonicContact OE2-ND1 2.8Å; E509-H527 PolarHBondContact OE2-ND1 3.43Å; C510-H527 PolarHBondContact SG-NE2 2.87Å; H523-H527 AromaticContact CE1-CD2 3.73Å; H523-H527 AromaticContact CE1-NE2 3.71Å; H523-H527 AromaticContact NE2-CD2 3.6Å; H523-H527 AromaticContact NE2-NE2 3.52Å; Q524-H527 PolarHBondContact O-N 3.41Å; L525-H527 VanDerWaalsContact C-N 3.31Å; H527-G529 PolarHBondContact O-N 3.25Å
528	T	90.6	Very high	91.6	Very high	82 Å²	82	72.4 Å²	72.4	50%	0.503	38%	0.38	S	S	.	.	H	α-helix	trans	-69.5	-14.7	176.9	53.3	0	0	0	0	113.5	Q524 L525 E530	Q524-T528 PolarHBondContact O-N 3.31Å; Q524-T528 PolarHBondContact O-OG1 3.32Å; L525-T528 WeakPolarHBondContact CA-OG1 3.37Å; T528-E530 PolarHBondContact O-N 2.73Å; T528-E530 PolarHBondContact OG1-N 2.62Å
529	G	90.4	Very high	91.4	Very high	50 Å²	50	73.1 Å²	73.1	52%	0.515	40%	0.398	S	S	.	.			trans	65.6	9.3	-171.1	0	0	0	0	0	113.6	L525 H527 K531	L525-G529 PolarHBondContact O-N 3.31Å; H527-G529 PolarHBondContact O-N 3.25Å; G529-K531 PolarHBondContact O-N 2.79Å
530	E	90.2	Very high	91.5	Very high	114 Å²	114	70.8 Å²	70.8	53%	0.533	39%	0.39	S	S	.	.			trans	-63.7	125.9	-177	-82.8	-171.3	-167.5	0	0	111.3	L525 T528 P532	L525-E530 HydrophobicContact CD2-CB 3.85Å; L525-E530 PolarHBondContact O-N 2.68Å; T528-E530 PolarHBondContact O-N 2.73Å; T528-E530 PolarHBondContact OG1-N 2.62Å; E530-P532 WeakPolarHBondContact O-CD 3.49Å
531	K	92.7	Very high	91.2	Very high	76 Å²	76	71.3 Å²	71.3	33%	0.33	40%	0.401	S	S	.	.			trans	-121.7	81.5	175.4	-65.8	-170.4	175.9	-168.5	0	109.7	D180 G529 Y533 R543 F544	D180-K531 IonicContact OD1-NZ 3.06Å; D180-K531 WeakPolarHBondContact OD2-CE 3.33Å; D180-K531 IonicContact OD2-NZ 3.36Å; D180-K531 PolarHBondContact OD2-NZ 3Å; G529-K531 PolarHBondContact O-N 2.79Å; K531-Y533 VanDerWaalsContact C-N 3.34Å; K531-Y533 PolarHBondContact O-N 3.21Å; K531-R543 HydrophobicContact CB-CB 3.73Å; K531-R543 VanDerWaalsContact O-CZ 3.3Å; K531-R543 PolarHBondContact O-NE 3.26Å; K531-R543 PolarHBondContact O-NH2 2.84Å; K531-F544 CarbonylContact C-O 3.53Å; K531-F544 VanDerWaalsContact CA-O 3.27Å; K531-F544 WeakPolarHBondContact CA-O 3.08Å
532	P	91.2	Very high	91.2	Very high	66 Å²	66	68.6 Å²	68.6	43%	0.429	39%	0.389	S	S	.	.			trans	-67.3	-31.9	-172.6	-21.2	34.1	0	0	0	113.6	E530 R543 F544	E530-P532 WeakPolarHBondContact O-CD 3.49Å; P532-R543 PolarHBondContact O-NH2 3.3Å; P532-F544 WeakPolarHBondContact CD-O 3.49Å
533	Y	93.1	Very high	91.3	Very high	95 Å²	95	70 Å²	70	37%	0.373	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	116.8	-170.2	-55.2	-88.9	0	0	0	110	K531 R543 F544 S545 D547	K531-Y533 VanDerWaalsContact C-N 3.34Å; K531-Y533 PolarHBondContact O-N 3.21Å; Y533-R543 CarbonylContact O-C 3.58Å; Y533-R543 WeakPolarHBondContact O-CA 3.27Å; Y533-F544 PolarHBondContact N-O 3.22Å; Y533-F544 PolarHBondContact O-N 2.95Å; Y533-S545 WeakPolarHBondContact CD2-O 3.45Å; Y533-S545 WeakPolarHBondContact CE2-O 3.45Å; Y533-D547 HydrophobicContact CD1-CB 3.88Å; Y533-D547 HydrophobicContact CE1-CB 3.61Å
534	Q	92.5	Very high	91.4	Very high	69 Å²	69	71.5 Å²	71.5	32%	0.322	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	139.4	-177.8	-178.6	170.1	-6.1	0	0	111.2	A536 R543	Q534-A536 PolarHBondContact O-N 3.3Å; Q534-R543 HydrophobicContact CB-CG 4.22Å; Q534-R543 HydrophobicContact CG-CG 4.12Å
535	C	95.1	Very high	91.4	Very high	4 Å²	4	68.5 Å²	68.5	3%	0.027	39%	0.389	C	S	.	.			trans	-67.2	126.5	171.4	-167.3	0	0	0	0	110.9	F537 K542 F544 L550 H553 H557	C535-F537 VanDerWaalsContact C-N 3.35Å; C535-K542 VanDerWaalsContact CB-O 3.26Å; C535-K542 WeakPolarHBondContact CB-O 3.46Å; C535-K542 PolarHBondContact N-O 3.04Å; C535-F544 HydrophobicContact CB-CE2 4.48Å; C535-L550 HydrophobicContact CB-CD1 4.04Å; C535-H553 VanDerWaalsContact SG-CD2 3.59Å; C535-H553 PolarHBondContact SG-NE2 3.32Å; C535-H557 PolarHBondContact SG-NE2 2.96Å
536	A	91.6	Very high	91.5	Very high	67 Å²	67	68.3 Å²	68.3	55%	0.554	39%	0.387	S	S	*	.			trans	-86.8	-4.5	-178.7	0	0	0	0	0	113.9	Q534 F901	Q534-A536 PolarHBondContact O-N 3.3Å; A536-F901 HydrophobicContact CB-CE1 3.57Å; A536-F901 HydrophobicContact CB-CZ 3.56Å
537	F	89.9	Confident	91.5	Very high	109 Å²	109	67.7 Å²	67.7	48%	0.478	38%	0.382	S	S	.	.	S	Bend	trans	-73.8	132.9	178.4	-165.7	-92.5	0	0	0	110.1	C535 C540 H557	C535-F537 VanDerWaalsContact C-N 3.35Å; F537-C540 HydrophobicContact CB-CB 4.17Å; F537-C540 HydrophobicContact CD1-CB 4.34Å; F537-C540 VanDerWaalsContact O-CB 3.3Å; F537-C540 WeakPolarHBondContact O-CB 3.35Å; F537-C540 PolarHBondContact O-N 2.98Å; F537-C540 VanDerWaalsContact O-N 3.14Å; F537-H557 HydrophobicContact CB-CB 4.44Å; F537-H557 HydrophobicContact CD1-CB 4.43Å; F537-H557 AromaticContact CD1-CE1 3.99Å; F537-H557 AromaticContact CD1-CG 3.86Å; F537-H557 AromaticContact CD1-ND1 3.41Å; F537-H557 WeakPolarHBondContact CD1-ND1 3.29Å; F537-H557 HydrophobicContact CD2-CB 3.7Å; F537-H557 AromaticContact CD2-CG 3.9Å; F537-H557 AromaticContact CE1-ND1 3.79Å; F537-H557 HydrophobicContact CE2-CB 3.98Å; F537-H557 HydrophobicContact CG-CB 3.94Å; F537-H557 AromaticContact CG-CD2 3.98Å; F537-H557 AromaticContact CG-CG 3.58Å; F537-H557 AromaticContact CG-ND1 3.67Å; F537-H557 HydrophobicContact CZ-CB 4.47Å
538	D	87.4	Confident	91.5	Very high	154 Å²	154	69.9 Å²	69.9	82%	0.824	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	146.9	-175.7	-165.2	13.8	0	0	0	111.7	C540	D538-C540 PolarHBondContact O-N 3.13Å
539	G	87.8	Confident	91.6	Very high	79 Å²	79	67.1 Å²	67.1	81%	0.814	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.9	-11.5	-171	0	0	0	0	0	115.9
540	C	92.2	Very high	91.8	Very high	20 Å²	20	65.7 Å²	65.7	14%	0.135	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-58.8	-175.8	-172.8	0	0	0	0	113.3	F537 D538 K542 H553 H557	F537-C540 HydrophobicContact CB-CB 4.17Å; F537-C540 HydrophobicContact CD1-CB 4.34Å; F537-C540 VanDerWaalsContact O-CB 3.3Å; F537-C540 WeakPolarHBondContact O-CB 3.35Å; F537-C540 PolarHBondContact O-N 2.98Å; F537-C540 VanDerWaalsContact O-N 3.14Å; D538-C540 PolarHBondContact O-N 3.13Å; C540-K542 PolarHBondContact O-N 2.94Å; C540-H553 PolarHBondContact SG-NE2 2.65Å; C540-H553 VanDerWaalsContact SG-NE2 3.38Å; C540-H557 WeakPolarHBondContact CB-CE1 3.49Å; C540-H557 WeakPolarHBondContact CB-NE2 3.38Å; C540-H557 PolarHBondContact SG-CE1 3.21Å; C540-H557 PolarHBondContact SG-NE2 3.42Å
541	G	89.4	Confident	91.9	Very high	36 Å²	36	66.6 Å²	66.6	37%	0.371	35%	0.352	S	S	.	.			trans	61.5	-12.1	178.7	0	0	0	0	0	117.9	R543	G541-R543 PolarHBondContact O-N 3.36Å
542	K	92.1	Very high	91.9	Very high	93 Å²	93	64.5 Å²	64.5	40%	0.404	35%	0.346	S	S	.	.			trans	-53.1	131.6	-173.8	-68.6	175.7	-178.3	176.2	0	110.9	D172 C535 C540 F544	D172-K542 IonicContact OD1-NZ 2.65Å; D172-K542 PolarHBondContact OD1-NZ 3.49Å; D172-K542 IonicContact OD2-NZ 2.75Å; C535-K542 VanDerWaalsContact CB-O 3.26Å; C535-K542 WeakPolarHBondContact CB-O 3.46Å; C535-K542 PolarHBondContact N-O 3.04Å; C540-K542 PolarHBondContact O-N 2.94Å; K542-F544 HydrophobicContact CB-CE2 4.16Å; K542-F544 HydrophobicContact CB-CZ 4.12Å; K542-F544 WeakPolarHBondContact O-CE2 3.4Å
543	R	93.7	Very high	91.9	Very high	113 Å²	113	62.1 Å²	62.1	43%	0.426	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	150.4	-176.8	-57.3	-175	67.9	104.3	4.3	111.8	K531 P532 Y533 Q534 G541	K531-R543 HydrophobicContact CB-CB 3.73Å; K531-R543 VanDerWaalsContact O-CZ 3.3Å; K531-R543 PolarHBondContact O-NE 3.26Å; K531-R543 PolarHBondContact O-NH2 2.84Å; P532-R543 PolarHBondContact O-NH2 3.3Å; Y533-R543 CarbonylContact O-C 3.58Å; Y533-R543 WeakPolarHBondContact O-CA 3.27Å; Q534-R543 HydrophobicContact CB-CG 4.22Å; Q534-R543 HydrophobicContact CG-CG 4.12Å; G541-R543 PolarHBondContact O-N 3.36Å
544	F	93.5	Very high	91.9	Very high	35 Å²	35	60.1 Å²	60.1	15%	0.154	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	146.9	-175.5	-57.3	-84.8	0	0	0	111.4	K531 P532 Y533 C535 K542 L546 N549 L550 H553	K531-F544 CarbonylContact C-O 3.53Å; K531-F544 VanDerWaalsContact CA-O 3.27Å; K531-F544 WeakPolarHBondContact CA-O 3.08Å; P532-F544 WeakPolarHBondContact CD-O 3.49Å; Y533-F544 PolarHBondContact N-O 3.22Å; Y533-F544 PolarHBondContact O-N 2.95Å; C535-F544 HydrophobicContact CB-CE2 4.48Å; K542-F544 HydrophobicContact CB-CE2 4.16Å; K542-F544 HydrophobicContact CB-CZ 4.12Å; K542-F544 WeakPolarHBondContact O-CE2 3.4Å; F544-L546 VanDerWaalsContact C-N 3.32Å; F544-N549 HydrophobicContact CB-CB 4.21Å; F544-N549 HydrophobicContact CD1-CB 4.07Å; F544-N549 HydrophobicContact CG-CB 4.39Å; F544-L550 HydrophobicContact CB-CB 4.39Å; F544-L550 HydrophobicContact CD2-CB 3.94Å; F544-L550 HydrophobicContact CD2-CD1 3.93Å; F544-L550 HydrophobicContact CE2-CD1 4.08Å; F544-L550 HydrophobicContact CG-CB 4.32Å; F544-H553 HydrophobicContact CE1-CB 3.98Å; F544-H553 HydrophobicContact CE2-CB 3.95Å; F544-H553 AromaticContact CE2-CD2 3.35Å; F544-H553 WeakPolarHBondContact CE2-CD2 3.38Å; F544-H553 AromaticContact CE2-CG 3.67Å; F544-H553 HydrophobicContact CZ-CB 3.5Å; F544-H553 VanDerWaalsContact CZ-CB 3.5Å; F544-H553 AromaticContact CZ-CD2 3.43Å; F544-H553 VanDerWaalsContact CZ-CD2 3.43Å; F544-H553 WeakPolarHBondContact CZ-CD2 3.41Å; F544-H553 AromaticContact CZ-CG 3.26Å; F544-H553 AromaticContact CZ-ND1 3.8Å
545	S	92.2	Very high	91.8	Very high	12 Å²	12	59.2 Å²	59.2	8%	0.084	32%	0.318	C	S	.	.	S	Bend	trans	-68.1	-29.2	174.2	45.3	0	0	0	0	112.7	D180 L525 Y533	D180-S545 PolarHBondContact OD1-OG 3.18Å; L525-S545 WeakPolarHBondContact CD1-O 3.31Å; Y533-S545 WeakPolarHBondContact CD2-O 3.45Å; Y533-S545 WeakPolarHBondContact CE2-O 3.45Å
546	L	93	Very high	91.6	Very high	29 Å²	29	64.3 Å²	64.3	15%	0.152	34%	0.344	C	S	.	.	S	Bend	trans	-136	139.3	-168.3	-54.7	172.8	0	0	0	112.3	R522 L525 F544 F548 N549 L550	R522-L546 HydrophobicContact CG-CD1 4.44Å; R522-L546 HydrophobicContact CG-CD2 3.4Å; R522-L546 VanDerWaalsContact CG-CD2 3.4Å; L525-L546 HydrophobicContact CD1-CD2 3.98Å; F544-L546 VanDerWaalsContact C-N 3.32Å; L546-F548 VanDerWaalsContact C-N 3.34Å; L546-F548 HydrophobicContact CB-CD1 4.04Å; L546-F548 HydrophobicContact CB-CE1 3.77Å; L546-F548 HydrophobicContact CB-CZ 4.26Å; L546-F548 HydrophobicContact CD1-CE1 3.57Å; L546-F548 HydrophobicContact CD1-CZ 3.58Å; L546-F548 HydrophobicContact CG-CE1 4.21Å; L546-F548 PolarHBondContact O-N 2.88Å; L546-N549 HydrophobicContact CB-CB 4.44Å; L546-N549 WeakPolarHBondContact O-CB 3.42Å; L546-N549 PolarHBondContact O-N 3.09Å; L546-L550 PolarHBondContact O-N 2.95Å
547	D	92.7	Very high	91.6	Very high	57 Å²	57	64.1 Å²	64.1	31%	0.305	33%	0.331	S	S	.	.	H	α-helix	trans	-54.9	-45	-179.3	-177.4	62	0	0	0	112.8	Y533 N549 L550 R551	Y533-D547 HydrophobicContact CD1-CB 3.88Å; Y533-D547 HydrophobicContact CE1-CB 3.61Å; D547-N549 VanDerWaalsContact C-N 3.26Å; D547-N549 PolarHBondContact O-N 3.33Å; D547-L550 WeakPolarHBondContact O-CB 3.36Å; D547-L550 PolarHBondContact O-N 3.36Å; D547-L550 VanDerWaalsContact O-N 3.11Å; D547-R551 PolarHBondContact O-N 2.87Å; D547-R551 IonicContact OD2-CZ 3.89Å; D547-R551 IonicContact OD2-NE 4Å; D547-R551 PolarHBondContact OD2-NE 3.31Å; D547-R551 IonicContact OD2-NH2 2.62Å; D547-R551 PolarHBondContact OD2-NH2 2.76Å
548	F	90.5	Very high	91.5	Very high	108 Å²	108	64 Å²	64	47%	0.474	34%	0.339	S	S	.	.	H	α-helix	trans	-65.4	-30.7	-179.9	71.7	-96.3	0	0	0	112.3	L546 R551 T552	L546-F548 VanDerWaalsContact C-N 3.34Å; L546-F548 HydrophobicContact CB-CD1 4.04Å; L546-F548 HydrophobicContact CB-CE1 3.77Å; L546-F548 HydrophobicContact CB-CZ 4.26Å; L546-F548 HydrophobicContact CD1-CE1 3.57Å; L546-F548 HydrophobicContact CD1-CZ 3.58Å; L546-F548 HydrophobicContact CG-CE1 4.21Å; L546-F548 PolarHBondContact O-N 2.88Å; F548-R551 PolarHBondContact O-N 2.88Å; F548-T552 VanDerWaalsContact O-CG2 3.29Å; F548-T552 WeakPolarHBondContact O-CG2 3.45Å; F548-T552 PolarHBondContact O-N 3.48Å; F548-T552 PolarHBondContact O-OG1 3.09Å
549	N	93	Very high	91.6	Very high	24 Å²	24	58.9 Å²	58.9	13%	0.128	32%	0.323	C	S	.	.	H	α-helix	trans	-66.1	-43.2	173.3	-79.3	-8.3	0	0	0	110.4	F544 L546 D547 R551 T552 H553	F544-N549 HydrophobicContact CB-CB 4.21Å; F544-N549 HydrophobicContact CD1-CB 4.07Å; F544-N549 HydrophobicContact CG-CB 4.39Å; L546-N549 HydrophobicContact CB-CB 4.44Å; L546-N549 WeakPolarHBondContact O-CB 3.42Å; L546-N549 PolarHBondContact O-N 3.09Å; D547-N549 VanDerWaalsContact C-N 3.26Å; D547-N549 PolarHBondContact O-N 3.33Å; N549-R551 PolarHBondContact O-N 3.11Å; N549-T552 PolarHBondContact O-N 3.43Å; N549-T552 PolarHBondContact O-OG1 3.21Å; N549-H553 WeakPolarHBondContact O-CB 3.26Å; N549-H553 PolarHBondContact O-N 3.04Å
550	L	94.4	Very high	91.7	Very high	20 Å²	20	58.3 Å²	58.3	11%	0.105	30%	0.301	C	S	.	.	H	α-helix	trans	-58.4	-46.9	170.7	172.5	59.5	0	0	0	111.4	C535 F544 L546 D547 T552 H553 L554	C535-L550 HydrophobicContact CB-CD1 4.04Å; F544-L550 HydrophobicContact CB-CB 4.39Å; F544-L550 HydrophobicContact CD2-CB 3.94Å; F544-L550 HydrophobicContact CD2-CD1 3.93Å; F544-L550 HydrophobicContact CE2-CD1 4.08Å; F544-L550 HydrophobicContact CG-CB 4.32Å; L546-L550 PolarHBondContact O-N 2.95Å; D547-L550 WeakPolarHBondContact O-CB 3.36Å; D547-L550 PolarHBondContact O-N 3.36Å; D547-L550 VanDerWaalsContact O-N 3.11Å; L550-T552 VanDerWaalsContact C-N 3.34Å; L550-T552 PolarHBondContact O-N 3.41Å; L550-H553 WeakPolarHBondContact O-CB 3.49Å; L550-H553 PolarHBondContact O-N 3.06Å; L550-H553 VanDerWaalsContact O-N 3.12Å; L550-L554 HydrophobicContact CD1-CD1 4.19Å; L550-L554 HydrophobicContact CD1-CD2 4.34Å; L550-L554 HydrophobicContact CD1-CG 3.96Å; L550-L554 HydrophobicContact CG-CD1 4.13Å; L550-L554 HydrophobicContact CG-CG 4.37Å; L550-L554 WeakPolarHBondContact O-CG 3.36Å; L550-L554 PolarHBondContact O-N 2.75Å
