A0A3Q0KNT8_SCHMA Loading...

Amyloid beta A4 protein related

AlphaFold DB , UniProt , Accession A0A3Q0KNT8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 990 aa.

						>A0A3Q0KNT8_SCHMA|A0A3Q0KNT8
MSLIRMESQNIEQNIPNTYSSSDSPTTLIYGLPSLFTSEILYDGPKRCILKTDKLSPNGNSNNIIEGHRTDVDSTGLCHKGCFSVPRIRDLTDSTMRGNVASSQNNETKGSCDSVTCFSEHELSDIPLSSNDEDRINFDVSDISKQLVLLSPFSGEKFATIRSESNYVPMTSSFLTERDNGCVRSSDVMQRSTLHPKHITVTMPTVEDGLSSGSDSGSPCLTSRSRVKDSSFDMRSFSGSPDSVTDIYCGRPTINSRSESLDGEHLLNPAIVQDISKDIMDIKRTLGASDHAKIYIPSCEQNTVNTSKSREQNINPRSPDKVNGCHCNEMKIEFTPLEISHANKISVSSRNWEMFKDHDKEKNTVQAVVECTDEGTFDQASCNATDIQNNILESPIDSCSHKQMHHWTFPAQVHTVDSSSEDETSHRSNISKSVPNKSEIKSRNNSDRGQNTKCSSPLSSTFENSKQKSQFKASINSSHPGTVTNKLNSKSATRINTNSDEVYKSPILRHSDCRDGDFDSDEDTAQLLDKQYQADKQVYIPELKDKSCIEADRQRRVREVSVRHPEQPDVLIHGLLFRAQYMGSTQILCNKQSTRMSRMLQAQEVVNRIKAPDDESHPSVTVELFVSTERIMILNSNLEDILIDHKLRTVSYIADIGDLFVLMSRRLDPSTQSEESENYFTSNYLNNELKEISTHNADNNNNTNSSLPEQQHSAVPLNSNIPNVTKSAMIEKLKKPMKMICHVLESTEAQLIAQTVGHAFQLAYLDFLRENGIEDLGIIKQLDYDDILKQQEIFCDELSLFCDKDNHKEVTIPKQKGESLGVVIVESGWGSLLPTALLANMHPTGPAARCGQLNIGNQIVAVNGQSLVGLPLLTCQQIIKNCRQSTIVKLMIISCPPVVEVLIRRPSLNYQLGFSVQDGVICSLLRGGIAERGGIRVDHRIIEINGESVVAVSHEKIVQLLATSVGEIHIRTMPTSVFRLLTGQIIPRYI
					

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	35.4	Very low	33.1	Very low	240 Å²	240	161.3 Å²	161.3	100%	1.182	82%	0.823	S	S	*	*				0	113.1	0	-62.6	-74	-157.3	0	0	106.6
2	S	30.6	Very low	32.6	Very low	110 Å²	110	162.4 Å²	162.4	77%	0.769	82%	0.822	S	S	*	*			cis	-156.3	155.9	-3.9	23.9	0	0	0	0	109.3
3	L	29.3	Very low	32.3	Very low	158 Å²	158	163.1 Å²	163.1	83%	0.827	82%	0.82	S	S	*	*			trans	-27.3	156.7	170.3	-79.4	74.6	0	0	0	115.7
4	I	36.9	Very low	32.2	Very low	153 Å²	153	162 Å²	162	79%	0.785	82%	0.818	S	S	*	*				-147.9	134.1	62.8	-75.7	156.1	0	0	0	113.5	M6	I4-M6 HydrophobicContact CG2-CG 4.36Å
5	R	34.3	Very low	32	Very low	206 Å²	206	160.5 Å²	160.5	78%	0.777	81%	0.811	S	S	*	*			trans	-97.7	138.4	164.4	-164.9	-171.9	-153	166.2	3.8	107
6	M	35.5	Very low	31.9	Very low	184 Å²	184	158.4 Å²	158.4	91%	0.906	81%	0.813	S	S	*	*			trans	-131	123.6	157.7	-88.2	-164.5	175.4	0	0	109.7	I4	I4-M6 HydrophobicContact CG2-CG 4.36Å
7	E	32.2	Very low	31.5	Very low	150 Å²	150	157.1 Å²	157.1	70%	0.701	81%	0.808	S	S	*	*			trans	-93.1	156	178.1	-61.1	162.3	121.4	0	0	110.4
8	S	35.8	Very low	31.2	Very low	109 Å²	109	155.6 Å²	155.6	76%	0.762	81%	0.807	S	S	*	*			trans	175.5	142.7	141	-81.4	0	0	0	0	110.2
9	Q	32.1	Very low	30.9	Very low	158 Å²	158	159.5 Å²	159.5	74%	0.738	81%	0.812	S	S	*	*			cis	-172.3	134.1	-20.8	-124.8	-178.4	23.9	0	0	108
10	N	28.9	Very low	30.7	Very low	141 Å²	141	156.9 Å²	156.9	75%	0.754	81%	0.809	S	S	*	*			trans	61.5	154.2	160.6	-51	-49.1	0	0	0	117.4
11	I	33.3	Very low	30.4	Very low	165 Å²	165	155.4 Å²	155.4	85%	0.846	81%	0.812	S	S	*	*			cis	-140.7	138.9	24.4	-68.4	167.3	0	0	0	110.1
12	E	26.8	Very low	30	Very low	175 Å²	175	148.6 Å²	148.6	82%	0.818	79%	0.788	S	S	*	*			trans	-82.6	153.3	168.5	-62	174.6	109.4	0	0	112.4
13	Q	29.4	Very low	29.9	Very low	171 Å²	171	151.4 Å²	151.4	80%	0.799	79%	0.794	S	S	*	*				178.4	144.3	115.8	-98.1	174.2	24	0	0	115.2