551	R	92	Very high	91.6	Very high	132 Å²	132	62.2 Å²	62.2	50%	0.498	31%	0.314	S	S	.	.	H	α-helix	trans	-59.5	-41	175.7	-65.6	-174.6	-166	-117.3	-5.3	112.8	D547 F548 N549 H553 L554	D547-R551 PolarHBondContact O-N 2.87Å; D547-R551 IonicContact OD2-CZ 3.89Å; D547-R551 IonicContact OD2-NE 4Å; D547-R551 PolarHBondContact OD2-NE 3.31Å; D547-R551 IonicContact OD2-NH2 2.62Å; D547-R551 PolarHBondContact OD2-NH2 2.76Å; F548-R551 PolarHBondContact O-N 2.88Å; N549-R551 PolarHBondContact O-N 3.11Å; R551-H553 VanDerWaalsContact C-N 3.31Å; R551-H553 PolarHBondContact O-N 3.49Å; R551-L554 PolarHBondContact O-N 3.2Å
552	T	92.1	Very high	91.7	Very high	33 Å²	33	62.8 Å²	62.8	20%	0.202	31%	0.311	C	S	.	.	H	α-helix	trans	-69	-29.8	176.3	65.5	0	0	0	0	113.2	F548 N549 L550	F548-T552 VanDerWaalsContact O-CG2 3.29Å; F548-T552 WeakPolarHBondContact O-CG2 3.45Å; F548-T552 PolarHBondContact O-N 3.48Å; F548-T552 PolarHBondContact O-OG1 3.09Å; N549-T552 PolarHBondContact O-N 3.43Å; N549-T552 PolarHBondContact O-OG1 3.21Å; L550-T552 VanDerWaalsContact C-N 3.34Å; L550-T552 PolarHBondContact O-N 3.41Å
553	H	92.5	Very high	91.7	Very high	15 Å²	15	61.6 Å²	61.6	7%	0.069	30%	0.304	C	S	.	.	H	α-helix	trans	-74.4	-39.6	174.7	166.3	66.2	0	0	0	112.5	C535 C540 F544 N549 L550 R551 R555 I556 H557	C535-H553 VanDerWaalsContact SG-CD2 3.59Å; C535-H553 PolarHBondContact SG-NE2 3.32Å; C540-H553 PolarHBondContact SG-NE2 2.65Å; C540-H553 VanDerWaalsContact SG-NE2 3.38Å; F544-H553 HydrophobicContact CE1-CB 3.98Å; F544-H553 HydrophobicContact CE2-CB 3.95Å; F544-H553 AromaticContact CE2-CD2 3.35Å; F544-H553 WeakPolarHBondContact CE2-CD2 3.38Å; F544-H553 AromaticContact CE2-CG 3.67Å; F544-H553 HydrophobicContact CZ-CB 3.5Å; F544-H553 VanDerWaalsContact CZ-CB 3.5Å; F544-H553 AromaticContact CZ-CD2 3.43Å; F544-H553 VanDerWaalsContact CZ-CD2 3.43Å; F544-H553 WeakPolarHBondContact CZ-CD2 3.41Å; F544-H553 AromaticContact CZ-CG 3.26Å; F544-H553 AromaticContact CZ-ND1 3.8Å; N549-H553 WeakPolarHBondContact O-CB 3.26Å; N549-H553 PolarHBondContact O-N 3.04Å; L550-H553 WeakPolarHBondContact O-CB 3.49Å; L550-H553 PolarHBondContact O-N 3.06Å; L550-H553 VanDerWaalsContact O-N 3.12Å; R551-H553 VanDerWaalsContact C-N 3.31Å; R551-H553 PolarHBondContact O-N 3.49Å; H553-R555 PolarHBondContact O-N 2.77Å; H553-R555 VanDerWaalsContact O-N 3.11Å; H553-I556 VanDerWaalsContact O-CB 3.26Å; H553-I556 WeakPolarHBondContact O-CB 3.41Å; H553-I556 WeakPolarHBondContact O-CG1 3.29Å; H553-I556 PolarHBondContact O-N 3.12Å; H553-H557 AromaticContact CD2-NE2 3.33Å; H553-H557 PolarHBondContact CD2-NE2 2.85Å; H553-H557 VanDerWaalsContact CD2-NE2 3.33Å; H553-H557 AromaticContact CE1-NE2 2.66Å; H553-H557 PolarHBondContact CE1-NE2 3.32Å; H553-H557 AromaticContact ND1-NE2 3.81Å; H553-H557 AromaticContact NE2-CD2 3.69Å; H553-H557 AromaticContact NE2-NE2 2.2Å; H553-H557 PolarHBondContact NE2-NE2 3.02Å
554	L	91.8	Very high	91.6	Very high	53 Å²	53	59.6 Å²	59.6	28%	0.277	31%	0.305	S	S	.	.	H	α-helix	trans	-57.5	-27.9	178.9	-74.9	169.7	0	0	0	112.9	L550 R551 I556 H557 T558	L550-L554 HydrophobicContact CD1-CD1 4.19Å; L550-L554 HydrophobicContact CD1-CD2 4.34Å; L550-L554 HydrophobicContact CD1-CG 3.96Å; L550-L554 HydrophobicContact CG-CD1 4.13Å; L550-L554 HydrophobicContact CG-CG 4.37Å; L550-L554 WeakPolarHBondContact O-CG 3.36Å; L550-L554 PolarHBondContact O-N 2.75Å; R551-L554 PolarHBondContact O-N 3.2Å; L554-I556 PolarHBondContact O-N 3.36Å; L554-H557 PolarHBondContact O-N 2.8Å; L554-T558 PolarHBondContact O-N 3.37Å; L554-T558 VanDerWaalsContact O-N 3.08Å
555	R	91.9	Very high	91.7	Very high	51 Å²	51	58.6 Å²	58.6	19%	0.192	30%	0.303	C	S	.	.	H	α-helix	trans	-63.7	-19	172.9	-69.3	-168.9	-67.5	-146.3	-3.4	114.8	H553 T558 G559 D560 A575	H553-R555 PolarHBondContact O-N 2.77Å; H553-R555 VanDerWaalsContact O-N 3.11Å; R555-T558 WeakPolarHBondContact CA-OG1 3.47Å; R555-G559 CarbonylContact O-C 3.35Å; R555-G559 PolarHBondContact O-N 3.16Å; R555-D560 HydrophobicContact CB-CB 4.2Å; R555-D560 WeakPolarHBondContact CD-OD2 3.26Å; R555-D560 HydrophobicContact CG-CB 4.05Å; R555-D560 PolarHBondContact O-N 2.86Å; R555-A575 HydrophobicContact CB-CB 4.42Å; R555-A575 PolarHBondContact NE-O 3.31Å; R555-A575 PolarHBondContact NH2-O 2.94Å
556	I	90.9	Very high	91.6	Very high	111 Å²	111	60.8 Å²	60.8	57%	0.569	32%	0.317	S	S	*	.	H	α-helix	trans	-69.3	-43.5	171.2	-57.1	175.1	0	0	0	109.3	H553 L554 G559	H553-I556 VanDerWaalsContact O-CB 3.26Å; H553-I556 WeakPolarHBondContact O-CB 3.41Å; H553-I556 WeakPolarHBondContact O-CG1 3.29Å; H553-I556 PolarHBondContact O-N 3.12Å; L554-I556 PolarHBondContact O-N 3.36Å; I556-G559 PolarHBondContact O-N 3.22Å
557	H	90.4	Very high	91.3	Very high	63 Å²	63	61.7 Å²	61.7	29%	0.292	32%	0.32	S	S	.	.	H	α-helix	trans	-72.7	-34.2	179.5	-62.2	-56.3	0	0	0	113.6	C535 F537 C540 H553 L554 G559	C535-H557 PolarHBondContact SG-NE2 2.96Å; F537-H557 HydrophobicContact CB-CB 4.44Å; F537-H557 HydrophobicContact CD1-CB 4.43Å; F537-H557 AromaticContact CD1-CE1 3.99Å; F537-H557 AromaticContact CD1-CG 3.86Å; F537-H557 AromaticContact CD1-ND1 3.41Å; F537-H557 WeakPolarHBondContact CD1-ND1 3.29Å; F537-H557 HydrophobicContact CD2-CB 3.7Å; F537-H557 AromaticContact CD2-CG 3.9Å; F537-H557 AromaticContact CE1-ND1 3.79Å; F537-H557 HydrophobicContact CE2-CB 3.98Å; F537-H557 HydrophobicContact CG-CB 3.94Å; F537-H557 AromaticContact CG-CD2 3.98Å; F537-H557 AromaticContact CG-CG 3.58Å; F537-H557 AromaticContact CG-ND1 3.67Å; F537-H557 HydrophobicContact CZ-CB 4.47Å; C540-H557 WeakPolarHBondContact CB-CE1 3.49Å; C540-H557 WeakPolarHBondContact CB-NE2 3.38Å; C540-H557 PolarHBondContact SG-CE1 3.21Å; C540-H557 PolarHBondContact SG-NE2 3.42Å; H553-H557 AromaticContact CD2-NE2 3.33Å; H553-H557 PolarHBondContact CD2-NE2 2.85Å; H553-H557 VanDerWaalsContact CD2-NE2 3.33Å; H553-H557 AromaticContact CE1-NE2 2.66Å; H553-H557 PolarHBondContact CE1-NE2 3.32Å; H553-H557 AromaticContact ND1-NE2 3.81Å; H553-H557 AromaticContact NE2-CD2 3.69Å; H553-H557 AromaticContact NE2-NE2 2.2Å; H553-H557 PolarHBondContact NE2-NE2 3.02Å; L554-H557 PolarHBondContact O-N 2.8Å; H557-G559 VanDerWaalsContact C-N 3.29Å
558	T	88.8	Confident	91	Very high	105 Å²	105	64.1 Å²	64.1	64%	0.644	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-7.1	174.6	65.3	0	0	0	0	113.5	L554 R555 D560	L554-T558 PolarHBondContact O-N 3.37Å; L554-T558 VanDerWaalsContact O-N 3.08Å; R555-T558 WeakPolarHBondContact CA-OG1 3.47Å; T558-D560 PolarHBondContact O-N 3.21Å; T558-D560 WeakPolarHBondContact OG1-CB 3.35Å; T558-D560 PolarHBondContact OG1-N 3.47Å
559	G	88.6	Confident	90.8	Very high	48 Å²	48	63.1 Å²	63.1	50%	0.495	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.4	10.6	-171	0	0	0	0	0	114.6	R555 I556 H557 R561	R555-G559 CarbonylContact O-C 3.35Å; R555-G559 PolarHBondContact O-N 3.16Å; I556-G559 PolarHBondContact O-N 3.22Å; H557-G559 VanDerWaalsContact C-N 3.29Å; G559-R561 PolarHBondContact O-N 3.5Å
560	D	89.8	Confident	90.6	Very high	66 Å²	66	63.1 Å²	63.1	35%	0.353	36%	0.361	S	S	.	.			trans	-68.2	119.8	-175.4	175	36.5	0	0	0	111.8	R555 T558 P562	R555-D560 HydrophobicContact CB-CB 4.2Å; R555-D560 WeakPolarHBondContact CD-OD2 3.26Å; R555-D560 HydrophobicContact CG-CB 4.05Å; R555-D560 PolarHBondContact O-N 2.86Å; T558-D560 PolarHBondContact O-N 3.21Å; T558-D560 WeakPolarHBondContact OG1-CB 3.35Å; T558-D560 PolarHBondContact OG1-N 3.47Å; D560-P562 WeakPolarHBondContact O-CD 3.43Å; D560-P562 WeakPolarHBondContact OD1-CD 3.37Å; D560-P562 WeakPolarHBondContact OD2-CD 3.43Å
561	R	90.8	Very high	90.4	Very high	103 Å²	103	68 Å²	68	39%	0.389	40%	0.397	S	S	.	.			trans	-122	76.8	176.6	-61.8	-175.6	-173.2	-154.6	4.8	108.7	D168 G559 Y563 R573 F574	D168-R561 IonicContact OD1-NH2 2.72Å; D168-R561 IonicContact OD2-CZ 3.94Å; D168-R561 VanDerWaalsContact OD2-CZ 3.22Å; D168-R561 IonicContact OD2-NH1 3.65Å; D168-R561 PolarHBondContact OD2-NH1 3.12Å; D168-R561 IonicContact OD2-NH2 3.92Å; D168-R561 PolarHBondContact OD2-NH2 3.39Å; G559-R561 PolarHBondContact O-N 3.5Å; R561-Y563 PolarHBondContact O-N 3.31Å; R561-R573 HydrophobicContact CB-CB 3.66Å; R561-R573 WeakPolarHBondContact CD-O 3.26Å; R561-R573 PolarHBondContact O-NE 3.31Å; R561-R573 PolarHBondContact O-NH2 2.87Å; R561-F574 CarbonylContact C-O 3.2Å; R561-F574 WeakPolarHBondContact CA-O 3.46Å
562	P	90.5	Very high	90.3	Very high	48 Å²	48	67.8 Å²	67.8	31%	0.312	40%	0.4	S	S	.	.			trans	-79.1	-7.6	-170.6	32.5	-34.1	0	0	0	112.8	D560 P564 F574	D560-P562 WeakPolarHBondContact O-CD 3.43Å; D560-P562 WeakPolarHBondContact OD1-CD 3.37Å; D560-P562 WeakPolarHBondContact OD2-CD 3.43Å; P562-P564 WeakPolarHBondContact O-CD 3.29Å; P562-F574 WeakPolarHBondContact CD-O 3.38Å
563	Y	93	Very high	90.4	Very high	68 Å²	68	72.6 Å²	72.6	27%	0.267	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	88.7	179	-55.1	-68.9	0	0	0	110.7	R561 R573 F574	R561-Y563 PolarHBondContact O-N 3.31Å; Y563-R573 WeakPolarHBondContact O-CA 3.41Å; Y563-F574 WeakPolarHBondContact CB-O 3.29Å; Y563-F574 WeakPolarHBondContact CD2-O 3.3Å; Y563-F574 PolarHBondContact N-O 3.49Å; Y563-F574 PolarHBondContact O-N 2.78Å
564	P	91.6	Very high	90.3	Very high	70 Å²	70	73.7 Å²	73.7	46%	0.455	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	154.9	171.7	31.8	-36.3	0	0	0	111.4	P562 P566 R573	P562-P564 WeakPolarHBondContact O-CD 3.29Å; P564-P566 WeakPolarHBondContact O-CD 3.37Å; P564-R573 HydrophobicContact CB-CG 4.24Å
565	C	94.8	Very high	90.3	Very high	14 Å²	14	72.2 Å²	72.2	10%	0.095	41%	0.414	C	S	.	.			trans	-73.9	126	167.5	-168.3	0	0	0	0	110.1	Q567 C570 K572 L580 H583 H587	C565-Q567 VanDerWaalsContact C-N 3.32Å; C565-C570 HydrophobicContact CB-CB 4.29Å; C565-K572 VanDerWaalsContact CB-O 3.28Å; C565-K572 WeakPolarHBondContact CB-O 3.4Å; C565-K572 PolarHBondContact N-O 2.2Å; C565-L580 HydrophobicContact CB-CD1 4.38Å; C565-H583 VanDerWaalsContact SG-CD2 3.58Å; C565-H583 PolarHBondContact SG-NE2 3.5Å; C565-H583 VanDerWaalsContact SG-NE2 3.4Å; C565-H587 PolarHBondContact SG-NE2 2.72Å; C565-H587 VanDerWaalsContact SG-NE2 3.4Å
566	P	90.6	Very high	90.3	Very high	59 Å²	59	71.8 Å²	71.8	38%	0.383	41%	0.414	S	S	.	.			trans	-82.5	-4.3	178.6	33	-36.8	0	0	0	114.1	I197 P564 P568 L584	I197-P566 HydrophobicContact CD1-CB 4.16Å; I197-P566 HydrophobicContact CD1-CG 3.63Å; I197-P566 HydrophobicContact CG2-CB 3.99Å; P564-P566 WeakPolarHBondContact O-CD 3.37Å; P566-P568 WeakPolarHBondContact O-CD 3.08Å; P566-L584 HydrophobicContact CG-CD2 3.93Å
567	Q	86.9	Confident	90.3	Very high	47 Å²	47	68.6 Å²	68.6	22%	0.22	40%	0.402	C	S	.	.	S	Bend	trans	-77.1	121.7	179	176.1	62.8	46	0	0	109.5	C565 C570 H587 R591	C565-Q567 VanDerWaalsContact C-N 3.32Å; Q567-C570 HydrophobicContact CB-CB 4.46Å; Q567-C570 WeakPolarHBondContact O-CB 3.47Å; Q567-C570 PolarHBondContact O-N 3.38Å; Q567-C570 VanDerWaalsContact O-N 3.09Å; Q567-H587 HydrophobicContact CG-CB 4.28Å; Q567-R591 VanDerWaalsContact OE1-NH2 3.13Å
568	P	86.1	Confident	90.3	Very high	108 Å²	108	69.1 Å²	69.1	70%	0.701	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	141.9	177.5	23.1	-34.2	0	0	0	111.1	P566 C570	P566-P568 WeakPolarHBondContact O-CD 3.08Å; P568-C570 VanDerWaalsContact C-N 3.33Å
569	G	85.6	Confident	90.5	Very high	88 Å²	88	67.6 Å²	67.6	91%	0.907	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.1	-3.2	-171.6	0	0	0	0	0	115.1
570	C	89.9	Confident	90.7	Very high	23 Å²	23	66.4 Å²	66.4	16%	0.155	38%	0.38	C	S	.	.			trans	-115.2	93.3	-178.7	-160.3	0	0	0	0	113.9	C565 Q567 P568 K572 H583 H587	C565-C570 HydrophobicContact CB-CB 4.29Å; Q567-C570 HydrophobicContact CB-CB 4.46Å; Q567-C570 WeakPolarHBondContact O-CB 3.47Å; Q567-C570 PolarHBondContact O-N 3.38Å; Q567-C570 VanDerWaalsContact O-N 3.09Å; P568-C570 VanDerWaalsContact C-N 3.33Å; C570-K572 PolarHBondContact O-N 3.02Å; C570-H583 PolarHBondContact SG-NE2 2.66Å; C570-H587 PolarHBondContact SG-CE1 3.33Å; C570-H587 PolarHBondContact SG-NE2 2.92Å; C570-H587 VanDerWaalsContact SG-NE2 3.36Å
571	S	89	Confident	90.8	Very high	122 Å²	122	68.1 Å²	68.1	85%	0.853	38%	0.384	S	S	*	.			trans	-70.4	10.1	-179.6	-45.9	0	0	0	0	115.7
572	K	90.9	Very high	90.8	Very high	129 Å²	129	66.8 Å²	66.8	56%	0.561	39%	0.39	S	S	*	.			trans	-75.3	135.4	-174.1	-66.9	-171.9	176.5	-172.3	0	111.4	C565 C570 F574	C565-K572 VanDerWaalsContact CB-O 3.28Å; C565-K572 WeakPolarHBondContact CB-O 3.4Å; C565-K572 PolarHBondContact N-O 2.2Å; C570-K572 PolarHBondContact O-N 3.02Å; K572-F574 HydrophobicContact CB-CE2 3.89Å; K572-F574 HydrophobicContact CB-CZ 3.87Å
573	R	93.5	Very high	90.8	Very high	133 Å²	133	65.3 Å²	65.3	50%	0.502	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	148.7	175.9	-56.7	-177.5	62	139.7	-2.3	110.3	R561 Y563 P564	R561-R573 HydrophobicContact CB-CB 3.66Å; R561-R573 WeakPolarHBondContact CD-O 3.26Å; R561-R573 PolarHBondContact O-NE 3.31Å; R561-R573 PolarHBondContact O-NH2 2.87Å; Y563-R573 WeakPolarHBondContact O-CA 3.41Å; P564-R573 HydrophobicContact CB-CG 4.24Å
574	F	91.6	Very high	90.7	Very high	38 Å²	38	64 Å²	64	17%	0.167	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	145	-174.1	-57.4	-87.8	0	0	0	112.1	R561 P562 Y563 K572 Q576 N579 L580 H583	R561-F574 CarbonylContact C-O 3.2Å; R561-F574 WeakPolarHBondContact CA-O 3.46Å; P562-F574 WeakPolarHBondContact CD-O 3.38Å; Y563-F574 WeakPolarHBondContact CB-O 3.29Å; Y563-F574 WeakPolarHBondContact CD2-O 3.3Å; Y563-F574 PolarHBondContact N-O 3.49Å; Y563-F574 PolarHBondContact O-N 2.78Å; K572-F574 HydrophobicContact CB-CE2 3.89Å; K572-F574 HydrophobicContact CB-CZ 3.87Å; F574-Q576 VanDerWaalsContact C-N 3.3Å; F574-N579 HydrophobicContact CB-CB 4.29Å; F574-N579 HydrophobicContact CD1-CB 3.77Å; F574-N579 HydrophobicContact CG-CB 4.28Å; F574-L580 HydrophobicContact CB-CB 4.44Å; F574-L580 HydrophobicContact CD2-CB 4.03Å; F574-L580 HydrophobicContact CD2-CD1 3.99Å; F574-L580 HydrophobicContact CE2-CD1 4.19Å; F574-L580 HydrophobicContact CG-CB 4.37Å; F574-H583 HydrophobicContact CE1-CB 4.07Å; F574-H583 HydrophobicContact CE2-CB 3.96Å; F574-H583 AromaticContact CE2-CD2 3.33Å; F574-H583 WeakPolarHBondContact CE2-CD2 3.46Å; F574-H583 AromaticContact CE2-CG 3.82Å; F574-H583 HydrophobicContact CZ-CB 3.5Å; F574-H583 AromaticContact CZ-CD2 3.35Å; F574-H583 WeakPolarHBondContact CZ-CD2 3.5Å; F574-H583 AromaticContact CZ-CG 3.4Å; F574-H583 VanDerWaalsContact CZ-CG 3.4Å
575	A	91.2	Very high	90.6	Very high	23 Å²	23	62.8 Å²	62.8	19%	0.19	37%	0.373	C	S	.	.	S	Bend	trans	-75.9	-15.3	172.1	0	0	0	0	0	113.1	R555	R555-A575 HydrophobicContact CB-CB 4.42Å; R555-A575 PolarHBondContact NE-O 3.31Å; R555-A575 PolarHBondContact NH2-O 2.94Å
576	Q	91.5	Very high	90.4	Very high	41 Å²	41	65 Å²	65	19%	0.192	39%	0.386	C	S	.	.	S	Bend	trans	-136.8	143.7	-179.8	-58.7	-170.6	6.1	0	0	112.5	F574 T578 N579 L580	F574-Q576 VanDerWaalsContact C-N 3.3Å; Q576-T578 VanDerWaalsContact C-N 3.3Å; Q576-T578 WeakPolarHBondContact CB-OG1 3.35Å; Q576-T578 PolarHBondContact O-N 2.96Å; Q576-T578 PolarHBondContact OE1-OG1 3.25Å; Q576-N579 PolarHBondContact O-N 2.88Å; Q576-L580 PolarHBondContact O-N 3.47Å; Q576-L580 VanDerWaalsContact O-N 3.16Å
577	S	91.1	Very high	90.2	Very high	44 Å²	44	63.6 Å²	63.6	31%	0.308	37%	0.374	S	S	.	.	H	α-helix	trans	-71.1	-23.8	-179.9	54.5	0	0	0	0	113.4	K581	S577-K581 WeakPolarHBondContact O-CB 3.44Å; S577-K581 VanDerWaalsContact O-CG 3.29Å; S577-K581 WeakPolarHBondContact O-CG 3.28Å; S577-K581 PolarHBondContact O-N 3.21Å
578	T	90.3	Very high	89.8	Confident	74 Å²	74	65 Å²	65	45%	0.454	39%	0.389	S	S	.	.	H	α-helix	trans	-59.2	-50	167.8	37	0	0	0	0	111	Q576 L580 K581 S582	Q576-T578 VanDerWaalsContact C-N 3.3Å; Q576-T578 WeakPolarHBondContact CB-OG1 3.35Å; Q576-T578 PolarHBondContact O-N 2.96Å; Q576-T578 PolarHBondContact OE1-OG1 3.25Å; T578-L580 PolarHBondContact O-N 3.45Å; T578-K581 WeakPolarHBondContact O-CB 3.35Å; T578-K581 PolarHBondContact O-N 3.2Å; T578-K581 VanDerWaalsContact O-N 3.08Å; T578-S582 PolarHBondContact O-N 3.28Å; T578-S582 PolarHBondContact O-OG 3.14Å
579	N	93	Very high	88.8	Confident	73 Å²	73	67.5 Å²	67.5	39%	0.39	39%	0.389	S	S	.	.	H	α-helix	trans	-69.3	-34	-179.6	-61.3	20.5	0	0	0	111.6	F574 Q576 S582 H583	F574-N579 HydrophobicContact CB-CB 4.29Å; F574-N579 HydrophobicContact CD1-CB 3.77Å; F574-N579 HydrophobicContact CG-CB 4.28Å; Q576-N579 PolarHBondContact O-N 2.88Å; N579-S582 PolarHBondContact O-OG 3.27Å; N579-S582 VanDerWaalsContact O-OG 3.12Å; N579-H583 VanDerWaalsContact O-CB 3.28Å; N579-H583 WeakPolarHBondContact O-CB 3.42Å; N579-H583 PolarHBondContact O-N 3.14Å
580	L	93.3	Very high	87.6	Confident	24 Å²	24	67.4 Å²	67.4	13%	0.126	37%	0.367	C	S	.	.	H	α-helix	trans	-63	-42.4	168	175.3	60.7	0	0	0	111.6	C565 F574 Q576 T578 H583 L584	C565-L580 HydrophobicContact CB-CD1 4.38Å; F574-L580 HydrophobicContact CB-CB 4.44Å; F574-L580 HydrophobicContact CD2-CB 4.03Å; F574-L580 HydrophobicContact CD2-CD1 3.99Å; F574-L580 HydrophobicContact CE2-CD1 4.19Å; F574-L580 HydrophobicContact CG-CB 4.37Å; Q576-L580 PolarHBondContact O-N 3.47Å; Q576-L580 VanDerWaalsContact O-N 3.16Å; T578-L580 PolarHBondContact O-N 3.45Å; L580-H583 PolarHBondContact O-N 3.27Å; L580-L584 HydrophobicContact CD1-CD1 4.16Å; L580-L584 HydrophobicContact CD1-CG 4.06Å; L580-L584 HydrophobicContact CG-CD1 4.03Å; L580-L584 HydrophobicContact CG-CG 4.39Å; L580-L584 WeakPolarHBondContact O-CB 3.13Å; L580-L584 WeakPolarHBondContact O-CG 3.45Å; L580-L584 PolarHBondContact O-N 3.16Å
581	K	91.4	Very high	85.6	Confident	101 Å²	101	72.1 Å²	72.1	44%	0.439	38%	0.382	S	S	.	.	H	α-helix	trans	-65.7	-41	179.2	-77.4	173.5	-179.1	-178.8	0	112.6	S577 T578 L584 A585	S577-K581 WeakPolarHBondContact O-CB 3.44Å; S577-K581 VanDerWaalsContact O-CG 3.29Å; S577-K581 WeakPolarHBondContact O-CG 3.28Å; S577-K581 PolarHBondContact O-N 3.21Å; T578-K581 WeakPolarHBondContact O-CB 3.35Å; T578-K581 PolarHBondContact O-N 3.2Å; T578-K581 VanDerWaalsContact O-N 3.08Å; K581-L584 PolarHBondContact O-N 3.06Å; K581-A585 PolarHBondContact O-N 3.06Å
582	S	90.8	Very high	83.7	Confident	75 Å²	75	69.2 Å²	69.2	52%	0.524	37%	0.365	S	S	.	.	H	α-helix	trans	-68.9	-35.3	174.3	60.7	0	0	0	0	112.3	T578 N579 A585	T578-S582 PolarHBondContact O-N 3.28Å; T578-S582 PolarHBondContact O-OG 3.14Å; N579-S582 PolarHBondContact O-OG 3.27Å; N579-S582 VanDerWaalsContact O-OG 3.12Å; S582-A585 WeakPolarHBondContact O-CB 3.08Å; S582-A585 PolarHBondContact O-N 2.94Å
583	H	91.7	Very high	81.9	Confident	18 Å²	18	67.3 Å²	67.3	8%	0.083	37%	0.365	C	S	.	.	H	α-helix	trans	-67.2	-39.6	171.6	177.1	45.7	0	0	0	113.2	C565 C570 F574 N579 L580 A585 T586 H587	C565-H583 VanDerWaalsContact SG-CD2 3.58Å; C565-H583 PolarHBondContact SG-NE2 3.5Å; C565-H583 VanDerWaalsContact SG-NE2 3.4Å; C570-H583 PolarHBondContact SG-NE2 2.66Å; F574-H583 HydrophobicContact CE1-CB 4.07Å; F574-H583 HydrophobicContact CE2-CB 3.96Å; F574-H583 AromaticContact CE2-CD2 3.33Å; F574-H583 WeakPolarHBondContact CE2-CD2 3.46Å; F574-H583 AromaticContact CE2-CG 3.82Å; F574-H583 HydrophobicContact CZ-CB 3.5Å; F574-H583 AromaticContact CZ-CD2 3.35Å; F574-H583 WeakPolarHBondContact CZ-CD2 3.5Å; F574-H583 AromaticContact CZ-CG 3.4Å; F574-H583 VanDerWaalsContact CZ-CG 3.4Å; N579-H583 VanDerWaalsContact O-CB 3.28Å; N579-H583 WeakPolarHBondContact O-CB 3.42Å; N579-H583 PolarHBondContact O-N 3.14Å; L580-H583 PolarHBondContact O-N 3.27Å; H583-A585 PolarHBondContact O-N 3.05Å; H583-T586 PolarHBondContact ND1-OG1 3.05Å; H583-T586 WeakPolarHBondContact O-CB 3.4Å; H583-T586 PolarHBondContact O-N 3.08Å; H583-T586 PolarHBondContact O-OG1 3.25Å; H583-H587 AromaticContact CD2-NE2 3.89Å; H583-H587 AromaticContact CE1-CD2 3.78Å; H583-H587 AromaticContact CE1-CE1 3.84Å; H583-H587 AromaticContact CE1-NE2 3.09Å; H583-H587 PolarHBondContact CE1-NE2 3.08Å; H583-H587 AromaticContact NE2-CD2 3.68Å; H583-H587 AromaticContact NE2-CE1 3.98Å; H583-H587 AromaticContact NE2-NE2 2.95Å; H583-H587 PolarHBondContact NE2-NE2 3.16Å
584	L	90.3	Very high	79.9	Confident	39 Å²	39	67.3 Å²	67.3	20%	0.204	37%	0.37	C	S	.	.	H	α-helix	trans	-59.1	-31.6	174.4	-80.1	170	0	0	0	112	L195 P566 L580 K581 T586 H587 S588	L195-L584 HydrophobicContact CD2-CD1 4.49Å; P566-L584 HydrophobicContact CG-CD2 3.93Å; L580-L584 HydrophobicContact CD1-CD1 4.16Å; L580-L584 HydrophobicContact CD1-CG 4.06Å; L580-L584 HydrophobicContact CG-CD1 4.03Å; L580-L584 HydrophobicContact CG-CG 4.39Å; L580-L584 WeakPolarHBondContact O-CB 3.13Å; L580-L584 WeakPolarHBondContact O-CG 3.45Å; L580-L584 PolarHBondContact O-N 3.16Å; K581-L584 PolarHBondContact O-N 3.06Å; L584-T586 PolarHBondContact O-N 2.53Å; L584-H587 PolarHBondContact O-N 3.11Å; L584-S588 PolarHBondContact O-N 3.08Å
585	A	89.7	Confident	77.8	Confident	46 Å²	46	71.2 Å²	71.2	38%	0.38	39%	0.389	S	S	.	.	H	α-helix	trans	-68.1	-17.7	172.8	0	0	0	0	0	114.1	K581 S582 H583 S588 K589	K581-A585 PolarHBondContact O-N 3.06Å; S582-A585 WeakPolarHBondContact O-CB 3.08Å; S582-A585 PolarHBondContact O-N 2.94Å; H583-A585 PolarHBondContact O-N 3.05Å; A585-S588 WeakPolarHBondContact CA-OG 3.43Å; A585-S588 PolarHBondContact O-OG 2.97Å; A585-K589 WeakPolarHBondContact O-CG 3.33Å; A585-K589 PolarHBondContact O-N 3.24Å
586	T	90	Very high	75.8	Confident	61 Å²	61	73.1 Å²	73.1	37%	0.374	40%	0.401	S	S	.	.	H	α-helix	trans	-75.1	-37.4	169.7	71	0	0	0	0	111.1	H583 L584 S588 K589 I590	H583-T586 PolarHBondContact ND1-OG1 3.05Å; H583-T586 WeakPolarHBondContact O-CB 3.4Å; H583-T586 PolarHBondContact O-N 3.08Å; H583-T586 PolarHBondContact O-OG1 3.25Å; L584-T586 PolarHBondContact O-N 2.53Å; T586-S588 PolarHBondContact O-N 3.5Å; T586-K589 PolarHBondContact O-N 3.31Å; T586-K589 VanDerWaalsContact O-N 3.17Å; T586-I590 WeakPolarHBondContact O-CD1 3.48Å; T586-I590 VanDerWaalsContact O-CG1 3.31Å; T586-I590 WeakPolarHBondContact O-CG1 3.44Å; T586-I590 PolarHBondContact O-N 2.89Å
587	H	85.7	Confident	73.7	Confident	28 Å²	28	74 Å²	74	13%	0.13	41%	0.411	C	S	.	.	H	α-helix	trans	-67.4	-34.8	177.6	-69.6	-57.6	0	0	0	113.5	C565 Q567 C570 H583 L584 K589 I590 R591	C565-H587 PolarHBondContact SG-NE2 2.72Å; C565-H587 VanDerWaalsContact SG-NE2 3.4Å; Q567-H587 HydrophobicContact CG-CB 4.28Å; C570-H587 PolarHBondContact SG-CE1 3.33Å; C570-H587 PolarHBondContact SG-NE2 2.92Å; C570-H587 VanDerWaalsContact SG-NE2 3.36Å; H583-H587 AromaticContact CD2-NE2 3.89Å; H583-H587 AromaticContact CE1-CD2 3.78Å; H583-H587 AromaticContact CE1-CE1 3.84Å; H583-H587 AromaticContact CE1-NE2 3.09Å; H583-H587 PolarHBondContact CE1-NE2 3.08Å; H583-H587 AromaticContact NE2-CD2 3.68Å; H583-H587 AromaticContact NE2-CE1 3.98Å; H583-H587 AromaticContact NE2-NE2 2.95Å; H583-H587 PolarHBondContact NE2-NE2 3.16Å; L584-H587 PolarHBondContact O-N 3.11Å; H587-K589 VanDerWaalsContact C-N 3.32Å; H587-I590 PolarHBondContact O-N 3.34Å; H587-R591 PolarHBondContact O-N 2.81Å
588	S	78.8	Confident	71.5	Confident	77 Å²	77	78 Å²	78	54%	0.538	42%	0.424	S	S	.	.	H	α-helix	trans	-66.8	-32.1	171.7	50.8	0	0	0	0	112.7	L584 A585 T586	L584-S588 PolarHBondContact O-N 3.08Å; A585-S588 WeakPolarHBondContact CA-OG 3.43Å; A585-S588 PolarHBondContact O-OG 2.97Å; T586-S588 PolarHBondContact O-N 3.5Å
589	K	65.8	Low	69.6	Low	160 Å²	160	80.8 Å²	80.8	70%	0.696	43%	0.433	S	S	*	.	H	α-helix	trans	-71.8	-39.7	175.1	-71	176.9	179.6	-171.4	0	112.2	A585 T586 H587 R591 A592	A585-K589 WeakPolarHBondContact O-CG 3.33Å; A585-K589 PolarHBondContact O-N 3.24Å; T586-K589 PolarHBondContact O-N 3.31Å; T586-K589 VanDerWaalsContact O-N 3.17Å; H587-K589 VanDerWaalsContact C-N 3.32Å; K589-R591 VanDerWaalsContact C-N 3.32Å; K589-R591 PolarHBondContact O-N 3.35Å; K589-A592 WeakPolarHBondContact O-CB 3.46Å; K589-A592 PolarHBondContact O-N 2.95Å
590	I	60	Low	67.7	Low	86 Å²	86	82 Å²	82	44%	0.441	44%	0.439	S	S	.	.	H	α-helix	trans	-68.2	-28.6	-178.8	-66.6	161.2	0	0	0	112.4	T586 H587 A592 T593 H594	T586-I590 WeakPolarHBondContact O-CD1 3.48Å; T586-I590 VanDerWaalsContact O-CG1 3.31Å; T586-I590 WeakPolarHBondContact O-CG1 3.44Å; T586-I590 PolarHBondContact O-N 2.89Å; H587-I590 PolarHBondContact O-N 3.34Å; I590-A592 VanDerWaalsContact C-N 3.27Å; I590-A592 PolarHBondContact O-N 3.01Å; I590-T593 PolarHBondContact O-N 3.42Å; I590-T593 PolarHBondContact O-OG1 3.28Å; I590-T593 VanDerWaalsContact O-OG1 3.09Å; I590-H594 PolarHBondContact O-N 3.08Å
591	R	47.9	Very low	65.6	Low	122 Å²	122	89.5 Å²	89.5	46%	0.46	47%	0.466	S	S	.	.	H	α-helix	trans	-60.7	-34.6	173.2	-82.4	-172.8	167.8	91.4	-3	112.7	Q567 H587 K589 T593 H594 Q595	Q567-R591 VanDerWaalsContact OE1-NH2 3.13Å; H587-R591 PolarHBondContact O-N 2.81Å; K589-R591 VanDerWaalsContact C-N 3.32Å; K589-R591 PolarHBondContact O-N 3.35Å; R591-T593 PolarHBondContact O-N 3.24Å; R591-H594 PolarHBondContact O-N 3.12Å; R591-Q595 WeakPolarHBondContact O-CB 3.48Å; R591-Q595 WeakPolarHBondContact O-CG 3.35Å; R591-Q595 PolarHBondContact O-N 3.48Å; R591-Q595 PolarHBondContact O-OE1 3.22Å
592	A	49.2	Very low	63.7	Low	62 Å²	62	90.1 Å²	90.1	51%	0.512	47%	0.47	S	S	.	.	H	α-helix	trans	-64.6	-36.3	-179.2	0	0	0	0	0	113.3	K589 I590 S596	K589-A592 WeakPolarHBondContact O-CB 3.46Å; K589-A592 PolarHBondContact O-N 2.95Å; I590-A592 VanDerWaalsContact C-N 3.27Å; I590-A592 PolarHBondContact O-N 3.01Å; A592-S596 WeakPolarHBondContact O-CB 3.47Å; A592-S596 PolarHBondContact O-N 2.99Å; A592-S596 PolarHBondContact O-OG 3.33Å
593	T	53.2	Low	61.6	Low	89 Å²	89	93.4 Å²	93.4	55%	0.546	48%	0.477	S	S	.	.	H	α-helix	trans	-80.7	-30.2	-179.8	55.3	0	0	0	0	113.2	I590 R591 S596 S597	I590-T593 PolarHBondContact O-N 3.42Å; I590-T593 PolarHBondContact O-OG1 3.28Å; I590-T593 VanDerWaalsContact O-OG1 3.09Å; R591-T593 PolarHBondContact O-N 3.24Å; T593-S596 PolarHBondContact O-OG 2.57Å; T593-S597 PolarHBondContact O-N 3.17Å; T593-S597 PolarHBondContact O-OG 3.02Å
594	H	50.7	Low	59.6	Low	133 Å²	133	98.4 Å²	98.4	62%	0.616	50%	0.504	S	S	*	.	H	α-helix	trans	-77	-32.2	171.8	-96.6	-78.1	0	0	0	113.2	I590 R591 S597 F598	I590-H594 PolarHBondContact O-N 3.08Å; R591-H594 PolarHBondContact O-N 3.12Å; H594-S597 WeakPolarHBondContact CA-OG 3.49Å; H594-S597 PolarHBondContact O-OG 3.17Å; H594-F598 WeakPolarHBondContact O-CB 3.33Å; H594-F598 PolarHBondContact O-N 3.36Å
595	Q	47.9	Very low	57.4	Low	119 Å²	119	102.7 Å²	102.7	56%	0.556	53%	0.527	S	S	*	.	H	α-helix	trans	-74.5	-39.5	176.9	-73.6	178	-54.2	0	0	112.5	R591 F598 M599	R591-Q595 WeakPolarHBondContact O-CB 3.48Å; R591-Q595 WeakPolarHBondContact O-CG 3.35Å; R591-Q595 PolarHBondContact O-N 3.48Å; R591-Q595 PolarHBondContact O-OE1 3.22Å; Q595-F598 PolarHBondContact O-N 3.36Å; Q595-M599 PolarHBondContact O-N 2.89Å
596	S	50.3	Low	55.1	Low	63 Å²	63	105 Å²	105	44%	0.441	54%	0.54	S	S	.	.	H	α-helix	trans	-64.6	-43	176.2	61	0	0	0	0	112.5	A592 T593 F598 M599 N600	A592-S596 WeakPolarHBondContact O-CB 3.47Å; A592-S596 PolarHBondContact O-N 2.99Å; A592-S596 PolarHBondContact O-OG 3.33Å; T593-S596 PolarHBondContact O-OG 2.57Å; S596-F598 VanDerWaalsContact C-N 3.32Å; S596-F598 PolarHBondContact O-N 2.86Å; S596-M599 PolarHBondContact O-N 3.41Å; S596-N600 WeakPolarHBondContact O-CB 3.39Å; S596-N600 VanDerWaalsContact O-CG 3.3Å; S596-N600 PolarHBondContact O-N 3.28Å