14	N	30.1	Very low	29.8	Very low	148 Å²	148	148.6 Å²	148.6	79%	0.791	79%	0.788	S	S	*	*			trans	74.7	98.3	159.3	-60.4	-37.8	0	0	0	120.2
15	I	30.2	Very low	29.5	Very low	139 Å²	139	146.4 Å²	146.4	71%	0.713	78%	0.784	S	S	*	*			trans	-95.9	162.2	153.9	-29.5	178.3	0	0	0	108.1
16	P	30.4	Very low	29	Very low	128 Å²	128	142.2 Å²	142.2	83%	0.831	78%	0.782	S	S	*	*				-139.2	155.4	98.1	34.5	-20	0	0	0	115.3
17	N	24.3	Very low	28.6	Very low	136 Å²	136	139.1 Å²	139.1	73%	0.727	77%	0.773	S	S	*	*			trans	-71.8	146.7	-164	-56.3	-42.3	0	0	0	115.5
18	T	26.5	Very low	28.4	Very low	130 Å²	130	137.8 Å²	137.8	80%	0.798	77%	0.77	S	S	*	*			trans	-152.7	103.7	142.6	-42.7	0	0	0	0	111.5
19	Y	25	Very low	28.1	Very low	229 Å²	229	139.4 Å²	139.4	90%	0.898	77%	0.769	S	S	*	*			trans	36.6	107.2	161	-68.3	-91.5	0	0	0	120.3
20	S	26.8	Very low	27.8	Very low	108 Å²	108	141 Å²	141	76%	0.755	77%	0.769	S	S	*	*			trans	-128.3	124.3	160.4	57.2	0	0	0	0	110.8
21	S	25.5	Very low	27.8	Very low	126 Å²	126	137.7 Å²	137.7	88%	0.881	77%	0.768	S	S	*	*			trans	-85.7	114.4	173.9	53.5	0	0	0	0	110.9
22	S	26.9	Very low	27.6	Very low	96 Å²	96	136.7 Å²	136.7	67%	0.671	76%	0.764	S	S	*	*			trans	-154.3	74.8	176.7	60.6	0	0	0	0	111.8
23	D	28.4	Very low	27.7	Very low	169 Å²	169	134 Å²	134	90%	0.904	76%	0.762	S	S	*	*			trans	-93.4	104.5	170.1	-71.2	-42.9	0	0	0	109.9
24	S	25.6	Very low	27.5	Very low	100 Å²	100	130.8 Å²	130.8	70%	0.699	76%	0.758	S	S	*	*			trans	-91.5	117.3	168.5	54.5	0	0	0	0	109.7	T26	S24-T26 PolarHBondContact O-N 3.31Å
25	P	30.9	Very low	27.5	Very low	106 Å²	106	131.3 Å²	131.3	69%	0.688	76%	0.76	S	S	*	*			trans	-68.1	132	178.7	27.9	-33.2	0	0	0	110.3	T27	P25-T27 PolarHBondContact O-N 3.17Å
26	T	25	Very low	27.4	Very low	119 Å²	119	134.5 Å²	134.5	73%	0.73	77%	0.769	S	S	*	*			trans	-82.7	108.4	-175.8	-60.6	0	0	0	0	110.7	S24 L28	S24-T26 PolarHBondContact O-N 3.31Å; T26-L28 HydrophobicContact CG2-CD2 4.46Å; T26-L28 HydrophobicContact CG2-CG 4.31Å; T26-L28 PolarHBondContact O-N 3.05Å; T26-L28 VanDerWaalsContact O-N 3.17Å
27	T	27.2	Very low	27.1	Very low	119 Å²	119	134.8 Å²	134.8	73%	0.73	77%	0.769	S	S	*	*			trans	-72.1	102.6	173.1	-52.3	0	0	0	0	110.5	P25 I29	P25-T27 PolarHBondContact O-N 3.17Å; T27-I29 HydrophobicContact CG2-CD1 4.48Å; T27-I29 HydrophobicContact CG2-CG1 4.05Å
28	L	26.6	Very low	27.4	Very low	121 Å²	121	133.5 Å²	133.5	63%	0.634	77%	0.771	S	S	*	*			trans	-88.5	105.2	173.1	-75.3	170.6	0	0	0	110.9	T26 Y30	T26-L28 HydrophobicContact CG2-CD2 4.46Å; T26-L28 HydrophobicContact CG2-CG 4.31Å; T26-L28 PolarHBondContact O-N 3.05Å; T26-L28 VanDerWaalsContact O-N 3.17Å; L28-Y30 HydrophobicContact CB-CD2 4.24Å; L28-Y30 HydrophobicContact CB-CE2 3.91Å; L28-Y30 HydrophobicContact CD1-CE2 4.23Å; L28-Y30 HydrophobicContact CD2-CE2 3.96Å; L28-Y30 HydrophobicContact CG-CE2 4.25Å
29	I	29	Very low	27.4	Very low	144 Å²	144	136.1 Å²	136.1	74%	0.738	77%	0.774	S	S	*	*			trans	-97	118.8	170.2	-55	177.7	0	0	0	107.9	T27	T27-I29 HydrophobicContact CG2-CD1 4.48Å; T27-I29 HydrophobicContact CG2-CG1 4.05Å