597	S	47.2	Very low	52.7	Low	59 Å²	59	107 Å²	107	41%	0.413	55%	0.552	S	S	.	*	H	α-helix	trans	-68.3	-27.4	176.3	52.3	0	0	0	0	113.6	T593 H594	T593-S597 PolarHBondContact O-N 3.17Å; T593-S597 PolarHBondContact O-OG 3.02Å; H594-S597 WeakPolarHBondContact CA-OG 3.49Å; H594-S597 PolarHBondContact O-OG 3.17Å
598	F	44.5	Very low	50.5	Low	130 Å²	130	111.2 Å²	111.2	57%	0.57	58%	0.58	S	S	*	*	H	α-helix	trans	-76.2	-45.9	173.4	-166.6	-95.1	0	0	0	112.5	H594 Q595 S596 R601 H602	H594-F598 WeakPolarHBondContact O-CB 3.33Å; H594-F598 PolarHBondContact O-N 3.36Å; Q595-F598 PolarHBondContact O-N 3.36Å; S596-F598 VanDerWaalsContact C-N 3.32Å; S596-F598 PolarHBondContact O-N 2.86Å; F598-R601 PolarHBondContact O-N 3.34Å; F598-H602 AromaticContact CE1-CD2 3.56Å; F598-H602 AromaticContact CE1-NE2 3.69Å; F598-H602 AromaticContact CZ-CD2 3.84Å; F598-H602 AromaticContact CZ-NE2 3.58Å; F598-H602 PolarHBondContact O-N 2.9Å
599	M	51	Low	48.5	Very low	132 Å²	132	115.2 Å²	115.2	65%	0.65	60%	0.595	S	S	*	*	H	α-helix	trans	-66.4	-39.8	179.7	-76.2	-172.7	152.7	0	0	112.8	Q595 S596 R601 H602 H603	Q595-M599 PolarHBondContact O-N 2.89Å; S596-M599 PolarHBondContact O-N 3.41Å; M599-R601 PolarHBondContact O-N 3.05Å; M599-H602 PolarHBondContact O-N 3.15Å; M599-H603 PolarHBondContact O-N 3.22Å
600	N	51.8	Low	47.2	Very low	98 Å²	98	113.5 Å²	113.5	52%	0.524	60%	0.603	S	S	.	*	H	α-helix	trans	-61.5	-33.2	174.1	-73.2	-3	0	0	0	112.3	S596 L604	S596-N600 WeakPolarHBondContact O-CB 3.39Å; S596-N600 VanDerWaalsContact O-CG 3.3Å; S596-N600 PolarHBondContact O-N 3.28Å; N600-L604 WeakPolarHBondContact O-CG 3.38Å; N600-L604 PolarHBondContact O-N 3.18Å
601	R	50.7	Low	46	Very low	182 Å²	182	113.4 Å²	113.4	69%	0.687	62%	0.624	S	S	*	*	H	α-helix	trans	-73.9	-28.8	179.7	-160.5	179.1	-67.5	-155.3	-2.2	113	F598 M599	F598-R601 PolarHBondContact O-N 3.34Å; M599-R601 PolarHBondContact O-N 3.05Å
602	H	50.4	Low	45.4	Very low	113 Å²	113	111 Å²	111	52%	0.523	64%	0.637	S	S	.	*	H	α-helix	trans	-77.1	-37.7	173.4	-93	-83.3	0	0	0	113.3	F598 M599 N605 S606	F598-H602 AromaticContact CE1-CD2 3.56Å; F598-H602 AromaticContact CE1-NE2 3.69Å; F598-H602 AromaticContact CZ-CD2 3.84Å; F598-H602 AromaticContact CZ-NE2 3.58Å; F598-H602 PolarHBondContact O-N 2.9Å; M599-H602 PolarHBondContact O-N 3.15Å; H602-N605 PolarHBondContact O-N 3.22Å; H602-S606 PolarHBondContact O-N 2.8Å; H602-S606 PolarHBondContact O-OG 3.17Å
603	H	47.3	Very low	44.8	Very low	144 Å²	144	115.6 Å²	115.6	67%	0.667	66%	0.658	S	S	*	*	H	α-helix	trans	-66.3	-39.9	178.5	-96.9	-72	0	0	0	113.1	M599 N605 S606	M599-H603 PolarHBondContact O-N 3.22Å; H603-N605 VanDerWaalsContact C-N 3.34Å; H603-N605 PolarHBondContact O-N 3.27Å; H603-S606 PolarHBondContact O-N 2.88Å
604	L	49	Very low	43.9	Very low	124 Å²	124	114.9 Å²	114.9	65%	0.649	67%	0.668	S	S	*	*	H	α-helix	trans	-71.2	-25.2	-179.9	-69	171.4	0	0	0	113.9	N600 T607	N600-L604 WeakPolarHBondContact O-CG 3.38Å; N600-L604 PolarHBondContact O-N 3.18Å; L604-T607 PolarHBondContact O-OG1 3.35Å
605	N	44.5	Very low	43.1	Very low	129 Å²	129	114.2 Å²	114.2	69%	0.69	68%	0.679	S	S	*	*	H	α-helix	trans	-89.3	-6.9	177.7	-75.3	5.1	0	0	0	113.6	H602 H603	H602-N605 PolarHBondContact O-N 3.22Å; H603-N605 VanDerWaalsContact C-N 3.34Å; H603-N605 PolarHBondContact O-N 3.27Å
606	S	40.8	Very low	42.5	Very low	95 Å²	95	114.6 Å²	114.6	66%	0.664	69%	0.689	S	S	*	*	S	Bend	trans	-98.7	-3.4	-178	-56.2	0	0	0	0	114	H602 H603	H602-S606 PolarHBondContact O-N 2.8Å; H602-S606 PolarHBondContact O-OG 3.17Å; H603-S606 PolarHBondContact O-N 2.88Å
607	T	39.9	Very low	41.6	Very low	102 Å²	102	118.9 Å²	118.9	63%	0.626	71%	0.706	S	S	*	*	S	Bend	trans	-102.1	-2.8	-176.7	47.5	0	0	0	0	114.3	L604 N609	L604-T607 PolarHBondContact O-OG1 3.35Å; T607-N609 PolarHBondContact O-N 3.5Å
608	V	39.8	Very low	41.1	Very low	116 Å²	116	124 Å²	124	70%	0.703	73%	0.728	S	S	*	*	S	Bend	trans	-103.7	57.6	-176.2	-165.5	0	0	0	0	111.2
609	N	35.9	Very low	40.9	Very low	161 Å²	161	128.6 Å²	128.6	86%	0.861	74%	0.742	S	S	*	*			trans	-162.3	51.9	169.9	-106.2	-30.4	0	0	0	114.1	T607	T607-N609 PolarHBondContact O-N 3.5Å
610	S	39.2	Very low	40.3	Very low	125 Å²	125	128.3 Å²	128.3	87%	0.874	75%	0.749	S	S	*	*			trans	-171.3	139.2	161.2	-78.4	0	0	0	0	108.1
611	G	34.1	Very low	39.5	Very low	84 Å²	84	127.6 Å²	127.6	87%	0.866	76%	0.757	S	S	*	*			cis	140.6	60.7	0.3	0	0	0	0	0	112.7
612	G	35	Very low	39	Very low	72 Å²	72	123.9 Å²	123.9	74%	0.742	77%	0.766	S	S	*	*			trans	-176.3	125.7	-179.2	0	0	0	0	0	116.8
613	V	36.8	Very low	38.5	Very low	158 Å²	158	123.1 Å²	123.1	96%	0.958	78%	0.779	S	S	*	*			trans	-11.6	145.3	160.5	-70	0	0	0	0	120.4
614	G	34.2	Very low	38.1	Very low	73 Å²	73	120.5 Å²	120.5	75%	0.753	78%	0.782	S	S	*	*			trans	-163.3	-28.6	178.9	0	0	0	0	0	122.2
615	S	35.6	Very low	37.7	Very low	120 Å²	120	123.6 Å²	123.6	84%	0.839	79%	0.793	S	S	*	*			trans	69	161.2	169.7	-57.2	0	0	0	0	121.3
616	V	34.6	Very low	38	Very low	126 Å²	126	122.2 Å²	122.2	76%	0.764	79%	0.79	S	S	*	*			trans	82.7	96.3	162.3	-163.5	0	0	0	0	120.5
617	L	31.7	Very low	37.9	Very low	154 Å²	154	124.3 Å²	124.3	81%	0.806	79%	0.794	S	S	*	*				34.2	139.6	124.8	-51.9	177.2	0	0	0	120.5
618	L	36.1	Very low	38	Very low	167 Å²	167	126.4 Å²	126.4	87%	0.874	80%	0.797	S	S	*	*			cis	-139.3	172.1	20.7	-86.1	98.4	0	0	0	114
619	R	39.5	Very low	38	Very low	226 Å²	226	126.4 Å²	126.4	85%	0.853	80%	0.797	S	S	*	*			trans	-124.8	152.3	172.8	-156.1	-174.1	-176.4	-179.2	2.3	108.9
620	P	38.5	Very low	38.1	Very low	125 Å²	125	125.1 Å²	125.1	81%	0.812	79%	0.786	S	S	*	*				-149.5	177.2	101.5	30.1	-9.1	0	0	0	113.3
621	A	36.7	Very low	38	Very low	83 Å²	83	126.2 Å²	126.2	69%	0.686	78%	0.782	S	S	*	*			cis	-170.7	-178.2	-29.6	0	0	0	0	0	109.1
622	A	39.3	Very low	38.1	Very low	105 Å²	105	129.4 Å²	129.4	87%	0.868	77%	0.774	S	S	*	*			trans	72.3	137.7	172.1	0	0	0	0	0	117.1
623	A	40.1	Very low	38.2	Very low	97 Å²	97	134.7 Å²	134.7	80%	0.802	78%	0.779	S	S	*	*			cis	-154.8	173.4	-5.4	0	0	0	0	0	113.3
624	A	39.7	Very low	38.1	Very low	88 Å²	88	134.2 Å²	134.2	73%	0.727	77%	0.769	S	S	*	*			trans	77.7	64.8	154	0	0	0	0	0	121.4
625	H	38.9	Very low	38.2	Very low	190 Å²	190	136.3 Å²	136.3	88%	0.88	77%	0.77	S	S	*	*				53.4	158.8	118.4	-76.5	-79.3	0	0	0	123.9
626	P	51.3	Low	38.1	Very low	99 Å²	99	138.1 Å²	138.1	64%	0.643	77%	0.77	S	S	*	*			trans	-125.4	-165.3	-150.2	45.3	-31.7	0	0	0	114.2
627	N	39.5	Very low	38.1	Very low	140 Å²	140	137.9 Å²	137.9	75%	0.749	77%	0.774	S	S	*	*				-169	152	123.1	-103.3	-20.5	0	0	0	118
628	H	42	Very low	38.1	Very low	146 Å²	146	137.6 Å²	137.6	68%	0.676	77%	0.773	S	S	*	*			trans	71.1	99.4	148	-89.3	-80.2	0	0	0	124.1
629	T	39.9	Very low	37.9	Very low	115 Å²	115	137.4 Å²	137.4	71%	0.706	77%	0.773	S	S	*	*				55.3	155	117	57.4	0	0	0	0	122.7
630	H	36.5	Very low	37.6	Very low	134 Å²	134	130.2 Å²	130.2	62%	0.62	77%	0.768	S	S	*	*			cis	-179.6	131.1	-22	-176.7	-89.9	0	0	0	105.9
631	D	38.8	Very low	37.4	Very low	148 Å²	148	129 Å²	129	79%	0.791	76%	0.763	S	S	*	*				176.9	162.7	129.8	-98.6	-39.2	0	0	0	112.6
632	Q	35.2	Very low	37	Very low	152 Å²	152	132 Å²	132	71%	0.71	77%	0.766	S	S	*	*			trans	-122.2	151.2	-171.3	-56.6	172.3	-3.6	0	0	109.8
633	H	38.2	Very low	36.6	Very low	183 Å²	183	134 Å²	134	85%	0.847	76%	0.761	S	S	*	*				-164.2	142.4	119.8	-114.6	-75.1	0	0	0	114.2
634	I	34.4	Very low	36.4	Very low	147 Å²	147	137 Å²	137	75%	0.754	76%	0.759	S	S	*	*			trans	-118.6	141.5	171.7	-73.1	169.2	0	0	0	103.4
635	P	36.6	Very low	35.9	Very low	118 Å²	118	138 Å²	138	77%	0.766	76%	0.761	S	S	*	*				-153.1	170.5	74.8	41.5	-20.4	0	0	0	119.5
636	N	31.9	Very low	35.5	Very low	157 Å²	157	134.8 Å²	134.8	84%	0.84	76%	0.757	S	S	*	*			trans	-64.5	156.6	167.2	-56.2	-32.6	0	0	0	112.4
637	S	35.3	Very low	34.5	Very low	121 Å²	121	138.2 Å²	138.2	85%	0.846	77%	0.766	S	S	*	*			trans	-142.2	152.6	150.7	-167.2	0	0	0	0	110.6
638	L	31.5	Very low	34	Very low	148 Å²	148	138 Å²	138	78%	0.775	77%	0.765	S	S	*	*			trans	-101.1	176.2	-174.8	-77.6	143	0	0	0	112.1
639	N	31.3	Very low	33.2	Very low	164 Å²	164	140.7 Å²	140.7	88%	0.877	78%	0.775	S	S	*	*			trans	94.3	128.9	164.7	-47.8	-42.7	0	0	0	115.7
640	G	33.3	Very low	32.6	Very low	74 Å²	74	140 Å²	140	76%	0.763	78%	0.775	S	S	*	*			trans	177.9	-1.7	-174	0	0	0	0	0	118.8
641	S	35.8	Very low	32.4	Very low	101 Å²	101	139.2 Å²	139.2	71%	0.706	78%	0.78	S	S	*	*			trans	48.2	119.3	153	-60.9	0	0	0	0	122.7
642	I	28.1	Very low	31.9	Very low	146 Å²	146	139.5 Å²	139.5	75%	0.749	78%	0.78	S	S	*	*				71	97	125	-60.5	168.4	0	0	0	118.4
643	L	30.4	Very low	31.8	Very low	146 Å²	146	138.4 Å²	138.4	76%	0.764	78%	0.777	S	S	*	*				174.9	158	109.2	-103.3	155	0	0	0	115.8
644	Q	35.3	Very low	31.4	Very low	159 Å²	159	135 Å²	135	74%	0.743	77%	0.771	S	S	*	*			trans	70.9	83.7	150.6	-87.3	160.3	-14.4	0	0	122.7
645	S	30	Very low	31.3	Very low	111 Å²	111	136.1 Å²	136.1	78%	0.776	78%	0.777	S	S	*	*				74.6	147.3	120.8	52.8	0	0	0	0	121.6
646	P	30.2	Very low	30.8	Very low	121 Å²	121	134 Å²	134	79%	0.786	78%	0.777	S	S	*	*			trans	-97.1	151.8	-168	38.2	-35.2	0	0	0	114.5
647	M	31.3	Very low	31.1	Very low	171 Å²	171	130.6 Å²	130.6	84%	0.842	77%	0.765	S	S	*	*			trans	-141.1	115.7	164.8	-84.7	-64.1	177	0	0	112.8
648	N	28.9	Very low	31	Very low	137 Å²	137	134 Å²	134	73%	0.733	77%	0.765	S	S	*	*			trans	30.8	112.7	148.6	-60.4	-31.9	0	0	0	120.1	S650	N648-S650 PolarHBondContact O-N 3.02Å
649	F	25	Very low	31.3	Very low	202 Å²	202	131.3 Å²	131.3	89%	0.886	75%	0.751	S	S	*	*			trans	-60.9	129.8	148.4	-85.4	-96.5	0	0	0	110.1
650	S	27.2	Very low	31.8	Very low	100 Å²	100	130.1 Å²	130.1	70%	0.699	74%	0.743	S	S	*	*			trans	-147.1	83.9	167.6	-77.1	0	0	0	0	109.3	N648 I652	N648-S650 PolarHBondContact O-N 3.02Å; S650-I652 PolarHBondContact O-N 3.49Å
651	T	31.2	Very low	32.1	Very low	117 Å²	117	132 Å²	132	72%	0.718	74%	0.736	S	S	*	*			trans	-68.1	102.1	-177.5	-52.3	0	0	0	0	110.7	I653	T651-I653 HydrophobicContact CG2-CG1 4.39Å; T651-I653 PolarHBondContact O-N 3.03Å; T651-I653 VanDerWaalsContact O-N 3.16Å
652	I	29.4	Very low	32.3	Very low	154 Å²	154	131.4 Å²	131.4	79%	0.79	73%	0.728	S	S	*	*			trans	-72.2	106.1	177.2	-59.9	176.1	0	0	0	109.2	S650	S650-I652 PolarHBondContact O-N 3.49Å
653	I	31.8	Very low	32.8	Very low	130 Å²	130	134.3 Å²	134.3	67%	0.667	73%	0.729	S	S	*	*			trans	-91.8	125.4	175.1	-60.1	176.1	0	0	0	109.2	T651 I655	T651-I653 HydrophobicContact CG2-CG1 4.39Å; T651-I653 PolarHBondContact O-N 3.03Å; T651-I653 VanDerWaalsContact O-N 3.16Å; I653-I655 PolarHBondContact O-N 3.13Å; I653-I655 VanDerWaalsContact O-N 3.13Å
654	P	30.1	Very low	33.1	Very low	111 Å²	111	131.8 Å²	131.8	72%	0.721	72%	0.717	S	S	*	*			trans	-74.4	104.1	180	29.2	-34.1	0	0	0	111.6	G656	P654-G656 PolarHBondContact O-N 3.06Å
655	I	32	Very low	33.2	Very low	170 Å²	170	132.8 Å²	132.8	87%	0.872	71%	0.714	S	S	*	*			trans	-72.7	100.1	178.9	-58.3	178.7	0	0	0	109.8	I653	I653-I655 PolarHBondContact O-N 3.13Å; I653-I655 VanDerWaalsContact O-N 3.13Å
656	G	27.8	Very low	33.4	Very low	74 Å²	74	131.1 Å²	131.1	76%	0.763	70%	0.701	S	S	*	*			trans	-130.6	14.1	-166.6	0	0	0	0	0	117.2	P654	P654-G656 PolarHBondContact O-N 3.06Å
657	S	37.4	Very low	34.1	Very low	85 Å²	85	129.2 Å²	129.2	59%	0.594	69%	0.687	S	S	*	*			trans	-130	150.9	179.6	67.4	0	0	0	0	113.1	D659	S657-D659 VanDerWaalsContact C-N 3.33Å; S657-D659 WeakPolarHBondContact CB-OD2 3.31Å; S657-D659 PolarHBondContact O-N 3.16Å; S657-D659 PolarHBondContact OG-OD2 3.27Å
658	K	34	Very low	34.4	Very low	193 Å²	193	125.7 Å²	125.7	84%	0.839	67%	0.672	S	S	*	*			trans	-92.7	53.8	-177.8	-74	-170	173.8	-175.2	0	112.2	I660	K658-I660 PolarHBondContact O-N 2.74Å
659	D	36.8	Very low	35	Very low	92 Å²	92	128.4 Å²	128.4	49%	0.492	67%	0.672	S	S	.	*			trans	-86.1	92.7	-177.1	-70	-66.8	0	0	0	112.5	S657 N661 V662	S657-D659 VanDerWaalsContact C-N 3.33Å; S657-D659 WeakPolarHBondContact CB-OD2 3.31Å; S657-D659 PolarHBondContact O-N 3.16Å; S657-D659 PolarHBondContact OG-OD2 3.27Å; D659-N661 PolarHBondContact O-N 2.92Å; D659-V662 HydrophobicContact CB-CG2 4.13Å; D659-V662 PolarHBondContact O-N 2.89Å
660	I	42.9	Very low	35.5	Very low	138 Å²	138	126.1 Å²	126.1	71%	0.708	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.6	-27.9	177.1	-67.8	171.4	0	0	0	111.9	K658 V662 R663	K658-I660 PolarHBondContact O-N 2.74Å; I660-V662 PolarHBondContact O-N 2.76Å; I660-R663 PolarHBondContact O-N 3.13Å
661	N	39.3	Very low	36.4	Very low	114 Å²	114	128.2 Å²	128.2	61%	0.61	66%	0.658	S	S	*	*	H	α-helix	trans	-66.3	-12.5	177.8	-74.8	-31.8	0	0	0	115.6	D659	D659-N661 PolarHBondContact O-N 2.92Å
662	V	40.2	Very low	37	Very low	88 Å²	88	125.4 Å²	125.4	53%	0.533	64%	0.643	S	S	.	*	H	α-helix	trans	-79.3	-40.3	176.8	-176.2	0	0	0	0	111.4	D659 I660 N664 R665 C666	D659-V662 HydrophobicContact CB-CG2 4.13Å; D659-V662 PolarHBondContact O-N 2.89Å; I660-V662 PolarHBondContact O-N 2.76Å; V662-N664 PolarHBondContact O-N 3.09Å; V662-R665 WeakPolarHBondContact O-CB 3.24Å; V662-R665 PolarHBondContact O-N 2.95Å; V662-C666 PolarHBondContact O-N 2.82Å
663	R	37.1	Very low	37.5	Very low	207 Å²	207	122.6 Å²	122.6	78%	0.781	63%	0.63	S	S	*	*	H	α-helix	trans	-61.8	-45.7	179.3	-102	-177.1	-179.5	136.2	4.6	112.2	I660 R665 C666 V667	I660-R663 PolarHBondContact O-N 3.13Å; R663-R665 PolarHBondContact O-N 3.09Å; R663-C666 PolarHBondContact O-N 2.97Å; R663-C666 VanDerWaalsContact O-N 3.16Å; R663-V667 WeakPolarHBondContact O-CG2 3.45Å; R663-V667 PolarHBondContact O-N 3.36Å
664	N	36.7	Very low	38.2	Very low	93 Å²	93	120.4 Å²	120.4	50%	0.497	62%	0.619	S	S	.	*	H	α-helix	trans	-64.7	-30.9	179.7	-67.1	7.1	0	0	0	111.6	V662 V667 N668	V662-N664 PolarHBondContact O-N 3.09Å; N664-V667 PolarHBondContact O-N 3.4Å; N664-N668 VanDerWaalsContact O-CB 3.26Å; N664-N668 WeakPolarHBondContact O-CB 3.28Å; N664-N668 VanDerWaalsContact O-CG 3.24Å; N664-N668 PolarHBondContact O-N 3.26Å
665	R	39	Very low	38.8	Very low	180 Å²	180	119.1 Å²	119.1	68%	0.679	61%	0.613	S	S	*	*	H	α-helix	trans	-68.4	-35.9	175.7	-144.5	178.5	-63.5	-173.8	-1.2	112.4	V662 R663 R669	V662-R665 WeakPolarHBondContact O-CB 3.24Å; V662-R665 PolarHBondContact O-N 2.95Å; R663-R665 PolarHBondContact O-N 3.09Å; R665-R669 PolarHBondContact O-N 3.42Å
666	C	33.7	Very low	39.2	Very low	76 Å²	76	114.7 Å²	114.7	51%	0.514	60%	0.597	S	S	.	*	H	α-helix	trans	-73.2	-42.9	172.6	-67.2	0	0	0	0	112.7	V662 R663 N668 R669 F670	V662-C666 PolarHBondContact O-N 2.82Å; R663-C666 PolarHBondContact O-N 2.97Å; R663-C666 VanDerWaalsContact O-N 3.16Å; C666-N668 VanDerWaalsContact C-N 3.33Å; C666-N668 PolarHBondContact O-N 3.4Å; C666-R669 PolarHBondContact O-N 3.35Å; C666-F670 PolarHBondContact O-N 3.35Å
667	V	44.3	Very low	39.8	Very low	82 Å²	82	117.4 Å²	117.4	50%	0.497	59%	0.593	S	S	.	*	H	α-helix	trans	-64.1	-39	177.1	172.8	0	0	0	0	111.1	R663 N664 F670 K671	R663-V667 WeakPolarHBondContact O-CG2 3.45Å; R663-V667 PolarHBondContact O-N 3.36Å; N664-V667 PolarHBondContact O-N 3.4Å; V667-F670 PolarHBondContact O-N 3.09Å; V667-K671 PolarHBondContact O-N 3.5Å
668	N	38.7	Very low	39.7	Very low	96 Å²	96	121 Å²	121	51%	0.513	60%	0.598	S	S	.	*	H	α-helix	trans	-72.2	-32.8	177.3	-70.6	-2.3	0	0	0	112.6	N664 C666 F670 K671 S672	N664-N668 VanDerWaalsContact O-CB 3.26Å; N664-N668 WeakPolarHBondContact O-CB 3.28Å; N664-N668 VanDerWaalsContact O-CG 3.24Å; N664-N668 PolarHBondContact O-N 3.26Å; C666-N668 VanDerWaalsContact C-N 3.33Å; C666-N668 PolarHBondContact O-N 3.4Å; N668-F670 VanDerWaalsContact C-N 3.34Å; N668-K671 PolarHBondContact O-N 3.42Å; N668-S672 PolarHBondContact O-N 3.5Å; N668-S672 PolarHBondContact O-OG 3.31Å
669	R	40.2	Very low	39.8	Very low	195 Å²	195	119.5 Å²	119.5	74%	0.736	59%	0.594	S	S	*	*	H	α-helix	trans	-64.8	-35	166.9	-95	-174.9	171.1	175.2	-2.9	112.9	R665 C666 S672 N673	R665-R669 PolarHBondContact O-N 3.42Å; C666-R669 PolarHBondContact O-N 3.35Å; R669-S672 WeakPolarHBondContact CA-OG 3.49Å; R669-S672 PolarHBondContact O-OG 3.39Å; R669-N673 WeakPolarHBondContact O-CB 3.48Å; R669-N673 PolarHBondContact O-N 3.23Å; R669-N673 VanDerWaalsContact O-N 3.09Å; R669-N673 PolarHBondContact O-OD1 3.06Å; R669-N673 VanDerWaalsContact O-OD1 3.09Å
670	F	36.7	Very low	39.6	Very low	153 Å²	153	124 Å²	124	67%	0.671	61%	0.613	S	S	*	*	H	α-helix	trans	-70.1	-39.6	172.6	-108.2	-86.9	0	0	0	112.1	C666 V667 N668 L674	C666-F670 PolarHBondContact O-N 3.35Å; V667-F670 PolarHBondContact O-N 3.09Å; N668-F670 VanDerWaalsContact C-N 3.34Å; F670-L674 HydrophobicContact CD1-CD1 4.44Å; F670-L674 VanDerWaalsContact O-CB 3.29Å; F670-L674 WeakPolarHBondContact O-CB 3.33Å; F670-L674 WeakPolarHBondContact O-CG 3.35Å; F670-L674 PolarHBondContact O-N 3.48Å
671	K	46.1	Very low	39.1	Very low	145 Å²	145	122.9 Å²	122.9	63%	0.63	61%	0.612	S	S	*	*	H	α-helix	trans	-62.3	-44	172.2	-86.3	-172.8	170.4	-176.9	0	112.3	V667 N668 L674 S675	V667-K671 PolarHBondContact O-N 3.5Å; N668-K671 PolarHBondContact O-N 3.42Å; K671-L674 PolarHBondContact O-N 3.45Å; K671-S675 WeakPolarHBondContact O-CB 3.5Å; K671-S675 PolarHBondContact O-N 2.74Å
672	S	43.4	Very low	38.6	Very low	58 Å²	58	126.5 Å²	126.5	41%	0.406	63%	0.625	S	S	.	*	H	α-helix	trans	-62.6	-46	177.5	60.7	0	0	0	0	111.6	N668 R669 L674 S675 S676	N668-S672 PolarHBondContact O-N 3.5Å; N668-S672 PolarHBondContact O-OG 3.31Å; R669-S672 WeakPolarHBondContact CA-OG 3.49Å; R669-S672 PolarHBondContact O-OG 3.39Å; S672-L674 PolarHBondContact O-N 3.46Å; S672-S675 WeakPolarHBondContact O-CB 3.46Å; S672-S675 PolarHBondContact O-N 3.18Å; S672-S676 PolarHBondContact O-N 3.14Å; S672-S676 PolarHBondContact O-OG 3.19Å
673	N	39.7	Very low	38.2	Very low	94 Å²	94	130.6 Å²	130.6	50%	0.503	64%	0.643	S	S	.	*	H	α-helix	trans	-72.8	-29.8	-177.1	-66.1	21.7	0	0	0	112.4	R669 S676 L677	R669-N673 WeakPolarHBondContact O-CB 3.48Å; R669-N673 PolarHBondContact O-N 3.23Å; R669-N673 VanDerWaalsContact O-N 3.09Å; R669-N673 PolarHBondContact O-OD1 3.06Å; R669-N673 VanDerWaalsContact O-OD1 3.09Å; N673-S676 WeakPolarHBondContact CA-OG 3.41Å; N673-S676 PolarHBondContact O-OG 2.93Å; N673-L677 WeakPolarHBondContact O-CB 3.49Å; N673-L677 WeakPolarHBondContact O-CD1 3.41Å; N673-L677 VanDerWaalsContact O-CG 3.31Å; N673-L677 WeakPolarHBondContact O-CG 3.35Å; N673-L677 PolarHBondContact O-N 3.45Å
674	L	45.8	Very low	37.8	Very low	84 Å²	84	129.2 Å²	129.2	44%	0.44	65%	0.645	S	S	.	*	H	α-helix	trans	-69.1	-40.7	167.9	-80.8	163.3	0	0	0	111.5	F670 K671 S672 S676 L677 F678	F670-L674 HydrophobicContact CD1-CD1 4.44Å; F670-L674 VanDerWaalsContact O-CB 3.29Å; F670-L674 WeakPolarHBondContact O-CB 3.33Å; F670-L674 WeakPolarHBondContact O-CG 3.35Å; F670-L674 PolarHBondContact O-N 3.48Å; K671-L674 PolarHBondContact O-N 3.45Å; S672-L674 PolarHBondContact O-N 3.46Å; L674-S676 PolarHBondContact O-N 3.01Å; L674-L677 PolarHBondContact O-N 3.21Å; L674-L677 VanDerWaalsContact O-N 3.07Å; L674-F678 HydrophobicContact CD2-CD2 4.32Å; L674-F678 HydrophobicContact CD2-CE2 4.05Å; L674-F678 PolarHBondContact O-N 3.41Å
675	S	43	Very low	37.4	Very low	85 Å²	85	132.1 Å²	132.1	59%	0.594	66%	0.661	S	S	*	*	H	α-helix	trans	-63.8	-29.4	178.4	-162.7	0	0	0	0	112.9	K671 S672	K671-S675 WeakPolarHBondContact O-CB 3.5Å; K671-S675 PolarHBondContact O-N 2.74Å; S672-S675 WeakPolarHBondContact O-CB 3.46Å; S672-S675 PolarHBondContact O-N 3.18Å
676	S	41.6	Very low	37.1	Very low	77 Å²	77	129.4 Å²	129.4	54%	0.538	67%	0.669	S	S	.	*	H	α-helix	trans	-85.3	-17	172.8	61.8	0	0	0	0	114.1	S672 N673 L674	S672-S676 PolarHBondContact O-N 3.14Å; S672-S676 PolarHBondContact O-OG 3.19Å; N673-S676 WeakPolarHBondContact CA-OG 3.41Å; N673-S676 PolarHBondContact O-OG 2.93Å; L674-S676 PolarHBondContact O-N 3.01Å
677	L	38.8	Very low	37.1	Very low	131 Å²	131	137.2 Å²	137.2	69%	0.686	69%	0.688	S	S	*	*	H	α-helix	trans	-94	-13.6	177.1	-79.6	168.1	0	0	0	113.4	N673 L674	N673-L677 WeakPolarHBondContact O-CB 3.49Å; N673-L677 WeakPolarHBondContact O-CD1 3.41Å; N673-L677 VanDerWaalsContact O-CG 3.31Å; N673-L677 WeakPolarHBondContact O-CG 3.35Å; N673-L677 PolarHBondContact O-N 3.45Å; L674-L677 PolarHBondContact O-N 3.21Å; L674-L677 VanDerWaalsContact O-N 3.07Å
678	F	35.1	Very low	36.6	Very low	159 Å²	159	140.9 Å²	140.9	70%	0.697	70%	0.704	S	S	*	*	S	Bend	trans	-91.8	6.8	175.5	-95.1	-87.6	0	0	0	114.2	L674	L674-F678 HydrophobicContact CD2-CD2 4.32Å; L674-F678 HydrophobicContact CD2-CE2 4.05Å; L674-F678 PolarHBondContact O-N 3.41Å
679	Q	37.5	Very low	36.2	Very low	162 Å²	162	145.2 Å²	145.2	76%	0.757	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	2.5	-173	-140	159.3	2	0	0	114.4
680	E	33	Very low	36	Very low	187 Å²	187	142.6 Å²	142.6	87%	0.874	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.6	22.5	-178.6	-65.4	-166.5	126.4	0	0	114.8
681	V	31.7	Very low	35.7	Very low	115 Å²	115	140.6 Å²	140.6	70%	0.697	73%	0.732	S	S	*	*	S	Bend	trans	-133.5	58.3	177.6	-162.1	0	0	0	0	112.7
682	H	29.5	Very low	35.1	Very low	189 Å²	189	138.6 Å²	138.6	88%	0.875	74%	0.736	S	S	*	*			trans	-156.8	61.2	171.1	-115.2	-68.4	0	0	0	113.5
683	L	30.4	Very low	34.6	Very low	174 Å²	174	143.1 Å²	143.1	91%	0.911	76%	0.755	S	S	*	*			trans	-139.6	30.5	-177.1	-123.9	169.3	0	0	0	115.9
684	E	29.6	Very low	34.4	Very low	179 Å²	179	146 Å²	146	84%	0.836	77%	0.769	S	S	*	*	S	Bend	trans	-145.1	161.2	165.8	-116.1	165.9	-168.4	0	0	111.2
685	N	28.6	Very low	33.7	Very low	154 Å²	154	148.3 Å²	148.3	82%	0.824	78%	0.782	S	S	*	*	S	Bend	trans	64.4	59.7	-178	-57.6	-44.9	0	0	0	117.5
686	S	30.9	Very low	33.4	Very low	123 Å²	123	150.3 Å²	150.3	86%	0.86	79%	0.785	S	S	*	*			trans	-176.3	70.1	141.6	-84.1	0	0	0	0	113.2
687	R	34.8	Very low	33	Very low	239 Å²	239	152.9 Å²	152.9	90%	0.902	79%	0.793	S	S	*	*			trans	-136.9	116.3	164.1	-79.6	-167.5	173.3	178.2	-1	112.8
688	L	33.1	Very low	32.7	Very low	159 Å²	159	152.9 Å²	152.9	83%	0.832	79%	0.793	S	S	*	*			trans	62.4	100.7	148.9	-55.6	174.1	0	0	0	118.2	T690	L688-T690 PolarHBondContact O-N 3.24Å
689	H	31.6	Very low	32.6	Very low	187 Å²	187	150.8 Å²	150.8	87%	0.866	79%	0.794	S	S	*	*			trans	-59.1	125.9	137.2	-81.9	-96.8	0	0	0	109.2
690	T	34.5	Very low	32.4	Very low	140 Å²	140	150 Å²	150	86%	0.859	79%	0.794	S	S	*	*				-170.9	162.4	119.1	18.6	0	0	0	0	109.7	L688	L688-T690 PolarHBondContact O-N 3.24Å
691	S	30.7	Very low	32.4	Very low	112 Å²	112	146.1 Å²	146.1	78%	0.783	79%	0.787	S	S	*	*			trans	-94.1	165.1	-163.3	-56.7	0	0	0	0	113.8
692	S	34.2	Very low	32.4	Very low	102 Å²	102	148 Å²	148	71%	0.713	79%	0.792	S	S	*	*			trans	99.1	104	147	-56.1	0	0	0	0	119.6
693	L	32.1	Very low	32.6	Very low	153 Å²	153	144.8 Å²	144.8	80%	0.801	79%	0.788	S	S	*	*				83.3	130.6	126.3	-66	174.9	0	0	0	121.1
694	L	35.6	Very low	32.5	Very low	154 Å²	154	142.8 Å²	142.8	81%	0.806	78%	0.783	S	S	*	*			trans	69.6	111.7	157.5	-58.8	165.5	0	0	0	116.4
695	N	31.9	Very low	32.9	Very low	133 Å²	133	140.1 Å²	140.1	71%	0.711	78%	0.784	S	S	*	*			cis	104.6	148.1	33.2	-173.7	32	0	0	0	112.1
696	I	35.2	Very low	33.1	Very low	127 Å²	127	138.2 Å²	138.2	65%	0.651	78%	0.783	S	S	*	*			trans	79.2	98.2	174.3	-45	-176.3	0	0	0	116.3
697	N	33.4	Very low	33.6	Very low	131 Å²	131	137.8 Å²	137.8	70%	0.701	78%	0.777	S	S	*	*				33.7	143.5	121.6	-42.1	-15.4	0	0	0	118.6
698	N	33.1	Very low	33.5	Very low	132 Å²	132	133.4 Å²	133.4	71%	0.706	77%	0.772	S	S	*	*				-178.6	152.4	53.8	-131.8	-9.7	0	0	0	112.7
699	T	33.4	Very low	33.6	Very low	115 Å²	115	134.9 Å²	134.9	71%	0.706	77%	0.774	S	S	*	*			trans	62.9	157.9	149.6	59.4	0	0	0	0	120.1
700	L	32.4	Very low	33.3	Very low	146 Å²	146	131.7 Å²	131.7	76%	0.764	77%	0.772	S	S	*	*			cis	-151.8	154.3	2.4	-151.6	78	0	0	0	112.4
701	S	33.2	Very low	33.2	Very low	104 Å²	104	133.7 Å²	133.7	73%	0.727	77%	0.771	S	S	*	*			trans	59.2	126.8	150.3	-67	0	0	0	0	124.5
702	I	32.4	Very low	33.4	Very low	154 Å²	154	134 Å²	134	79%	0.79	77%	0.77	S	S	*	*			trans	-95	163.6	148.6	-25.5	176.2	0	0	0	107.6
703	P	34.1	Very low	33.4	Very low	122 Å²	122	135.9 Å²	135.9	79%	0.792	78%	0.778	S	S	*	*				-153.3	163.3	91.4	39.1	-19.5	0	0	0	118.1
704	T	28.6	Very low	33.2	Very low	133 Å²	133	136 Å²	136	82%	0.816	78%	0.779	S	S	*	*			trans	-56.9	157.2	174.8	51.6	0	0	0	0	119
705	S	36.1	Very low	33.2	Very low	123 Å²	123	136.8 Å²	136.8	86%	0.86	78%	0.783	S	S	*	*			trans	-148.7	150.2	143	60.9	0	0	0	0	113.3
706	S	34.6	Very low	33.4	Very low	114 Å²	114	135 Å²	135	80%	0.797	78%	0.781	S	S	*	*			trans	-90.1	179.9	-161.7	43.1	0	0	0	0	116.3
707	P	40.1	Very low	33.5	Very low	113 Å²	113	135.2 Å²	135.2	73%	0.734	79%	0.791	S	S	*	*			trans	-105.3	-147.7	-160.8	44.3	-37.8	0	0	0	115.5
708	D	33.3	Very low	33.6	Very low	148 Å²	148	137.2 Å²	137.2	79%	0.791	80%	0.8	S	S	*	*			trans	83.3	146.6	-173.6	-50.7	-24.6	0	0	0	113.9
709	Q	35.2	Very low	33.6	Very low	189 Å²	189	135.5 Å²	135.5	88%	0.883	80%	0.799	S	S	*	*			cis	-138.3	-175.6	17.2	-70.1	179.3	0.3	0	0	113.7
710	C	25.3	Very low	33.9	Very low	120 Å²	120	136.1 Å²	136.1	81%	0.811	80%	0.804	S	S	*	*			trans	-60.1	166.8	172.5	-51.7	0	0	0	0	113.4
711	E	32.9	Very low	34.2	Very low	182 Å²	182	137.1 Å²	137.1	85%	0.85	81%	0.81	S	S	*	*				-159.2	169.8	51.3	-87.9	-165.1	137.3	0	0	113.7
712	P	34	Very low	33.9	Very low	118 Å²	118	139.4 Å²	139.4	77%	0.766	81%	0.814	S	S	*	*			trans	-88	161	177.2	36.6	-36.2	0	0	0	114
713	T	34.8	Very low	34.1	Very low	143 Å²	143	140.7 Å²	140.7	88%	0.877	82%	0.821	S	S	*	*			trans	-154.2	137.7	165.3	4.4	0	0	0	0	112.1
714	D	27.8	Very low	33.8	Very low	154 Å²	154	141.2 Å²	141.2	82%	0.824	82%	0.823	S	S	*	*			trans	-82.9	142.1	-178.5	-56.5	-83.2	0	0	0	113.5
715	I	35.6	Very low	34.1	Very low	171 Å²	171	140 Å²	140	88%	0.877	82%	0.82	S	S	*	*			trans	-137.6	111.7	154	-57.2	-177.3	0	0	0	109.2
716	S	35.4	Very low	34	Very low	96 Å²	96	139.3 Å²	139.3	67%	0.671	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-79.8	149.7	176.6	-56.2	0	0	0	0	112.5
717	P	37.4	Very low	34	Very low	132 Å²	132	138.4 Å²	138.4	86%	0.857	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-72.9	133.1	166.8	30.9	-33.1	0	0	0	110.9
718	L	35.9	Very low	33.7	Very low	173 Å²	173	138.1 Å²	138.1	91%	0.906	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-86.4	154.5	176.7	-80.3	163.7	0	0	0	112.5
719	S	34.2	Very low	33.7	Very low	96 Å²	96	139.2 Å²	139.2	67%	0.671	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-79.2	153.5	-178.4	50.8	0	0	0	0	113.7
720	P	39.8	Very low	33.7	Very low	127 Å²	127	134.7 Å²	134.7	83%	0.825	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-70.5	158	169.8	32	-35.6	0	0	0	112
721	L	36.9	Very low	34	Very low	167 Å²	167	136.2 Å²	136.2	87%	0.874	79%	0.794	S	S	*	*			trans	-123.5	133.7	174.4	-82.7	167.3	0	0	0	110.2
722	D	27.5	Very low	34.1	Very low	152 Å²	152	132.5 Å²	132.5	81%	0.813	79%	0.788	S	S	*	*			trans	-77.5	142.7	165.2	-71.2	-59	0	0	0	111
723	L	35.8	Very low	34	Very low	182 Å²	182	131.6 Å²	131.6	95%	0.953	79%	0.785	S	S	*	*			trans	-140.2	132.7	154.5	-82.1	-177.1	0	0	0	110.9
724	T	29.3	Very low	33.9	Very low	133 Å²	133	130.6 Å²	130.6	82%	0.816	78%	0.778	S	S	*	*			trans	-105.1	142.1	-173.2	54.8	0	0	0	0	112.4
725	S	33.8	Very low	34.2	Very low	108 Å²	108	130.2 Å²	130.2	76%	0.755	78%	0.776	S	S	*	*			trans	-163.6	117.8	154.8	50.1	0	0	0	0	113.8
726	S	34.9	Very low	34	Very low	108 Å²	108	126.8 Å²	126.8	76%	0.755	77%	0.767	S	S	*	*			trans	25.8	145.6	130.6	57.7	0	0	0	0	121.8
727	S	33.4	Very low	34	Very low	94 Å²	94	127.3 Å²	127.3	66%	0.657	77%	0.771	S	S	*	*			cis	-176.7	178.6	-7	53.5	0	0	0	0	111.6