30	Y	27.7	Very low	27.6	Very low	191 Å²	191	133.1 Å²	133.1	75%	0.749	77%	0.772	S	S	*	*			trans	-120.4	118.5	174.1	-75.8	-76	0	0	0	110.8	L28	L28-Y30 HydrophobicContact CB-CD2 4.24Å; L28-Y30 HydrophobicContact CB-CE2 3.91Å; L28-Y30 HydrophobicContact CD1-CE2 4.23Å; L28-Y30 HydrophobicContact CD2-CE2 3.96Å; L28-Y30 HydrophobicContact CG-CE2 4.25Å
31	G	28.6	Very low	27.7	Very low	71 Å²	71	135.7 Å²	135.7	73%	0.732	78%	0.776	S	S	*	*			trans	113.7	84.7	165.7	0	0	0	0	0	116
32	L	28.4	Very low	27.8	Very low	144 Å²	144	141 Å²	141	75%	0.754	78%	0.778	S	S	*	*			trans	-127.8	143.1	157.2	-94.1	169.2	0	0	0	108.4
33	P	28.4	Very low	27.9	Very low	120 Å²	120	144 Å²	144	78%	0.779	79%	0.787	S	S	*	*				-125.8	117.1	129.8	5.1	15.8	0	0	0	111.7
34	S	26.3	Very low	27.9	Very low	103 Å²	103	138.5 Å²	138.5	72%	0.72	77%	0.77	S	S	*	*	S	Bend	trans	27.8	98.2	148.5	60	0	0	0	0	119.4
35	L	29.2	Very low	28.3	Very low	159 Å²	159	139.8 Å²	139.8	83%	0.832	78%	0.776	S	S	*	*	S	Bend		171.3	153.6	124.6	-87.2	159.3	0	0	0	107.3
36	F	29.5	Very low	28.2	Very low	205 Å²	205	144.2 Å²	144.2	90%	0.899	79%	0.785	S	S	*	*			trans	66.1	61.9	-168.7	-62.6	-81.9	0	0	0	116.4
37	T	24.1	Very low	28.4	Very low	135 Å²	135	150.3 Å²	150.3	83%	0.828	79%	0.794	S	S	*	*			trans	-95.3	109	152	50.5	0	0	0	0	110
38	S	29.4	Very low	28.3	Very low	109 Å²	109	150.5 Å²	150.5	76%	0.762	80%	0.799	S	S	*	*			trans	-132	109.9	157.8	55.5	0	0	0	0	108.5
39	E	26.8	Very low	28.4	Very low	185 Å²	185	152.8 Å²	152.8	86%	0.864	81%	0.81	S	S	*	*			trans	-64.1	133	-174.4	-51.9	160.2	129.7	0	0	111.3
40	I	29.2	Very low	28.4	Very low	166 Å²	166	153.2 Å²	153.2	85%	0.851	81%	0.813	S	S	*	*			trans	-137.9	101.4	153.5	-56.3	-176.7	0	0	0	108.6
41	L	28.5	Very low	28.3	Very low	161 Å²	161	153 Å²	153	84%	0.843	82%	0.816	S	S	*	*			trans	-66.3	149.5	162	-107.4	77.7	0	0	0	109.9
42	Y	27.3	Very low	28.3	Very low	237 Å²	237	155.7 Å²	155.7	93%	0.929	82%	0.819	S	S	*	*			trans	-66.6	130.1	172.1	-84.6	-102.1	0	0	0	112.1
43	D	29.7	Very low	28.4	Very low	160 Å²	160	155.7 Å²	155.7	86%	0.856	82%	0.819	S	S	*	*			trans	-146.2	148.3	142.3	-155.9	-2.9	0	0	0	110.2
44	G	28.4	Very low	28.6	Very low	54 Å²	54	160 Å²	160	56%	0.557	83%	0.826	S	S	*	*			trans	-82	-177.1	174.7	0	0	0	0	0	112.1
45	P	34.5	Very low	28.9	Very low	126 Å²	126	163.3 Å²	163.3	82%	0.818	83%	0.834	S	S	*	*			cis	-147.1	175.8	30.7	40.6	-20	0	0	0	117.6
46	K	28.2	Very low	28.9	Very low	200 Å²	200	160.9 Å²	160.9	87%	0.87	83%	0.831	S	S	*	*			trans	-5.5	125	153.8	-57	170.7	-178.5	175	0	117.4
47	R	28.7	Very low	29.1	Very low	246 Å²	246	156.8 Å²	156.8	93%	0.928	83%	0.825	S	S	*	*			trans	-153	137	145.1	-118.4	173.7	-168.9	-169.4	3.7	114
48	C	25.9	Very low	29.5	Very low	123 Å²	123	158.7 Å²	158.7	83%	0.831	83%	0.83	S	S	*	*			trans	-76.2	141	179.4	-46.8	0	0	0	0	111	L50	C48-L50 PolarHBondContact O-N 3.27Å
49	I	28.8	Very low	29.6	Very low	170 Å²	170	156.6 Å²	156.6	87%	0.872	83%	0.825	S	S	*	*			trans	-84.6	99.7	172.8	-58.7	176.7	0	0	0	108.8
50	L	28.1	Very low	30	Very low	153 Å²	153	155.7 Å²	155.7	80%	0.801	83%	0.826	S	S	*	*			trans	-75.3	120.2	160.3	-86.9	160.1	0	0	0	108.4	C48 T52	C48-L50 PolarHBondContact O-N 3.27Å; L50-T52 PolarHBondContact O-N 3.15Å
51	K	26	Very low	30.4	Very low	185 Å²	185	151.9 Å²	151.9	80%	0.804	82%	0.815	S	S	*	*			trans	-56.6	125.5	163.9	-88.3	-178	171.9	-179.9	0	108.5
52	T	29.9	Very low	30.7	Very low	129 Å²	129	150.3 Å²	150.3	79%	0.791	81%	0.807	S	S	*	*			trans	-121	100.7	162.7	35.8	0	0	0	0	108	L50 K54	L50-T52 PolarHBondContact O-N 3.15Å; T52-K54 PolarHBondContact O-N 3.12Å
53	D	30.6	Very low	31.1	Very low	143 Å²	143	145.3 Å²	145.3	77%	0.765	80%	0.797	S	S	*	*			trans	-66.5	126.3	173.5	-66.8	-60.8	0	0	0	109.6	L55	D53-L55 PolarHBondContact O-N 3.37Å
54	K	31.8	Very low	31.3	Very low	211 Å²	211	144.1 Å²	144.1	92%	0.917	79%	0.789	S	S	*	*			trans	-84.7	97.1	175.8	-84.6	-166.6	173.9	-174.4	0	110.6	T52	T52-K54 PolarHBondContact O-N 3.12Å
55	L	31.5	Very low	31.5	Very low	172 Å²	172	147.9 Å²	147.9	90%	0.901	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-71	131	155.9	-83.7	157.4	0	0	0	110	D53	D53-L55 PolarHBondContact O-N 3.37Å
56	S	30.8	Very low	31.4	Very low	109 Å²	109	150.6 Å²	150.6	76%	0.762	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-78.5	148.9	173.1	-158.7	0	0	0	0	110
57	P	32.5	Very low	31.6	Very low	118 Å²	118	144.3 Å²	144.3	77%	0.766	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-83.7	149.5	-167.9	33.9	-34.8	0	0	0	112.6
58	N	33.3	Very low	31.9	Very low	175 Å²	175	141.5 Å²	141.5	94%	0.936	79%	0.786	S	S	*	*			trans	-146.2	139	154.4	-116.9	-19.8	0	0	0	109.9
59	G	31.7	Very low	32.1	Very low	65 Å²	65	145.8 Å²	145.8	67%	0.67	78%	0.784	S	S	*	*			trans	-106.2	179.4	-167.6	0	0	0	0	0	114.8
60	N	34.2	Very low	32.4	Very low	166 Å²	166	142.6 Å²	142.6	89%	0.888	77%	0.773	S	S	*	*			trans	-169.4	145.2	158.5	-96.7	-26.7	0	0	0	104.8
61	S	37.5	Very low	32.4	Very low	86 Å²	86	142.3 Å²	142.3	60%	0.601	77%	0.772	S	S	*	*			cis	-161.9	168.7	6.8	51	0	0	0	0	106.2
62	N	35.8	Very low	32.8	Very low	129 Å²	129	140.1 Å²	140.1	69%	0.69	77%	0.774	S	S	*	*				-176.3	160.9	52.1	-112.3	-35.5	0	0	0	110.2
63	N	36	Very low	32.7	Very low	132 Å²	132	140.9 Å²	140.9	71%	0.706	77%	0.773	S	S	*	*			trans	73.2	138.8	154.7	-60.7	-11.8	0	0	0	119.7
64	I	32.9	Very low	32.8	Very low	135 Å²	135	139.2 Å²	139.2	69%	0.692	77%	0.773	S	S	*	*			cis	-170.5	155.1	-19.6	-130.9	164.5	0	0	0	109.6
65	I	33.3	Very low	32.7	Very low	132 Å²	132	136 Å²	136	68%	0.677	77%	0.771	S	S	*	*			trans	76.4	117.9	160.6	-75.3	167.7	0	0	0	121.2
66	E	31.4	Very low	32.6	Very low	183 Å²	183	131.7 Å²	131.7	86%	0.855	77%	0.768	S	S	*	*			trans	47.2	140.6	138.2	-55.3	169	-173.7	0	0	122.2
67	G	32.8	Very low	32.5	Very low	69 Å²	69	134.7 Å²	134.7	71%	0.711	78%	0.775	S	S	*	*			cis	171.5	162.4	-4.6	0	0	0	0	0	114.7
68	H	34.4	Very low	32.2	Very low	186 Å²	186	134.5 Å²	134.5	86%	0.861	78%	0.775	S	S	*	*			trans	64.5	122	158.8	-85.7	-53.4	0	0	0	124.4
69	R	31.5	Very low	32.1	Very low	213 Å²	213	135.5 Å²	135.5	80%	0.804	77%	0.774	S	S	*	*				108.4	114.8	125.6	-85.9	-169.9	174.9	-152.3	-2.3	121.8