728	T	34.2	Very low	34	Very low	107 Å²	107	129.6 Å²	129.6	66%	0.656	77%	0.77	S	S	*	*			trans	66.9	105.1	147.9	42.3	0	0	0	0	121.2
729	E	34.4	Very low	33.8	Very low	172 Å²	172	126.6 Å²	126.6	80%	0.804	76%	0.763	S	S	*	*				81	100.2	119.8	-70	173.4	-160.2	0	0	123.1
730	S	34.2	Very low	33.7	Very low	94 Å²	94	126.3 Å²	126.3	66%	0.657	77%	0.767	S	S	*	*				100.3	129.8	113.8	79.4	0	0	0	0	121.4
731	N	32.6	Very low	33.5	Very low	152 Å²	152	127.4 Å²	127.4	81%	0.813	77%	0.771	S	S	*	*			trans	52.9	122.4	141.5	-54.9	-18.4	0	0	0	118.8
732	S	33.6	Very low	33.2	Very low	104 Å²	104	126 Å²	126	73%	0.727	76%	0.764	S	S	*	*			cis	-177.8	161.1	42.5	43.1	0	0	0	0	112.8
733	S	33.4	Very low	33.2	Very low	99 Å²	99	126.4 Å²	126.4	69%	0.692	76%	0.761	S	S	*	*			trans	29.7	141.2	148.4	57.3	0	0	0	0	121.8
734	T	32.4	Very low	32.9	Very low	121 Å²	121	125.4 Å²	125.4	74%	0.742	76%	0.755	S	S	*	*			cis	-170.4	168.3	40.4	-15.4	0	0	0	0	113.6
735	L	33.6	Very low	33	Very low	147 Å²	147	129.3 Å²	129.3	77%	0.77	76%	0.761	S	S	*	*			trans	76.6	93.4	147.6	-75.4	160.2	0	0	0	122.8
736	S	32.2	Very low	32.7	Very low	99 Å²	99	134 Å²	134	69%	0.692	76%	0.763	S	S	*	*				51	132.9	125.4	62.9	0	0	0	0	121.7
737	S	34.7	Very low	32.3	Very low	107 Å²	107	134.7 Å²	134.7	75%	0.748	76%	0.759	S	S	*	*				-167.8	140.3	65.8	33.7	0	0	0	0	115.9
738	Q	36.4	Very low	32	Very low	180 Å²	180	139 Å²	139	84%	0.841	77%	0.773	S	S	*	*			trans	30.7	119.7	147.2	-64.2	168.3	-1.8	0	0	120.1
739	S	31.4	Very low	31.6	Very low	109 Å²	109	137.6 Å²	137.6	76%	0.762	77%	0.767	S	S	*	*				73.2	140	52.2	81.5	0	0	0	0	115.1
740	A	32.6	Very low	31.3	Very low	90 Å²	90	135 Å²	135	74%	0.744	77%	0.768	S	S	*	*			cis	-173.7	170.8	-11.5	0	0	0	0	0	110.1
741	T	35.7	Very low	31.1	Very low	150 Å²	150	134.6 Å²	134.6	92%	0.92	77%	0.765	S	S	*	*			trans	-161.9	154.7	152.8	4.5	0	0	0	0	110.5
742	N	30.5	Very low	30.9	Very low	137 Å²	137	133.9 Å²	133.9	73%	0.733	77%	0.772	S	S	*	*			trans	-151.5	160.8	-165.8	-150	-3.4	0	0	0	114.2
743	H	28.7	Very low	30.7	Very low	161 Å²	161	133 Å²	133	75%	0.745	77%	0.766	S	S	*	*			trans	36.3	111.1	165.9	-69.8	-75.3	0	0	0	121.9
744	I	28.4	Very low	30.6	Very low	162 Å²	162	133.1 Å²	133.1	83%	0.831	76%	0.762	S	S	*	*				-146.4	121.9	128.8	-53.8	-177.8	0	0	0	110.2
745	K	31.5	Very low	30.5	Very low	214 Å²	214	134 Å²	134	93%	0.93	76%	0.761	S	S	*	*			trans	-161	109.3	144.8	-124	169.4	-174.7	172	0	112.3
746	Y	28	Very low	30.5	Very low	206 Å²	206	130.9 Å²	130.9	81%	0.808	75%	0.752	S	S	*	*			trans	-109.8	166.2	-179.2	-116.1	-79.8	0	0	0	110.7
747	N	27.1	Very low	30.7	Very low	124 Å²	124	134.1 Å²	134.1	66%	0.663	75%	0.753	S	S	*	*			trans	44.6	108	155.8	-66.4	-22.3	0	0	0	119.4
748	I	27.1	Very low	30.7	Very low	184 Å²	184	134.7 Å²	134.7	94%	0.944	75%	0.752	S	S	*	*			trans	-96.9	78	156	-55.3	179.8	0	0	0	108.5
749	S	26	Very low	30.7	Very low	77 Å²	77	133.1 Å²	133.1	54%	0.538	75%	0.745	S	S	.	*	S	Bend	trans	-155	130.8	172.1	43.4	0	0	0	0	111.2
750	S	26.4	Very low	31	Very low	117 Å²	117	134.2 Å²	134.2	82%	0.818	74%	0.738	S	S	*	*			trans	40.7	96.7	163.7	55.6	0	0	0	0	118.8
751	S	31.1	Very low	31.1	Very low	86 Å²	86	136.8 Å²	136.8	60%	0.601	74%	0.739	S	S	*	*			trans	-166.5	88.6	152	31	0	0	0	0	113.6	S753	S751-S753 PolarHBondContact O-N 2.96Å
752	S	27.9	Very low	30.9	Very low	137 Å²	137	139.1 Å²	139.1	96%	0.958	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	63.8	163.9	54.8	0	0	0	0	110.8
753	S	29.6	Very low	31.2	Very low	85 Å²	85	137.4 Å²	137.4	59%	0.594	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-154.6	-3.1	-171.5	54.8	0	0	0	0	117	S751	S751-S753 PolarHBondContact O-N 2.96Å
754	V	30.3	Very low	31.5	Very low	102 Å²	102	135.8 Å²	135.8	62%	0.618	73%	0.727	S	S	*	*			trans	-108.7	-4.8	-166.9	-168.1	0	0	0	0	114.4	S756	V754-S756 PolarHBondContact O-N 3.5Å
755	I	31.7	Very low	31.8	Very low	139 Å²	139	132.2 Å²	132.2	71%	0.713	72%	0.723	S	S	*	*	G	3₁₀ helix	trans	-71.2	-16.9	-178.4	-65.2	176.3	0	0	0	112.6	K757	I755-K757 VanDerWaalsContact C-N 3.32Å; I755-K757 PolarHBondContact O-N 3.33Å
756	S	33.6	Very low	32.1	Very low	83 Å²	83	129.4 Å²	129.4	58%	0.58	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-77.9	3.8	-173.5	51.2	0	0	0	0	116.4	V754	V754-S756 PolarHBondContact O-N 3.5Å
757	K	36.7	Very low	32.6	Very low	167 Å²	167	127.7 Å²	127.7	73%	0.726	72%	0.715	S	S	*	*	G	3₁₀ helix	trans	-119.1	-2.9	-177.2	-75.3	-168.1	172.7	-174.4	0	116.8	I755	I755-K757 VanDerWaalsContact C-N 3.32Å; I755-K757 PolarHBondContact O-N 3.33Å
758	T	34.2	Very low	33	Very low	118 Å²	118	126.7 Å²	126.7	72%	0.724	72%	0.718	S	S	*	*	S	Bend	trans	-102.9	-4.5	172.4	32.8	0	0	0	0	114
759	Q	36.8	Very low	33.6	Very low	148 Å²	148	126 Å²	126	69%	0.692	71%	0.711	S	S	*	*	S	Bend	trans	-94.9	1.2	174.6	-68	-175.9	-56.8	0	0	114.3
760	Q	37.4	Very low	34.1	Very low	131 Å²	131	130 Å²	130	61%	0.612	73%	0.725	S	S	*	*	S	Bend	trans	-97.1	0.9	177.5	-78.4	-175.3	-43.3	0	0	114.8	N764	Q760-N764 PolarHBondContact O-ND2 3.44Å
761	L	33.8	Very low	34.4	Very low	145 Å²	145	132.3 Å²	132.3	76%	0.759	73%	0.729	S	S	*	*	S	Bend	trans	-115.4	12	-175.8	-67.8	176.4	0	0	0	114.5
762	F	32.8	Very low	34.7	Very low	199 Å²	199	136.6 Å²	136.6	87%	0.873	74%	0.739	S	S	*	*	S	Bend	trans	-123.5	6	171.6	-124.9	-95.2	0	0	0	113.7
763	T	35.8	Very low	35	Very low	100 Å²	100	139.7 Å²	139.7	61%	0.613	74%	0.736	S	S	*	*	S	Bend	trans	-120.6	47.6	-178.9	58.1	0	0	0	0	110.7
764	N	34.5	Very low	35.3	Very low	127 Å²	127	141.6 Å²	141.6	68%	0.679	74%	0.744	S	S	*	*	S	Bend	trans	-147.4	18.9	-178.1	-88.1	-55.4	0	0	0	112.7	Q760	Q760-N764 PolarHBondContact O-ND2 3.44Å
765	A	36	Very low	35.6	Very low	88 Å²	88	143.9 Å²	143.9	73%	0.727	75%	0.752	S	S	*	*	S	Bend	trans	-126.5	8.7	-169.1	0	0	0	0	0	114.9
766	I	37.6	Very low	35.7	Very low	155 Å²	155	143.2 Å²	143.2	80%	0.795	76%	0.757	S	S	*	*	S	Bend	trans	-127.9	-13.4	-175.6	-63.6	-178.5	0	0	0	112.7	S768	I766-S768 VanDerWaalsContact C-N 3.35Å; I766-S768 PolarHBondContact O-N 3.05Å
767	E	37.4	Very low	35.7	Very low	169 Å²	169	145.1 Å²	145.1	79%	0.79	77%	0.766	S	S	*	*	S	Bend	trans	-85.5	8.9	-175	-64.7	-171	132.2	0	0	115.4
768	S	37.1	Very low	35.6	Very low	104 Å²	104	142.7 Å²	142.7	73%	0.727	77%	0.765	S	S	*	*	S	Bend	trans	-104.9	26.3	-178.1	79.5	0	0	0	0	115.1	I766	I766-S768 VanDerWaalsContact C-N 3.35Å; I766-S768 PolarHBondContact O-N 3.05Å
769	Q	40.1	Very low	35.5	Very low	170 Å²	170	143.1 Å²	143.1	79%	0.794	77%	0.768	S	S	*	*	S	Bend	trans	-132.3	0.5	-178.6	-77.3	-73.1	-79.1	0	0	114.5
770	L	35.5	Very low	35	Very low	159 Å²	159	141 Å²	141	83%	0.832	77%	0.769	S	S	*	*			trans	-134.4	71.6	-176.9	-74.1	171.8	0	0	0	111.5
771	N	32.9	Very low	34.8	Very low	167 Å²	167	141.8 Å²	141.8	89%	0.893	78%	0.777	S	S	*	*			trans	-151.3	51.2	169.9	-109.1	-34.2	0	0	0	112
772	E	36.2	Very low	34.7	Very low	175 Å²	175	139.5 Å²	139.5	82%	0.818	78%	0.779	S	S	*	*			trans	-128.9	158.1	163.6	-100.1	-176.4	152.5	0	0	109.2
773	F	35.3	Very low	34.7	Very low	203 Å²	203	136.4 Å²	136.4	89%	0.89	78%	0.777	S	S	*	*			trans	68.5	64.1	-171.4	-62.4	-81.5	0	0	0	116.5
774	T	36.6	Very low	34.5	Very low	124 Å²	124	140.2 Å²	140.2	76%	0.761	79%	0.787	S	S	*	*			trans	-70.6	134.6	148.9	42	0	0	0	0	110.9
775	N	34.8	Very low	34.4	Very low	150 Å²	150	140.8 Å²	140.8	80%	0.802	79%	0.79	S	S	*	*			trans	154.4	116.8	145.3	-82.1	-30.9	0	0	0	112.8
776	P	34.5	Very low	34.2	Very low	126 Å²	126	145.7 Å²	145.7	82%	0.818	80%	0.795	S	S	*	*			trans	-116.2	119.2	166.7	34.4	-22.4	0	0	0	112.4
777	T	34.2	Very low	34	Very low	123 Å²	123	145.6 Å²	145.6	76%	0.755	79%	0.791	S	S	*	*			trans	-146.9	142.2	175.5	19	0	0	0	0	114.9
778	T	35.2	Very low	33.6	Very low	116 Å²	116	143.1 Å²	143.1	71%	0.712	78%	0.783	S	S	*	*			trans	66.5	127.2	153	48.8	0	0	0	0	122.5
779	T	31.9	Very low	33.5	Very low	127 Å²	127	146.4 Å²	146.4	78%	0.779	79%	0.787	S	S	*	*			trans	56.9	121	145.2	53.9	0	0	0	0	119.3
780	S	26	Very low	33.2	Very low	102 Å²	102	142.8 Å²	142.8	71%	0.713	78%	0.781	S	S	*	*			cis	83	137.4	50	-156.4	0	0	0	0	114.6
781	D	31.9	Very low	33.1	Very low	148 Å²	148	142.2 Å²	142.2	79%	0.791	78%	0.777	S	S	*	*			trans	92.7	142.6	164.9	-59.5	11.8	0	0	0	119.6
782	A	32.8	Very low	32.8	Very low	97 Å²	97	142.4 Å²	142.4	80%	0.802	77%	0.773	S	S	*	*			trans	68.1	143.1	164.8	0	0	0	0	0	119.1
783	V	32.9	Very low	32.6	Very low	135 Å²	135	139.7 Å²	139.7	82%	0.818	77%	0.773	S	S	*	*			cis	-154.6	169.7	-16.7	111.3	0	0	0	0	109.6
784	Q	30.5	Very low	32.3	Very low	179 Å²	179	135.9 Å²	135.9	84%	0.836	77%	0.772	S	S	*	*			trans	-79	-159.1	176.7	-63.1	-179.8	-42.3	0	0	113.2
785	L	32.9	Very low	32	Very low	140 Å²	140	137.6 Å²	137.6	73%	0.733	78%	0.775	S	S	*	*			trans	90.4	137.4	-177.7	-51.8	175.4	0	0	0	113.8
786	F	32.3	Very low	31.6	Very low	191 Å²	191	138 Å²	138	84%	0.838	78%	0.777	S	S	*	*			cis	-134.9	179.7	3.1	-116.1	-61.5	0	0	0	112.8
787	E	32.5	Very low	31.6	Very low	152 Å²	152	139.7 Å²	139.7	71%	0.71	78%	0.778	S	S	*	*			trans	-110	160.7	-165.1	-92.7	-169.2	110.6	0	0	115.1
788	N	28.8	Very low	31.5	Very low	117 Å²	117	140.1 Å²	140.1	63%	0.626	78%	0.776	S	S	*	*			trans	44.2	129	142.1	-54.2	-28.2	0	0	0	121.9
789	H	36	Very low	31.3	Very low	174 Å²	174	143.3 Å²	143.3	81%	0.806	78%	0.782	S	S	*	*				-171.8	131.1	118.5	-98.4	-60.6	0	0	0	109
790	S	32.8	Very low	31.3	Very low	94 Å²	94	145.5 Å²	145.5	66%	0.657	78%	0.784	S	S	*	*				66.6	137.4	86	-59.4	0	0	0	0	114.3
791	L	33.4	Very low	31.5	Very low	146 Å²	146	149.7 Å²	149.7	76%	0.764	79%	0.789	S	S	*	*			cis	-156	-174.9	5	-120.3	168.7	0	0	0	111.8
792	E	28	Very low	31.6	Very low	171 Å²	171	149.6 Å²	149.6	80%	0.799	79%	0.787	S	S	*	*			trans	-59.9	148.4	-174.9	-59.6	153.9	142.6	0	0	115.9
793	S	32.2	Very low	31.3	Very low	118 Å²	118	151.8 Å²	151.8	83%	0.825	79%	0.785	S	S	*	*				177.5	165.2	114.5	44.6	0	0	0	0	111.7
794	S	27.2	Very low	31.3	Very low	123 Å²	123	152.7 Å²	152.7	86%	0.86	79%	0.785	S	S	*	*			trans	-133	125.3	-175.2	-53	0	0	0	0	111.8
795	I	31.8	Very low	31.2	Very low	161 Å²	161	150 Å²	150	83%	0.826	79%	0.786	S	S	*	*			trans	-138.6	126	168.1	-58	-178.8	0	0	0	107.8
796	N	26.2	Very low	31.2	Very low	159 Å²	159	151.1 Å²	151.1	85%	0.85	79%	0.791	S	S	*	*			trans	-83.1	142.5	165.9	-69.8	-42	0	0	0	109.3
797	L	35.2	Very low	31	Very low	160 Å²	160	145.3 Å²	145.3	84%	0.838	79%	0.785	S	S	*	*			trans	-165.6	160.2	144.7	-106.2	156.5	0	0	0	109.6
798	D	31.7	Very low	31.1	Very low	132 Å²	132	144.4 Å²	144.4	71%	0.706	79%	0.789	S	S	*	*			trans	-97.9	165	-156.8	-52.7	-91.6	0	0	0	115.6
799	H	30	Very low	31.3	Very low	183 Å²	183	145 Å²	145	85%	0.847	80%	0.797	S	S	*	*			trans	78.4	157.6	154.1	-77.7	-72.1	0	0	0	121.9
800	E	33	Very low	31	Very low	174 Å²	174	143.8 Å²	143.8	81%	0.813	79%	0.792	S	S	*	*			trans	67	79.5	164.6	-65.9	-171.1	144.7	0	0	121.7
801	K	30.3	Very low	31	Very low	189 Å²	189	145.6 Å²	145.6	82%	0.822	80%	0.801	S	S	*	*				31.7	101.6	119.2	-170	-168.2	179.4	-173.9	0	117.8
802	I	32.8	Very low	30.7	Very low	147 Å²	147	145.9 Å²	145.9	75%	0.754	80%	0.801	S	S	*	*			trans	-134.1	123.7	154.1	-60.2	-179.8	0	0	0	108.7	L804	I802-L804 HydrophobicContact CG2-CD1 4.25Å; I802-L804 HydrophobicContact CG2-CG 4.18Å
803	D	26.6	Very low	31	Very low	143 Å²	143	145.3 Å²	145.3	77%	0.765	80%	0.801	S	S	*	*			trans	-86.6	131.8	167.2	-74.1	-64.7	0	0	0	109.6
804	L	33.2	Very low	31.1	Very low	153 Å²	153	145.9 Å²	145.9	80%	0.801	80%	0.795	S	S	*	*			trans	-136.7	102	174.7	-92.7	166.9	0	0	0	110.4	I802	I802-L804 HydrophobicContact CG2-CD1 4.25Å; I802-L804 HydrophobicContact CG2-CG 4.18Å
805	S	28	Very low	31.4	Very low	123 Å²	123	148.7 Å²	148.7	86%	0.86	79%	0.792	S	S	*	*			trans	-91.7	130.6	174	53.5	0	0	0	0	111.3
806	I	33.8	Very low	31.5	Very low	163 Å²	163	146.4 Å²	146.4	84%	0.836	79%	0.786	S	S	*	*			trans	-124	130.1	171.5	-59.1	176.3	0	0	0	107
807	G	28.5	Very low	31.7	Very low	69 Å²	69	145 Å²	145	71%	0.711	78%	0.778	S	S	*	*			trans	-129.8	164	-174.4	0	0	0	0	0	113.5
808	V	33.5	Very low	31.7	Very low	133 Å²	133	146 Å²	146	81%	0.806	78%	0.779	S	S	*	*			trans	-139.1	112.3	-178.9	178.3	0	0	0	0	111.1
809	T	33.4	Very low	31.8	Very low	129 Å²	129	146.7 Å²	146.7	79%	0.791	78%	0.782	S	S	*	*			trans	24.5	132.8	154.3	60	0	0	0	0	123
810	Q	29.7	Very low	31.9	Very low	149 Å²	149	148.1 Å²	148.1	70%	0.696	79%	0.786	S	S	*	*			trans	-78.3	178	156.4	-63	178.5	-27.6	0	0	112.4
811	P	33.5	Very low	31.8	Very low	132 Å²	132	144.6 Å²	144.6	86%	0.857	78%	0.781	S	S	*	*				-128.7	165.2	112.9	37.8	-32.8	0	0	0	114.6
812	M	26.4	Very low	31.9	Very low	152 Å²	152	142.3 Å²	142.3	75%	0.749	78%	0.778	S	S	*	*			trans	-108.3	168.7	-179.6	-69	-174.3	162.8	0	0	112.8
813	I	34.5	Very low	31.8	Very low	159 Å²	159	142.2 Å²	142.2	82%	0.815	78%	0.779	S	S	*	*			trans	-161.5	126.4	134.9	-97.5	145.2	0	0	0	110.8
814	N	32.9	Very low	32.1	Very low	130 Å²	130	140.7 Å²	140.7	70%	0.695	78%	0.779	S	S	*	*			trans	22.3	125.7	151.5	-54.3	-20.9	0	0	0	120.7
815	K	34.2	Very low	31.9	Very low	183 Å²	183	142.3 Å²	142.3	80%	0.796	78%	0.782	S	S	*	*				63.9	139	76.8	-67.1	-170.7	173.5	-164.1	0	113.9
816	T	33.3	Very low	32.2	Very low	113 Å²	113	142 Å²	142	69%	0.693	78%	0.775	S	S	*	*			cis	-146.3	139.7	30.6	47.7	0	0	0	0	114.6
817	D	30.8	Very low	32.1	Very low	129 Å²	129	140.1 Å²	140.1	69%	0.69	77%	0.767	S	S	*	*				46.4	170.4	120.8	-40.8	-43.1	0	0	0	124
818	E	35.8	Very low	32.1	Very low	182 Å²	182	143.4 Å²	143.4	85%	0.85	77%	0.767	S	S	*	*			trans	90.4	114.5	175.9	-58	-57	127.8	0	0	119.8
819	D	33.5	Very low	32	Very low	146 Å²	146	143.5 Å²	143.5	78%	0.781	76%	0.762	S	S	*	*			trans	-65.9	151.8	-175.4	-65.8	-50.3	0	0	0	115.7
820	F	33.1	Very low	32	Very low	213 Å²	213	145 Å²	145	93%	0.934	77%	0.766	S	S	*	*			trans	-157.9	117.9	131.4	-109.4	-69.2	0	0	0	111.8