70	T	33.9	Very low	32	Very low	104 Å²	104	142.3 Å²	142.3	64%	0.638	79%	0.785	S	S	*	*			trans	69.2	113.3	133.9	55.6	0	0	0	0	121.8
71	D	28.4	Very low	31.7	Very low	147 Å²	147	137.7 Å²	137.7	79%	0.786	78%	0.777	S	S	*	*				49.4	118.6	126.7	-43.7	-27.5	0	0	0	120.6
72	V	34.7	Very low	31.1	Very low	138 Å²	138	139.7 Å²	139.7	84%	0.836	79%	0.789	S	S	*	*				175.9	149.2	97.3	159.6	0	0	0	0	109.2
73	D	27.8	Very low	30.7	Very low	145 Å²	145	142.9 Å²	142.9	78%	0.775	80%	0.797	S	S	*	*			trans	-55.3	144.3	-175.6	-53.8	-75.3	0	0	0	116.4
74	S	33.4	Very low	30.3	Very low	108 Å²	108	141.5 Å²	141.5	76%	0.755	80%	0.798	S	S	*	*				-177.5	121.6	114.9	30.5	0	0	0	0	114.5
75	T	28.8	Very low	30	Very low	145 Å²	145	141.4 Å²	141.4	89%	0.89	80%	0.803	S	S	*	*			trans	33.2	112.3	145.4	58.6	0	0	0	0	120.5
76	G	30.5	Very low	30	Very low	81 Å²	81	140.5 Å²	140.5	84%	0.835	81%	0.806	S	S	*	*			trans	-167	109.6	166.1	0	0	0	0	0	113.3
77	L	27.9	Very low	29.7	Very low	172 Å²	172	143.3 Å²	143.3	90%	0.901	81%	0.808	S	S	*	*			trans	-48.8	165.8	-175.5	-77.5	151.7	0	0	0	118.2
78	C	26	Very low	29.6	Very low	114 Å²	114	147 Å²	147	77%	0.77	81%	0.81	S	S	*	*			trans	84.2	105.1	161.4	-64.2	0	0	0	0	118.7
79	H	31.3	Very low	29.3	Very low	195 Å²	195	148.9 Å²	148.9	90%	0.903	81%	0.81	S	S	*	*				-154	130.3	127.3	-114.7	-72.4	0	0	0	113.1
80	K	29.6	Very low	29.2	Very low	209 Å²	209	145.2 Å²	145.2	91%	0.909	81%	0.806	S	S	*	*			trans	-71.7	139	161.6	-67.7	-179.1	175.8	-178.2	0	108.9
81	G	28.2	Very low	29.1	Very low	69 Å²	69	147.3 Å²	147.3	71%	0.711	81%	0.813	S	S	*	*			trans	-178	121.1	171.4	0	0	0	0	0	112.4
82	C	25.1	Very low	29.4	Very low	128 Å²	128	146.2 Å²	146.2	87%	0.865	81%	0.811	S	S	*	*			trans	-67.3	133.4	-180	-50	0	0	0	0	111.6
83	F	27.5	Very low	29.2	Very low	196 Å²	196	146 Å²	146	86%	0.86	81%	0.806	S	S	*	*			trans	-145.2	117.2	158.4	-94.7	-75.3	0	0	0	113.2
84	S	27.6	Very low	29.6	Very low	102 Å²	102	143.7 Å²	143.7	71%	0.713	80%	0.801	S	S	*	*			trans	20.7	130.2	134.1	-44.9	0	0	0	0	120.9
85	V	26.9	Very low	29.4	Very low	134 Å²	134	143.5 Å²	143.5	81%	0.812	80%	0.795	S	S	*	*			trans	-56.2	139.6	165.4	178.6	0	0	0	0	112.8
86	P	31.6	Very low	29.7	Very low	112 Å²	112	142.8 Å²	142.8	73%	0.727	78%	0.784	S	S	*	*			trans	-115.6	132.1	152.8	31.5	-19.1	0	0	0	112.8
87	R	25.1	Very low	29.7	Very low	242 Å²	242	149.8 Å²	149.8	91%	0.913	79%	0.785	S	S	*	*			trans	-83.5	118.8	164.6	-77	175.2	167.8	167.6	-4.4	110.3
88	I	30.8	Very low	29.9	Very low	147 Å²	147	144.7 Å²	144.7	75%	0.754	77%	0.774	S	S	*	*			trans	-149.2	113.3	154.6	-51.8	-177.8	0	0	0	104.9
89	R	27.6	Very low	30.2	Very low	226 Å²	226	146.9 Å²	146.9	85%	0.853	78%	0.778	S	S	*	*				71	148.8	67.7	-90.2	-169.3	-176.8	158.4	2.6	115.5
90	D	29.6	Very low	30.1	Very low	135 Å²	135	144 Å²	144	72%	0.722	77%	0.774	S	S	*	*			trans	79	136.5	171.2	-51.6	-21.9	0	0	0	114.5
91	L	33.4	Very low	30.1	Very low	149 Å²	149	138.2 Å²	138.2	78%	0.78	77%	0.765	S	S	*	*			cis	-150.5	167.2	19.8	-100	118.8	0	0	0	114
92	T	33.6	Very low	30.1	Very low	123 Å²	123	139.9 Å²	139.9	76%	0.755	77%	0.766	S	S	*	*			trans	66.8	141.1	153.6	46.6	0	0	0	0	120.1
93	D	31.5	Very low	30.3	Very low	134 Å²	134	138.5 Å²	138.5	72%	0.717	76%	0.758	S	S	*	*			cis	-157.3	153.3	-3.3	-151.9	-37.1	0	0	0	111.9
94	S	34.5	Very low	30.5	Very low	96 Å²	96	137 Å²	137	67%	0.671	75%	0.754	S	S	*	*			trans	60.1	152.3	152.1	-77.7	0	0	0	0	123
95	T	30.7	Very low	30.6	Very low	104 Å²	104	138.5 Å²	138.5	64%	0.638	75%	0.753	S	S	*	*			cis	-171.2	154.8	-16.8	-94.1	0	0	0	0	109.9
96	M	33.4	Very low	30.8	Very low	131 Å²	131	138.3 Å²	138.3	65%	0.645	75%	0.748	S	S	*	*			trans	85.7	109.4	177.1	-53.3	-44.8	-169	0	0	118.2
97	R	31.7	Very low	30.7	Very low	227 Å²	227	141 Å²	141	86%	0.857	75%	0.751	S	S	*	*				68.8	131.4	89	-70.1	-175.5	-124	-140.9	-2.2	115.1
98	G	32	Very low	31	Very low	66 Å²	66	136.7 Å²	136.7	68%	0.68	75%	0.751	S	S	*	*			cis	169.3	175.3	-3.2	0	0	0	0	0	113.3
99	N	31.7	Very low	30.9	Very low	160 Å²	160	139.5 Å²	139.5	86%	0.856	76%	0.758	S	S	*	*			trans	71.1	121	174.6	-55.6	-10.9	0	0	0	116.6
100	V	28.8	Very low	31	Very low	133 Å²	133	132.3 Å²	132.3	81%	0.806	75%	0.754	S	S	*	*			cis	100.3	124.8	27	175	0	0	0	0	113.8
101	A	31.4	Very low	31	Very low	89 Å²	89	130.4 Å²	130.4	74%	0.736	75%	0.752	S	S	*	*			trans	71.7	150.3	161.2	0	0	0	0	0	118.6
102	S	26.5	Very low	30.6	Very low	103 Å²	103	129.5 Å²	129.5	72%	0.72	76%	0.756	S	S	*	*			cis	-176.3	171.2	-23	53.3	0	0	0	0	109.3
103	S	31	Very low	30.5	Very low	100 Å²	100	130.2 Å²	130.2	70%	0.699	76%	0.755	S	S	*	*			trans	77.7	110.6	168.2	-61.5	0	0	0	0	116.2
104	Q	30	Very low	30.4	Very low	165 Å²	165	127.7 Å²	127.7	77%	0.771	75%	0.748	S	S	*	*				81.2	99.2	71.3	-83.4	-174.2	-2.2	0	0	113.5
105	N	30.6	Very low	30	Very low	132 Å²	132	130.1 Å²	130.1	71%	0.706	76%	0.759	S	S	*	*				162.9	154	97.6	-86.2	-24	0	0	0	114.2
106	N	31.7	Very low	29.8	Very low	130 Å²	130	129.5 Å²	129.5	70%	0.695	76%	0.755	S	S	*	*			trans	67.1	100.4	160.8	-59.6	2.9	0	0	0	117.2
107	E	28	Very low	29.4	Very low	170 Å²	170	128.8 Å²	128.8	79%	0.794	76%	0.762	S	S	*	*				80.2	103.8	79.5	-80.6	-164.5	137.2	0	0	114
108	T	32.8	Very low	29.2	Very low	151 Å²	151	126.7 Å²	126.7	93%	0.926	76%	0.759	S	S	*	*				-164.7	157.6	123.7	11.1	0	0	0	0	111.3
109	K	29.1	Very low	29.1	Very low	206 Å²	206	128.8 Å²	128.8	90%	0.896	76%	0.763	S	S	*	*			trans	-93.4	141.3	-162.3	-62.9	165.5	178.6	172	0	112.9
110	G	29.3	Very low	28.9	Very low	74 Å²	74	130.1 Å²	130.1	76%	0.763	76%	0.764	S	S	*	*			trans	-153.4	109.5	155.1	0	0	0	0	0	107.3
111	S	29.1	Very low	29.1	Very low	96 Å²	96	131.8 Å²	131.8	67%	0.671	76%	0.763	S	S	*	*			trans	-84.1	143.5	-169.5	92.7	0	0	0	0	112.3	D113	S111-D113 VanDerWaalsContact CB-OD1 3.23Å; S111-D113 WeakPolarHBondContact CB-OD1 3.33Å; S111-D113 PolarHBondContact OG-OD1 3.31Å
112	C	26	Very low	29	Very low	130 Å²	130	136 Å²	136	88%	0.878	77%	0.767	S	S	*	*			trans	-110.5	95.4	166.8	-66	0	0	0	0	107
113	D	29.9	Very low	29.1	Very low	137 Å²	137	139.4 Å²	139.4	73%	0.733	78%	0.777	S	S	*	*			trans	-103.7	134.5	177.1	-62.9	17.4	0	0	0	109.1	S111	S111-D113 VanDerWaalsContact CB-OD1 3.23Å; S111-D113 WeakPolarHBondContact CB-OD1 3.33Å; S111-D113 PolarHBondContact OG-OD1 3.31Å