821	S	29.5	Very low	32.2	Very low	99 Å²	99	144.8 Å²	144.8	69%	0.692	77%	0.768	S	S	*	*			trans	-89.6	136.2	174.5	61.5	0	0	0	0	112
822	N	33.6	Very low	32.2	Very low	141 Å²	141	149.2 Å²	149.2	75%	0.754	77%	0.769	S	S	*	*			trans	-170.3	118.7	141.3	-106	-53.7	0	0	0	114.6
823	N	29.9	Very low	32.5	Very low	145 Å²	145	151.2 Å²	151.2	78%	0.775	77%	0.77	S	S	*	*			trans	36.8	101.3	140.2	-65.7	-45.5	0	0	0	120.7
824	S	32.9	Very low	32.4	Very low	111 Å²	111	151.6 Å²	151.6	78%	0.776	77%	0.768	S	S	*	*				-145.3	128.3	128.9	62.6	0	0	0	0	111.1	V826	S824-V826 PolarHBondContact O-N 3.18Å
825	H	29.9	Very low	32.4	Very low	188 Å²	188	149.9 Å²	149.9	87%	0.87	76%	0.764	S	S	*	*			trans	-97.5	82.8	-169.3	-146.6	-56.8	0	0	0	110.2
826	V	33.8	Very low	32.3	Very low	116 Å²	116	145 Å²	145	70%	0.703	75%	0.753	S	S	*	*			trans	-81.3	130.6	176.4	-177.6	0	0	0	0	109.9	S824 I828	S824-V826 PolarHBondContact O-N 3.18Å; V826-I828 PolarHBondContact O-N 3.26Å
827	N	30.5	Very low	32.3	Very low	124 Å²	124	148.7 Å²	148.7	66%	0.663	76%	0.759	S	S	*	*			trans	-86.7	111.6	-174.3	-160.8	63.7	0	0	0	111	D829	N827-D829 PolarHBondContact ND2-OD2 3.27Å; N827-D829 PolarHBondContact O-N 3.32Å
828	I	29.7	Very low	32.5	Very low	138 Å²	138	149.8 Å²	149.8	71%	0.708	76%	0.764	S	S	*	*			trans	-88.3	84.8	-174.5	-52.7	175.3	0	0	0	110	V826	V826-I828 PolarHBondContact O-N 3.26Å
829	D	30.5	Very low	32.5	Very low	135 Å²	135	149.8 Å²	149.8	72%	0.722	76%	0.761	S	S	*	*			trans	-144.7	33.3	178.3	-89.7	-46.5	0	0	0	112.7	N827	N827-D829 PolarHBondContact ND2-OD2 3.27Å; N827-D829 PolarHBondContact O-N 3.32Å
830	D	33.7	Very low	32.7	Very low	161 Å²	161	148.3 Å²	148.3	86%	0.861	76%	0.759	S	S	*	*			trans	-138.9	0.6	-179	-108.5	-37.3	0	0	0	115.4	Y832	D830-Y832 PolarHBondContact O-N 3.21Å
831	I	33.4	Very low	32.7	Very low	144 Å²	144	147.3 Å²	147.3	74%	0.738	76%	0.758	S	S	*	*			trans	-102.7	66.8	-171.9	-45.9	179.1	0	0	0	111.7
832	Y	33.6	Very low	33	Very low	224 Å²	224	147.6 Å²	147.6	88%	0.878	76%	0.76	S	S	*	*	S	Bend	trans	-165.4	71.8	162.5	-108.5	-66.4	0	0	0	113.4	D830	D830-Y832 PolarHBondContact O-N 3.21Å
833	Y	33.1	Very low	32.7	Very low	195 Å²	195	148.4 Å²	148.4	77%	0.765	76%	0.764	S	S	*	*			trans	179.6	86.7	142.1	-112.3	-75	0	0	0	112.3
834	Q	33.4	Very low	32.8	Very low	166 Å²	166	149.6 Å²	149.6	78%	0.776	77%	0.768	S	S	*	*			trans	-141.6	123.9	154.2	-79.3	-151.9	25.5	0	0	111.3	S836	Q834-S836 PolarHBondContact OE1-OG 2.83Å
835	P	32.7	Very low	32.6	Very low	94 Å²	94	150.7 Å²	150.7	61%	0.61	76%	0.764	S	S	*	*			trans	-116.7	80.3	146.2	34.2	-24	0	0	0	108.4	F837	P835-F837 HydrophobicContact CB-CD2 4.11Å; P835-F837 HydrophobicContact CB-CE2 4.05Å; P835-F837 PolarHBondContact O-N 3.39Å
836	S	31.7	Very low	32.6	Very low	81 Å²	81	148.6 Å²	148.6	57%	0.566	76%	0.758	S	S	*	*			trans	-72.9	76.4	176.3	23.8	0	0	0	0	110.4	Q834 I838	Q834-S836 PolarHBondContact OE1-OG 2.83Å; S836-I838 VanDerWaalsContact C-N 3.3Å; S836-I838 PolarHBondContact O-N 3.33Å
837	F	33.5	Very low	32.5	Very low	190 Å²	190	150.3 Å²	150.3	83%	0.833	76%	0.763	S	S	*	*			trans	-67.7	84.9	174.8	-85.5	-78.8	0	0	0	111.4	P835 K839	P835-F837 HydrophobicContact CB-CD2 4.11Å; P835-F837 HydrophobicContact CB-CE2 4.05Å; P835-F837 PolarHBondContact O-N 3.39Å; F837-K839 PolarHBondContact O-N 3.38Å
838	I	35	Very low	32.3	Very low	152 Å²	152	149.6 Å²	149.6	78%	0.779	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-62.8	120.6	162.1	-60.7	171.5	0	0	0	107.3	S836	S836-I838 VanDerWaalsContact C-N 3.3Å; S836-I838 PolarHBondContact O-N 3.33Å
839	K	35.2	Very low	32.6	Very low	183 Å²	183	148.6 Å²	148.6	80%	0.796	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-85.8	123.2	162.8	-73.6	-177	175.1	-176.4	0	108.4	F837	F837-K839 PolarHBondContact O-N 3.38Å
840	P	37.8	Very low	32.7	Very low	115 Å²	115	149.9 Å²	149.9	75%	0.747	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-75.7	129.9	158.9	30.9	-30.3	0	0	0	109.1
841	E	33.2	Very low	32.9	Very low	192 Å²	192	147.5 Å²	147.5	90%	0.897	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-95.1	117	161.7	-68.1	-179.5	145.8	0	0	107.7
842	S	35.2	Very low	32.8	Very low	105 Å²	105	146.3 Å²	146.3	73%	0.734	77%	0.773	S	S	*	*			trans	-166.7	144.4	161.4	44.8	0	0	0	0	110.6
843	D	28.6	Very low	32.5	Very low	158 Å²	158	144.6 Å²	144.6	85%	0.845	78%	0.775	S	S	*	*			trans	-89.7	125.7	-167.7	-48.3	-88.5	0	0	0	112.8
844	I	32.3	Very low	32.6	Very low	169 Å²	169	142.9 Å²	142.9	87%	0.867	78%	0.775	S	S	*	*			trans	-134	119.1	159.5	-59.3	-176.3	0	0	0	109.5
845	I	28.3	Very low	32.6	Very low	134 Å²	134	141.2 Å²	141.2	69%	0.687	77%	0.771	S	S	*	*			trans	-86.3	153.9	175.6	-49.9	169.6	0	0	0	108.5
846	I	29.9	Very low	32.2	Very low	145 Å²	145	143.2 Å²	143.2	74%	0.744	79%	0.785	S	S	*	*			trans	158.6	127.9	132	-81.5	160.9	0	0	0	113.5
847	N	30.6	Very low	32.3	Very low	152 Å²	152	148.2 Å²	148.2	81%	0.813	80%	0.797	S	S	*	*			trans	51.8	115.9	157.6	-62.7	-8.1	0	0	0	121.6
848	S	27.2	Very low	32.2	Very low	109 Å²	109	145.5 Å²	145.5	76%	0.762	80%	0.796	S	S	*	*			trans	-78.3	148.1	158.1	49.3	0	0	0	0	112.1
849	S	34.9	Very low	32.1	Very low	116 Å²	116	143.2 Å²	143.2	81%	0.811	79%	0.794	S	S	*	*			trans	-154.7	118.9	165	-80.6	0	0	0	0	109.5
850	I	33.3	Very low	32	Very low	163 Å²	163	140.2 Å²	140.2	84%	0.836	79%	0.791	S	S	*	*			trans	-106.5	116.3	-173.5	-60.2	173	0	0	0	109.4
851	P	37.2	Very low	31.8	Very low	111 Å²	111	145 Å²	145	72%	0.721	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-77.3	149.1	169.3	31.5	-32.8	0	0	0	111.8
852	P	32.8	Very low	31.8	Very low	119 Å²	119	146.2 Å²	146.2	77%	0.773	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-86.5	149.1	-169.7	33.9	-36.2	0	0	0	114.1
853	M	26.2	Very low	31.7	Very low	187 Å²	187	146.1 Å²	146.1	92%	0.921	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-81.4	140	164.3	-66.5	-153.7	79.8	0	0	111.7
854	Q	36.4	Very low	31.9	Very low	160 Å²	160	149.6 Å²	149.6	75%	0.748	79%	0.791	S	S	*	*			trans	-146	149.3	167.2	-86.6	-155.5	13.4	0	0	114.4
855	N	32	Very low	32	Very low	131 Å²	131	150.9 Å²	150.9	70%	0.701	79%	0.79	S	S	*	*			trans	72.5	84.1	153	-57.6	-29.5	0	0	0	120.3
856	C	24.6	Very low	31.9	Very low	135 Å²	135	150 Å²	150	91%	0.912	80%	0.795	S	S	*	*			trans	-81.9	133.7	150.6	-64.2	0	0	0	0	111.9
857	K	33.4	Very low	32	Very low	187 Å²	187	151.3 Å²	151.3	81%	0.813	80%	0.803	S	S	*	*			trans	-154.1	152.1	161.2	-68	-173	-176.5	170.9	0	109.3
858	T	31.8	Very low	32	Very low	132 Å²	132	148.9 Å²	148.9	81%	0.81	80%	0.797	S	S	*	*			cis	-169.3	131.4	-29.6	32.8	0	0	0	0	107.5
859	S	32.3	Very low	32.3	Very low	105 Å²	105	151.3 Å²	151.3	73%	0.734	80%	0.8	S	S	*	*			trans	-159.2	125.1	155	-170.5	0	0	0	0	113.4
860	T	34.4	Very low	32.1	Very low	119 Å²	119	151.5 Å²	151.5	73%	0.73	80%	0.796	S	S	*	*			trans	28.3	143	149.3	68.8	0	0	0	0	121.6
861	R	32.9	Very low	32.2	Very low	216 Å²	216	152.3 Å²	152.3	82%	0.815	79%	0.794	S	S	*	*			cis	-161.2	153.3	5.5	-128.8	170.3	179.2	-179.5	0.6	111.1
862	R	33.3	Very low	32	Very low	217 Å²	217	158.1 Å²	158.1	82%	0.819	80%	0.801	S	S	*	*			trans	75.5	96.7	159.8	-66.8	-179	168.7	163	-3.7	121
863	S	32.4	Very low	31.8	Very low	104 Å²	104	156.1 Å²	156.1	73%	0.727	79%	0.791	S	S	*	*			trans	68.8	140.8	130.8	59.7	0	0	0	0	121.6
864	R	33.7	Very low	32.2	Very low	230 Å²	230	155.6 Å²	155.6	87%	0.868	79%	0.786	S	S	*	*			cis	-164.8	151.9	-2.7	-115.6	168.7	-179.8	164.8	-2.2	110.4
865	K	34.6	Very low	32	Very low	196 Å²	196	153.2 Å²	153.2	85%	0.852	79%	0.787	S	S	*	*			trans	68	109.9	178.6	-54.7	-178.6	178.8	-176.1	0	113.5
866	C	26.6	Very low	32.2	Very low	116 Å²	116	152 Å²	152	78%	0.784	79%	0.786	S	S	*	*			cis	75.2	105.8	17	-37.3	0	0	0	0	116.2
867	L	32.1	Very low	32.6	Very low	173 Å²	173	152.3 Å²	152.3	91%	0.906	78%	0.779	S	S	*	*				-173.1	160	109.5	-99.3	157.4	0	0	0	111.5
868	S	30.2	Very low	32.4	Very low	100 Å²	100	150.6 Å²	150.6	70%	0.699	77%	0.772	S	S	*	*			trans	-143.5	171.6	-168.4	54.2	0	0	0	0	110.9
869	I	33.1	Very low	32.4	Very low	160 Å²	160	151 Å²	151	82%	0.821	77%	0.765	S	S	*	*			trans	170.4	159.2	142	-89.7	153.2	0	0	0	111
870	T	30.9	Very low	32.4	Very low	120 Å²	120	151.9 Å²	151.9	74%	0.736	76%	0.761	S	S	*	*			trans	-131.1	165.6	-166.9	53.1	0	0	0	0	113.3
871	K	34.8	Very low	32.4	Very low	181 Å²	181	155.7 Å²	155.7	79%	0.787	77%	0.767	S	S	*	*			trans	144.9	139.3	135.9	-80.9	169.4	-178.7	180	0	115.8
872	R	33.4	Very low	32.5	Very low	232 Å²	232	151.7 Å²	151.7	88%	0.875	76%	0.762	S	S	*	*			trans	56.4	157.2	134.6	-74.8	-170.3	-178.3	-175.3	-2.5	121.6
873	S	29.6	Very low	32.5	Very low	78 Å²	78	150.1 Å²	150.1	55%	0.545	76%	0.761	S	S	.	*			cis	-171.8	179.1	-28.2	43.5	0	0	0	0	110
874	E	33.4	Very low	32.5	Very low	175 Å²	175	150.6 Å²	150.6	82%	0.818	76%	0.76	S	S	*	*			trans	76.8	157.7	165.9	-72	123.6	-107.1	0	0	121.6
875	S	31.9	Very low	32.5	Very low	110 Å²	110	147 Å²	147	77%	0.769	75%	0.753	S	S	*	*			trans	-152.1	-165	-176.6	63.3	0	0	0	0	107
876	P	36.9	Very low	32.4	Very low	107 Å²	107	143.2 Å²	143.2	70%	0.695	74%	0.742	S	S	*	*			cis	-138.6	-164.6	-5.3	33.2	-8.5	0	0	0	115.2
877	N	32.2	Very low	32.5	Very low	140 Å²	140	145.4 Å²	145.4	75%	0.749	75%	0.745	S	S	*	*				103.5	155.7	129.6	-118.1	5.7	0	0	0	124.3
878	F	30.9	Very low	32.5	Very low	151 Å²	151	144.2 Å²	144.2	66%	0.662	74%	0.738	S	S	*	*			trans	94.1	104	158	-94.8	-121.8	0	0	0	123.5
879	E	31.8	Very low	32.3	Very low	142 Å²	142	144.6 Å²	144.6	66%	0.664	74%	0.741	S	S	*	*				73.8	137.1	127	-71.2	-178.6	172.9	0	0	126.1
880	D	32.1	Very low	32.2	Very low	122 Å²	122	146.2 Å²	146.2	65%	0.652	74%	0.743	S	S	*	*			trans	53.1	123.4	145	-65.2	5.7	0	0	0	124.2
881	F	33.2	Very low	32.3	Very low	199 Å²	199	146.2 Å²	146.2	87%	0.873	74%	0.743	S	S	*	*				-163.6	170.2	85.7	-119.2	-92.3	0	0	0	113.5
882	L	35.7	Very low	32.1	Very low	133 Å²	133	146 Å²	146	70%	0.696	75%	0.745	S	S	*	*			trans	-115.3	149.2	-162.4	-84.1	169.7	0	0	0	115.8
883	K	33.2	Very low	32	Very low	183 Å²	183	142.6 Å²	142.6	80%	0.796	74%	0.744	S	S	*	*			trans	65.1	159.1	158	-58.9	160.5	-178.6	178	0	114.6
884	T	33.3	Very low	32.1	Very low	115 Å²	115	145.9 Å²	145.9	71%	0.706	76%	0.755	S	S	*	*			cis	-155.4	150.3	33.3	39.2	0	0	0	0	113.7
885	Q	33.5	Very low	32.1	Very low	154 Å²	154	142 Å²	142	72%	0.72	75%	0.746	S	S	*	*			trans	69.8	119.5	137.6	-69.9	-175.5	-93.5	0	0	124.1
886	D	32	Very low	32.2	Very low	117 Å²	117	144.8 Å²	144.8	63%	0.626	75%	0.751	S	S	*	*				75.4	110.2	118.6	-49.2	-5.3	0	0	0	122.6
887	D	28.5	Very low	31.7	Very low	161 Å²	161	143.4 Å²	143.4	86%	0.861	74%	0.744	S	S	*	*				43.2	88.6	122.5	-61.5	-1.3	0	0	0	120.2
888	I	32.5	Very low	31.8	Very low	148 Å²	148	146.2 Å²	146.2	76%	0.759	75%	0.749	S	S	*	*			trans	-132.1	120.6	142.8	-59.5	-177.3	0	0	0	109.4	F890	I888-F890 HydrophobicContact CG2-CD2 4.05Å; I888-F890 HydrophobicContact CG2-CE2 3.89Å
889	S	25.4	Very low	31.6	Very low	109 Å²	109	144.3 Å²	144.3	76%	0.762	74%	0.742	S	S	*	*			trans	-79	143.9	173.1	51	0	0	0	0	111.8
890	F	32.2	Very low	31.6	Very low	193 Å²	193	145.5 Å²	145.5	85%	0.846	75%	0.748	S	S	*	*			trans	-132.8	143	164.9	-97	-81.8	0	0	0	110.7	I888	I888-F890 HydrophobicContact CG2-CD2 4.05Å; I888-F890 HydrophobicContact CG2-CE2 3.89Å
891	T	31.5	Very low	31.4	Very low	121 Å²	121	146 Å²	146	74%	0.742	74%	0.744	S	S	*	*			trans	-94.1	167.3	-157.1	52.8	0	0	0	0	114.8
892	E	31.6	Very low	31.1	Very low	177 Å²	177	146.2 Å²	146.2	83%	0.827	74%	0.74	S	S	*	*			trans	-44.5	151.1	172.1	-55.3	160.8	128.2	0	0	114.4
893	N	31.4	Very low	30.7	Very low	160 Å²	160	144.9 Å²	144.9	86%	0.856	73%	0.733	S	S	*	*			trans	-159.6	78.6	152.1	-94.1	-77.8	0	0	0	109.3
894	D	30.7	Very low	30.5	Very low	146 Å²	146	142.2 Å²	142.2	78%	0.781	73%	0.728	S	S	*	*				21.3	161.9	119.2	-139.4	46.7	0	0	0	120.6
895	P	33.9	Very low	30.3	Very low	95 Å²	95	144.8 Å²	144.8	62%	0.617	74%	0.737	S	S	*	*				-122.8	163.9	-59.8	35.8	-25.2	0	0	0	111.6
896	L	33.4	Very low	30	Very low	167 Å²	167	140.6 Å²	140.6	87%	0.874	74%	0.735	S	S	*	*			trans	-153.5	104.4	163.8	-115.6	137	0	0	0	115.7	K898	L896-K898 PolarHBondContact O-N 3.46Å
897	S	27.5	Very low	29.8	Very low	79 Å²	79	142.2 Å²	142.2	55%	0.552	74%	0.744	S	S	*	*			trans	-56.7	124.1	166.1	176.1	0	0	0	0	111.2	H899	S897-H899 PolarHBondContact OG-CD2 3.49Å; S897-H899 VanDerWaalsContact OG-CD2 3.31Å
898	K	32.6	Very low	29.7	Very low	199 Å²	199	140.7 Å²	140.7	87%	0.865	74%	0.736	S	S	*	*			trans	-95.9	82.3	164.3	-81.2	-178.4	177.8	169.5	0	110.2	L896 H900	L896-K898 PolarHBondContact O-N 3.46Å; K898-H900 PolarHBondContact O-N 3.4Å
899	H	27.9	Very low	29.6	Very low	111 Å²	111	140.4 Å²	140.4	51%	0.514	73%	0.731	S	S	.	*			trans	-56.2	130.9	156.2	-79.1	-90.8	0	0	0	109.7	S897 F901	S897-H899 PolarHBondContact OG-CD2 3.49Å; S897-H899 VanDerWaalsContact OG-CD2 3.31Å; H899-F901 HydrophobicContact CB-CD2 4.43Å; H899-F901 AromaticContact CE1-CE2 3.95Å; H899-F901 AromaticContact ND1-CD2 3.72Å; H899-F901 AromaticContact ND1-CE2 3.38Å; H899-F901 WeakPolarHBondContact ND1-CE2 3.45Å
900	H	30.9	Very low	29.8	Very low	167 Å²	167	141.7 Å²	141.7	77%	0.773	73%	0.729	S	S	*	*			trans	-129.9	80.9	152.2	-105.7	-64.9	0	0	0	109.1	K898	K898-H900 PolarHBondContact O-N 3.4Å
901	F	27.9	Very low	29.7	Very low	132 Å²	132	137.4 Å²	137.4	58%	0.579	72%	0.723	S	S	*	*			trans	-61	134.8	155.6	-80.3	-85.4	0	0	0	109.1	A536 H899	A536-F901 HydrophobicContact CB-CE1 3.57Å; A536-F901 HydrophobicContact CB-CZ 3.56Å; H899-F901 HydrophobicContact CB-CD2 4.43Å; H899-F901 AromaticContact CE1-CE2 3.95Å; H899-F901 AromaticContact ND1-CD2 3.72Å; H899-F901 AromaticContact ND1-CE2 3.38Å; H899-F901 WeakPolarHBondContact ND1-CE2 3.45Å
902	Y	28.2	Very low	29.7	Very low	203 Å²	203	135.6 Å²	135.6	80%	0.796	72%	0.715	S	S	*	*			trans	-150.1	87.4	151.6	-102	-71.8	0	0	0	108.5