114	S	30.5	Very low	29	Very low	82 Å²	82	139.4 Å²	139.4	57%	0.573	78%	0.776	S	S	*	*			cis	-166.5	118.5	-22.4	50.7	0	0	0	0	107.6	T116	S114-T116 PolarHBondContact O-N 2.86Å
115	V	25	Very low	29.2	Very low	147 Å²	147	138.6 Å²	138.6	89%	0.891	78%	0.778	S	S	*	*			trans	-80.2	96.8	164.2	176.2	0	0	0	0	107.2
116	T	27.9	Very low	29.1	Very low	90 Å²	90	139.2 Å²	139.2	55%	0.552	78%	0.779	S	S	*	*			trans	-99.5	93.1	175.6	51	0	0	0	0	110.8	S114 F118	S114-T116 PolarHBondContact O-N 2.86Å; T116-F118 HydrophobicContact CG2-CE2 3.93Å
117	C	23.8	Very low	29	Very low	117 Å²	117	139.1 Å²	139.1	79%	0.791	79%	0.786	S	S	*	*			trans	-64.2	127	153	-57.1	0	0	0	0	108
118	F	28.1	Very low	28.8	Very low	182 Å²	182	138.7 Å²	138.7	80%	0.798	79%	0.788	S	S	*	*			trans	-120.2	136.5	166.3	-85.8	-71.8	0	0	0	110.4	T116	T116-F118 HydrophobicContact CG2-CE2 3.93Å
119	S	30.1	Very low	28.8	Very low	110 Å²	110	136.9 Å²	136.9	77%	0.769	78%	0.781	S	S	*	*			trans	-77	143.8	-174.5	47	0	0	0	0	112.7
120	E	26.3	Very low	28.8	Very low	188 Å²	188	131.1 Å²	131.1	88%	0.879	77%	0.767	S	S	*	*			trans	-67.3	131.7	164.2	-60.5	-178.1	135.5	0	0	110.6
121	H	33.2	Very low	28.7	Very low	169 Å²	169	134.4 Å²	134.4	78%	0.782	77%	0.767	S	S	*	*			trans	-158.5	144.6	152.8	-128.1	-95.8	0	0	0	111.4
122	E	31	Very low	29	Very low	177 Å²	177	137.8 Å²	137.8	83%	0.827	78%	0.778	S	S	*	*			trans	76.8	97.3	162.5	-49.2	-159.7	139.3	0	0	119.7
123	L	28.2	Very low	29.2	Very low	175 Å²	175	138.6 Å²	138.6	92%	0.916	77%	0.769	S	S	*	*			trans	-62.6	136.9	149.9	-67.6	140.3	0	0	0	111
124	S	28.7	Very low	29.4	Very low	99 Å²	99	140 Å²	140	69%	0.692	78%	0.776	S	S	*	*				-179	164.4	119.6	63.7	0	0	0	0	113.5
125	D	33.4	Very low	29.3	Very low	149 Å²	149	145.7 Å²	145.7	80%	0.797	79%	0.785	S	S	*	*			trans	78.5	95.4	157	-52.4	-32.1	0	0	0	120.9
126	I	28.4	Very low	29.8	Very low	145 Å²	145	146.5 Å²	146.5	74%	0.744	78%	0.783	S	S	*	*			trans	-75.2	157.9	157.5	-31.9	176.5	0	0	0	108.7	L128	I126-L128 HydrophobicContact CG2-CG 4.47Å
127	P	29.7	Very low	29.8	Very low	128 Å²	128	149.3 Å²	149.3	83%	0.831	79%	0.794	S	S	*	*				-140.8	160.2	104.3	32.3	-16.5	0	0	0	115.9
128	L	25.4	Very low	30.1	Very low	161 Å²	161	153.5 Å²	153.5	84%	0.843	80%	0.799	S	S	*	*			trans	-84.6	142.7	-172.5	-62.3	151.9	0	0	0	113.3	I126	I126-L128 HydrophobicContact CG2-CG 4.47Å
129	S	31	Very low	30.3	Very low	112 Å²	112	152.1 Å²	152.1	78%	0.783	80%	0.801	S	S	*	*			trans	-179.7	147.2	141.6	59.1	0	0	0	0	110.5
130	S	28.9	Very low	30.2	Very low	85 Å²	85	152.2 Å²	152.2	59%	0.594	80%	0.796	S	S	*	*			cis	-178.6	144.6	-25	49.9	0	0	0	0	107
131	N	28.5	Very low	30.3	Very low	143 Å²	143	148.6 Å²	148.6	77%	0.765	79%	0.792	S	S	*	*			trans	71.3	113.3	167.7	-36.3	-37.7	0	0	0	116
132	D	35.3	Very low	30.2	Very low	167 Å²	167	148.6 Å²	148.6	89%	0.893	80%	0.798	S	S	*	*				-158	138.8	88.7	-89.3	-27	0	0	0	110.2
133	E	30	Very low	30	Very low	148 Å²	148	147 Å²	147	69%	0.692	79%	0.793	S	S	*	*			trans	-92	132.8	-177.6	-75.2	-111.1	145.7	0	0	111
134	D	34.8	Very low	29.9	Very low	167 Å²	167	143.8 Å²	143.8	89%	0.893	79%	0.785	S	S	*	*			trans	-146.8	86.5	151	-115.9	-25.3	0	0	0	109.4