903	L	27.5	Very low	29.7	Very low	105 Å²	105	133.7 Å²	133.7	55%	0.55	71%	0.711	S	S	.	*			trans	-94.2	141.3	142.7	-79.9	174.3	0	0	0	107.5
904	D	27.4	Very low	29.7	Very low	127 Å²	127	132.4 Å²	132.4	68%	0.679	70%	0.704	S	S	*	*			trans	39.3	111.9	151.3	-46.4	-33	0	0	0	118.3
905	N	30.1	Very low	29.9	Very low	169 Å²	169	134.6 Å²	134.6	90%	0.904	71%	0.706	S	S	*	*				-153.5	143	106.1	-99.9	-69.7	0	0	0	109.5
906	G	28.1	Very low	29.8	Very low	66 Å²	66	135.9 Å²	135.9	68%	0.68	71%	0.713	S	S	*	*			trans	-97.9	-147.7	-172.3	0	0	0	0	0	114.3
907	N	26.7	Very low	29.8	Very low	151 Å²	151	133.7 Å²	133.7	81%	0.807	71%	0.706	S	S	*	*			trans	72.7	140.7	171.6	-62.3	-1.3	0	0	0	118.4
908	D	27.3	Very low	30	Very low	130 Å²	130	135.8 Å²	135.8	70%	0.695	72%	0.716	S	S	*	*			trans	68.5	127.6	152.3	-68.9	-38	0	0	0	120.2
909	H	30.5	Very low	29.8	Very low	142 Å²	142	133.7 Å²	133.7	66%	0.657	71%	0.713	S	S	*	*			cis	-162.9	142	27.2	-121.8	3.8	0	0	0	113.7
910	L	28.5	Very low	30.1	Very low	136 Å²	136	138.7 Å²	138.7	71%	0.712	73%	0.734	S	S	*	*			trans	51.1	115.2	133.9	-68.7	171.4	0	0	0	121.7
911	S	29.7	Very low	30.1	Very low	102 Å²	102	136.5 Å²	136.5	71%	0.713	74%	0.737	S	S	*	*				72.1	122.1	113.6	-163.6	0	0	0	0	120.1
912	S	31.6	Very low	30.5	Very low	84 Å²	84	135.2 Å²	135.2	59%	0.587	74%	0.742	S	S	*	*				175.1	138.2	87.9	44.7	0	0	0	0	113.7
913	N	32.9	Very low	30.6	Very low	137 Å²	137	134.3 Å²	134.3	73%	0.733	74%	0.738	S	S	*	*				169.7	100.8	115.2	-86.9	-58.8	0	0	0	110
914	N	31.7	Very low	30.8	Very low	132 Å²	132	138.7 Å²	138.7	71%	0.706	75%	0.748	S	S	*	*				74.2	106.9	78.9	-75.2	-43.3	0	0	0	114.4
915	K	34.5	Very low	31.2	Very low	193 Å²	193	143.3 Å²	143.3	84%	0.839	76%	0.756	S	S	*	*			trans	-160.8	114.3	131.9	-110.4	164	-173.8	177.6	0	112.3
916	T	32	Very low	31.4	Very low	122 Å²	122	145.4 Å²	145.4	75%	0.748	75%	0.751	S	S	*	*			trans	57.8	134.2	139.6	54.8	0	0	0	0	119.6
917	T	32.2	Very low	31.7	Very low	121 Å²	121	151.7 Å²	151.7	74%	0.742	75%	0.754	S	S	*	*			cis	-161	153	7.9	0.5	0	0	0	0	109.1
918	T	31.9	Very low	32	Very low	122 Å²	122	153.3 Å²	153.3	75%	0.748	75%	0.749	S	S	*	*				-169.3	144.3	81.1	33.8	0	0	0	0	114.1
919	L	28.9	Very low	32.3	Very low	156 Å²	156	156.9 Å²	156.9	82%	0.817	75%	0.753	S	S	*	*			trans	42.1	98.8	142.4	-58	169.7	0	0	0	121.7
920	K	34	Very low	32.4	Very low	216 Å²	216	158.6 Å²	158.6	94%	0.939	76%	0.76	S	S	*	*				-172.9	145.1	107.7	-99.7	166.5	-175.8	175.6	0	114.7
921	S	30.4	Very low	32.5	Very low	121 Å²	121	157.3 Å²	157.3	85%	0.846	76%	0.761	S	S	*	*			trans	-37.7	161.6	-171.9	-135.1	0	0	0	0	121.8
922	P	36.3	Very low	32.6	Very low	105 Å²	105	161.5 Å²	161.5	68%	0.682	77%	0.767	S	S	*	*			trans	-117.3	170.3	-170.2	43.2	-33.1	0	0	0	116.3
923	Y	30.4	Very low	32.8	Very low	183 Å²	183	162.7 Å²	162.7	72%	0.718	78%	0.775	S	S	*	*			trans	177	173.5	138.9	-118.5	-113.1	0	0	0	109
924	R	32	Very low	32.8	Very low	198 Å²	198	165.8 Å²	165.8	75%	0.747	78%	0.782	S	S	*	*				173.4	152.5	-52.6	-143	179	-170.9	-160	4.4	105.6
925	R	35.5	Very low	33.1	Very low	224 Å²	224	163.9 Å²	163.9	85%	0.845	78%	0.779	S	S	*	*			trans	85.4	169.3	174.7	-50.2	171	179.5	-167.8	0.7	116.8
926	R	33.7	Very low	33.1	Very low	213 Å²	213	161.8 Å²	161.8	80%	0.804	78%	0.777	S	S	*	*				176.2	139.6	-63	-113.2	-174.7	173.2	-177.7	-0.3	111.4
927	R	34.4	Very low	33.2	Very low	197 Å²	197	160.2 Å²	160.2	74%	0.743	77%	0.771	S	S	*	*			trans	71.5	161.4	159.3	-62.7	174.1	168	-177.6	-3.4	116.5
928	R	34	Very low	33.3	Very low	185 Å²	185	161.1 Å²	161.1	70%	0.698	77%	0.771	S	S	*	*			cis	-170.7	170.3	-12.4	-114.5	179.2	168.5	-179.1	-6	111.5
929	R	33.4	Very low	33.3	Very low	206 Å²	206	162 Å²	162	78%	0.777	77%	0.765	S	S	*	*			trans	78.6	129.2	162.4	-69.1	151.9	175.5	178.8	-5.2	115.4
930	H	32.4	Very low	33.4	Very low	177 Å²	177	163 Å²	163	82%	0.819	76%	0.759	S	S	*	*				79	136.9	56.2	-63.7	-46.6	0	0	0	112.2
931	C	30.1	Very low	33.1	Very low	109 Å²	109	160 Å²	160	74%	0.736	75%	0.752	S	S	*	*			cis	-163	-171.9	12.4	-112.5	0	0	0	0	108.6
932	K	33.1	Very low	33	Very low	190 Å²	190	160.3 Å²	160.3	83%	0.826	75%	0.753	S	S	*	*			cis	153.9	111.5	-19.6	173.4	-155.4	-177.6	-173.9	0	109.2
933	S	35.1	Very low	32.5	Very low	109 Å²	109	164.9 Å²	164.9	76%	0.762	76%	0.762	S	S	*	*			trans	178.9	130.8	155.4	51.6	0	0	0	0	117.3
934	K	33.5	Very low	32.6	Very low	203 Å²	203	162.5 Å²	162.5	88%	0.883	77%	0.767	S	S	*	*			trans	48.6	162.7	138.4	-64.3	-169.3	174.6	-169.6	0	120.9
935	S	37	Very low	32.4	Very low	91 Å²	91	158.1 Å²	158.1	64%	0.636	77%	0.766	S	S	*	*			cis	-157.5	152	12.7	15.3	0	0	0	0	112.5
936	D	36.1	Very low	32.3	Very low	149 Å²	149	152.4 Å²	152.4	80%	0.797	76%	0.761	S	S	*	*			trans	50.3	150.2	134.7	-46.5	-23.3	0	0	0	121.6
937	S	32.5	Very low	32.2	Very low	90 Å²	90	151 Å²	151	63%	0.629	76%	0.763	S	S	*	*			cis	-171.5	177.6	-15.3	55.2	0	0	0	0	111.1
938	N	34.6	Very low	32.2	Very low	139 Å²	139	146.6 Å²	146.6	74%	0.743	76%	0.762	S	S	*	*			trans	74.2	154.8	159.6	-65.1	-29.7	0	0	0	120.4
939	K	32.8	Very low	32.1	Very low	142 Å²	142	144.2 Å²	144.2	62%	0.617	76%	0.763	S	S	*	*			cis	-171.9	155.8	-34.8	-142.8	169.3	177.2	-164.7	0	111.7
940	Y	31	Very low	32.1	Very low	175 Å²	175	142 Å²	142	69%	0.686	77%	0.767	S	S	*	*			trans	65.3	141.8	171.1	-50.6	-63.9	0	0	0	117
941	I	27	Very low	32	Very low	153 Å²	153	140.9 Å²	140.9	79%	0.785	77%	0.767	S	S	*	*			cis	96.7	111.6	19	-61.2	169.1	0	0	0	115.2
942	C	28.5	Very low	32.1	Very low	129 Å²	129	143.4 Å²	143.4	87%	0.872	77%	0.77	S	S	*	*				-170.6	165.7	129.4	-114.2	0	0	0	0	113.1
943	K	26.5	Very low	31.8	Very low	200 Å²	200	141.8 Å²	141.8	87%	0.87	77%	0.769	S	S	*	*			trans	-139	140.4	175	-72.6	-176.3	177.3	-175.7	0	110.6
944	T	32.4	Very low	31.6	Very low	134 Å²	134	143.6 Å²	143.6	82%	0.822	77%	0.769	S	S	*	*			trans	-167	139.7	154.1	41	0	0	0	0	108.5
945	S	27.9	Very low	31.3	Very low	106 Å²	106	139.7 Å²	139.7	74%	0.741	76%	0.762	S	S	*	*			cis	108.5	90.2	9	76.1	0	0	0	0	116.7
946	S	32.6	Very low	30.8	Very low	104 Å²	104	140.3 Å²	140.3	73%	0.727	77%	0.766	S	S	*	*			trans	-175.8	125.7	157.7	49.7	0	0	0	0	108.5
947	H	31.8	Very low	30.3	Very low	184 Å²	184	137.4 Å²	137.4	85%	0.852	76%	0.758	S	S	*	*				60.2	136.6	79.3	-64.7	-63	0	0	0	113.7
948	S	34.1	Very low	30.3	Very low	104 Å²	104	142.1 Å²	142.1	73%	0.727	77%	0.77	S	S	*	*			cis	-154.1	152.4	10.8	53.5	0	0	0	0	115.4
949	N	31.5	Very low	29.9	Very low	134 Å²	134	146.4 Å²	146.4	72%	0.717	78%	0.777	S	S	*	*			trans	-3.2	146.7	151.3	-46.5	-2.2	0	0	0	120.1
950	N	34.6	Very low	29.8	Very low	161 Å²	161	143.3 Å²	143.3	86%	0.861	79%	0.785	S	S	*	*				-163.4	138.9	103.1	-93.9	-21.1	0	0	0	113
951	N	29.8	Very low	29.6	Very low	152 Å²	152	141 Å²	141	81%	0.813	79%	0.79	S	S	*	*			trans	-98.5	155.3	179	-70.2	-16.6	0	0	0	111.4
952	M	31.9	Very low	29.7	Very low	162 Å²	162	145.4 Å²	145.4	80%	0.798	80%	0.797	S	S	*	*			trans	-152.2	115.2	137.6	-93.7	-118	70.6	0	0	110.2	I954	M952-I954 HydrophobicContact CE-CD1 4.06Å; M952-I954 HydrophobicContact CE-CG1 3.85Å
953	L	26.4	Very low	29.7	Very low	156 Å²	156	143.6 Å²	143.6	82%	0.817	79%	0.785	S	S	*	*			trans	-94.2	130	162.9	-78.9	158.6	0	0	0	108
954	I	31.2	Very low	29.8	Very low	148 Å²	148	143.8 Å²	143.8	76%	0.759	79%	0.786	S	S	*	*			trans	-133.9	147.4	155	-63.9	-172.8	0	0	0	108	M952	M952-I954 HydrophobicContact CE-CD1 4.06Å; M952-I954 HydrophobicContact CE-CG1 3.85Å
955	T	27.4	Very low	29.8	Very low	121 Å²	121	143 Å²	143	74%	0.742	79%	0.786	S	S	*	*			trans	-106.7	162.3	-159.1	50.9	0	0	0	0	114.6
956	S	26	Very low	29.8	Very low	103 Å²	103	149.4 Å²	149.4	72%	0.72	79%	0.794	S	S	*	*			trans	83.9	139.7	147.5	-161	0	0	0	0	119.4
957	S	26	Very low	29.8	Very low	89 Å²	89	153.6 Å²	153.6	62%	0.622	80%	0.802	S	S	*	*			trans	42.8	118.1	145.6	58.3	0	0	0	0	120.2
958	H	31.9	Very low	29.7	Very low	188 Å²	188	148.7 Å²	148.7	87%	0.87	79%	0.789	S	S	*	*				-158.7	145	113.5	-107.5	-72.6	0	0	0	112.4
959	Y	26	Very low	29.5	Very low	229 Å²	229	152.3 Å²	152.3	90%	0.898	79%	0.791	S	S	*	*			trans	-68.7	146	166.6	-91.1	-118.4	0	0	0	110.4
960	G	31.3	Very low	29.4	Very low	77 Å²	77	150.8 Å²	150.8	79%	0.794	78%	0.783	S	S	*	*			trans	-153	44.2	-171.3	0	0	0	0	0	115.8	R962	G960-R962 PolarHBondContact O-N 3.48Å
961	T	27	Very low	29.3	Very low	127 Å²	127	150.9 Å²	150.9	78%	0.779	78%	0.776	S	S	*	*			trans	-76.1	112.8	173.9	50.9	0	0	0	0	111.7
962	R	29.7	Very low	29.5	Very low	246 Å²	246	152.1 Å²	152.1	93%	0.928	78%	0.782	S	S	*	*			trans	-165.3	139.7	140.6	-114.8	167.9	178.6	-179.3	-1.6	117	G960	G960-R962 PolarHBondContact O-N 3.48Å
963	S	27.5	Very low	29.8	Very low	90 Å²	90	151.2 Å²	151.2	63%	0.629	78%	0.779	S	S	*	*			trans	-68.1	153.9	176.8	52.3	0	0	0	0	117.9
964	K	29.6	Very low	30.2	Very low	205 Å²	205	149.2 Å²	149.2	89%	0.891	78%	0.776	S	S	*	*			trans	57.5	102.4	134.1	-65.1	173.6	-179.8	-179.5	0	120.8
965	S	31.3	Very low	30.3	Very low	118 Å²	118	148 Å²	148	83%	0.825	77%	0.771	S	S	*	*				-162.9	138.2	127.9	49.2	0	0	0	0	107.1
966	R	29.1	Very low	30.5	Very low	239 Å²	239	148.8 Å²	148.8	90%	0.902	77%	0.771	S	S	*	*			cis	81.6	77.8	20	-159.7	-172.6	-179.9	170.5	2.1	115.8
967	E	32.6	Very low	31	Very low	193 Å²	193	151.5 Å²	151.5	90%	0.902	77%	0.772	S	S	*	*			trans	-149.1	155.3	151	-100.2	160.3	-152	0	0	107.5
968	S	29.5	Very low	31.3	Very low	81 Å²	81	159.1 Å²	159.1	57%	0.566	79%	0.787	S	S	*	*				176.4	160.6	-55.2	-179.5	0	0	0	0	106.3
969	F	28.4	Very low	31.3	Very low	179 Å²	179	153.6 Å²	153.6	79%	0.785	78%	0.781	S	S	*	*			trans	69.4	140.7	175.7	-51.4	-79.1	0	0	0	115.3
970	D	30.9	Very low	31.5	Very low	102 Å²	102	153.9 Å²	153.9	55%	0.545	78%	0.781	S	S	.	*			cis	-159	162.5	-8.8	-131.5	-17.7	0	0	0	114.1
971	K	31.9	Very low	31.7	Very low	164 Å²	164	161.7 Å²	161.7	71%	0.713	79%	0.786	S	S	*	*			trans	35.7	107.5	146.1	-69	154.7	-166.9	150.6	0	120.3
972	L	35	Very low	31.8	Very low	177 Å²	177	165 Å²	165	93%	0.927	78%	0.784	S	S	*	*				175.1	142	98.2	-93.5	167.7	0	0	0	114.7
973	L	36.2	Very low	31.9	Very low	143 Å²	143	159.4 Å²	159.4	75%	0.749	78%	0.782	S	S	*	*			trans	-91.6	168.4	165.5	-97.2	165.6	0	0	0	109
974	P	36.6	Very low	32.1	Very low	115 Å²	115	160.4 Å²	160.4	75%	0.747	78%	0.784	S	S	*	*			cis	-152.3	170.6	45.5	42.4	-20.7	0	0	0	120.7
975	N	32	Very low	32.4	Very low	123 Å²	123	159 Å²	159	66%	0.658	79%	0.786	S	S	*	*			trans	-11.6	141.3	152.6	-58	-30.1	0	0	0	118.9
976	N	31.2	Very low	32.5	Very low	137 Å²	137	162.4 Å²	162.4	73%	0.733	79%	0.785	S	S	*	*				-172.4	149.3	94.8	-102.9	-59	0	0	0	118
977	Q	38	Very low	32.7	Very low	159 Å²	159	157.4 Å²	157.4	74%	0.743	78%	0.781	S	S	*	*			trans	60.2	103.6	146.1	-68.8	175.4	49.6	0	0	123.3
978	R	31.2	Very low	32.7	Very low	249 Å²	249	154.8 Å²	154.8	94%	0.94	78%	0.783	S	S	*	*				39.7	115.1	114.5	-65.3	178.5	173.4	179.8	-1.9	118.8
979	G	32.8	Very low	32.9	Very low	73 Å²	73	155.1 Å²	155.1	75%	0.753	79%	0.791	S	S	*	*			trans	-152.8	82.1	165.7	0	0	0	0	0	115.1	R981	G979-R981 PolarHBondContact O-N 3.05Å
980	R	30.7	Very low	33.4	Very low	235 Å²	235	155.8 Å²	155.8	89%	0.887	79%	0.793	S	S	*	*			trans	-64.1	115.4	171.4	-76.3	177.2	170.9	168.4	-4.2	110.4
981	R	33.6	Very low	33.5	Very low	240 Å²	240	161.8 Å²	161.8	91%	0.906	81%	0.808	S	S	*	*			trans	-98.8	78.1	164.8	-73.8	-161	173.9	-153.8	-1.5	112.2	G979 C983	G979-R981 PolarHBondContact O-N 3.05Å; R981-C983 PolarHBondContact O-N 3.28Å
982	R	30.1	Very low	33.5	Very low	197 Å²	197	165.4 Å²	165.4	74%	0.743	82%	0.817	S	S	*	*			trans	-68.9	106.4	165.3	175.6	-166.9	-77.2	173.7	-8.3	108.4	T984	R982-T984 HydrophobicContact CG-CG2 4.03Å; R982-T984 PolarHBondContact O-N 3.25Å
983	C	31.6	Very low	33.3	Very low	129 Å²	129	167.2 Å²	167.2	87%	0.872	82%	0.818	S	S	*	*			trans	-77.7	89	175.4	-71.6	0	0	0	0	111.2	R981	R981-C983 PolarHBondContact O-N 3.28Å
984	T	31.9	Very low	33.2	Very low	111 Å²	111	171.2 Å²	171.2	68%	0.681	82%	0.824	S	S	*	*			trans	-95.5	97	165.9	43.7	0	0	0	0	110.2	R982	R982-T984 HydrophobicContact CG-CG2 4.03Å; R982-T984 PolarHBondContact O-N 3.25Å
985	L	36.2	Very low	33.2	Very low	176 Å²	176	174.4 Å²	174.4	92%	0.921	84%	0.844	S	S	*	*			trans	-109.5	109.6	156.5	-82.3	168.8	0	0	0	108.3
986	K	32.3	Very low	33.3	Very low	188 Å²	188	177 Å²	177	82%	0.817	85%	0.854	S	S	*	*			trans	-75.7	177.9	165	-74.5	-177.4	173.1	180	0	109.2
987	T	34.9	Very low	33.4	Very low	134 Å²	134	179.1 Å²	179.1	82%	0.822	86%	0.86	S	S	*	*			trans	61	74.5	164	59.9	0	0	0	0	117.3
988	C	32.4	Very low	33.2	Very low	138 Å²	138	180.2 Å²	180.2	93%	0.932	87%	0.866	S	S	*	*				-144.2	150.1	105.1	-95.3	0	0	0	0	109.5
989	A	34.1	Very low	33.3	Very low	89 Å²	89	176.2 Å²	176.2	74%	0.736	86%	0.862	S	S	*	*			trans	-131.1	158.9	-165.7	0	0	0	0	0	113.1
990	K	36.9	Very low	33.3	Very low	192 Å²	192	182.6 Å²	182.6	84%	0.835	87%	0.869	S	S	*	*			trans	91	133.1	167.8	-55.4	173.1	179.9	175.3	0	116.5
991	R	34.1	Very low	33.5	Very low	229 Å²	229	179.1 Å²	179.1	86%	0.864	87%	0.868	S	S	*	*			trans	72.2	86.2	163.7	-62.5	166.6	-176.3	-172.9	-2	114.6
992	R	32.3	Very low	33.5	Very low	239 Å²	239	174.8 Å²	174.8	90%	0.902	87%	0.865	S	S	*	*				76.2	96	74.1	-75.2	-172.2	176.1	-172.2	-0.7	112.8
993	F	30	Very low	33.7	Very low	216 Å²	216	173.1 Å²	173.1	95%	0.947	87%	0.874	S	S	*	*			trans	-143.6	149.5	149.6	-103.3	-83.3	0	0	0	109.1
994	R	35.4	Very low	33.9	Very low	227 Å²	227	176.8 Å²	176.8	86%	0.857	88%	0.875	S	S	*	*			trans	-171.7	150.1	177.6	-121.2	-165.8	-172.3	-161	4	108.4
995	P	36.3	Very low	34.1	Very low	182 Å²	182	182.7 Å²	182.7	100%	1.182	89%	0.892	S	S	*	*			cis	-91.3	0	-30.2	-0.5	22.4	0	0	0	111.9

Retrieved 995 of 995 residues in 1127.5 ms (Link to these results)

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