135	R	28.6	Very low	30.1	Very low	201 Å²	201	148.3 Å²	148.3	76%	0.758	79%	0.793	S	S	*	*			trans	-82.8	124.4	175.2	-82.9	174.5	156.6	-176.2	-4.5	110.5
136	I	33.5	Very low	29.9	Very low	163 Å²	163	149.3 Å²	149.3	84%	0.836	79%	0.792	S	S	*	*			trans	-120.2	131	154.6	-57.8	-178.4	0	0	0	107.9
137	N	29.3	Very low	29.7	Very low	149 Å²	149	150.6 Å²	150.6	80%	0.797	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-64.1	133.2	-163.4	-61.6	-38.6	0	0	0	113.8
138	F	29.5	Very low	29.7	Very low	205 Å²	205	151.1 Å²	151.1	90%	0.899	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-92.8	124.9	146.2	-100.5	-95.4	0	0	0	107.7
139	D	32.3	Very low	29.8	Very low	154 Å²	154	150.3 Å²	150.3	82%	0.824	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-83.4	145.2	174.7	-152.3	-10.5	0	0	0	110.4
140	V	28.2	Very low	29.6	Very low	112 Å²	112	152.4 Å²	152.4	68%	0.679	80%	0.798	S	S	*	*			trans	-103.8	109.1	-167.4	178.1	0	0	0	0	109.8
141	S	29.5	Very low	29.5	Very low	112 Å²	112	153.5 Å²	153.5	78%	0.783	81%	0.806	S	S	*	*			trans	-143.5	-5.5	170.5	-72	0	0	0	0	115.1	I143	S141-I143 PolarHBondContact O-N 2.69Å; S141-I143 VanDerWaalsContact O-N 3.1Å
142	D	29.6	Very low	29.5	Very low	169 Å²	169	151.9 Å²	151.9	90%	0.904	80%	0.803	S	S	*	*			trans	-84.5	78.4	175.5	-78.6	-36.5	0	0	0	112.6
143	I	27.6	Very low	29.1	Very low	144 Å²	144	152.1 Å²	152.1	74%	0.738	80%	0.796	S	S	*	*			trans	-132.4	76.2	160.1	-51.5	179.4	0	0	0	109.4	S141	S141-I143 PolarHBondContact O-N 2.69Å; S141-I143 VanDerWaalsContact O-N 3.1Å
144	S	27	Very low	29.2	Very low	107 Å²	107	150.9 Å²	150.9	75%	0.748	80%	0.804	S	S	*	*			trans	160.2	100.9	143.9	-76.8	0	0	0	0	111.7
145	K	31.3	Very low	28.7	Very low	194 Å²	194	146.8 Å²	146.8	84%	0.843	80%	0.802	S	S	*	*			trans	178	148.8	134	-95.6	151.9	-169.7	178	0	113
146	Q	30	Very low	28.8	Very low	169 Å²	169	146.3 Å²	146.3	79%	0.79	81%	0.808	S	S	*	*			trans	47.3	88.1	166.9	-91.7	65.7	14.5	0	0	119.1
147	L	24.4	Very low	28.5	Very low	172 Å²	172	146.4 Å²	146.4	90%	0.901	80%	0.802	S	S	*	*			trans	-120.8	92.4	145.4	-174.5	96.9	0	0	0	108.5
148	V	29.9	Very low	28.4	Very low	139 Å²	139	148.5 Å²	148.5	84%	0.842	80%	0.804	S	S	*	*			trans	-138.2	138	167.7	-177.6	0	0	0	0	109.9
149	L	26.5	Very low	28.3	Very low	144 Å²	144	142.9 Å²	142.9	75%	0.754	80%	0.796	S	S	*	*			trans	-95.2	148.2	-174.9	-76.3	156.7	0	0	0	111.9
150	L	26.5	Very low	27.9	Very low	156 Å²	156	141.6 Å²	141.6	82%	0.817	79%	0.794	S	S	*	*			trans	70	153.1	145.6	-64.4	162.3	0	0	0	120.7
151	S	27.2	Very low	27.8	Very low	109 Å²	109	143 Å²	143	76%	0.762	80%	0.796	S	S	*	*			trans	66.1	120.5	165.5	43.2	0	0	0	0	120
152	P	28.4	Very low	27.6	Very low	109 Å²	109	148.9 Å²	148.9	71%	0.708	80%	0.801	S	S	*	*			trans	-79.9	175.2	152.1	35.2	-30.3	0	0	0	111
153	F	28.1	Very low	27.5	Very low	171 Å²	171	144.9 Å²	144.9	75%	0.75	79%	0.787	S	S	*	*			trans	70.5	104.2	-177	-59.5	-87.8	0	0	0	116.8
154	S	30.8	Very low	27.5	Very low	122 Å²	122	147.1 Å²	147.1	85%	0.853	79%	0.794	S	S	*	*				-175.6	131.3	100.9	61.5	0	0	0	0	110.5
155	G	25.4	Very low	27.6	Very low	82 Å²	82	146.5 Å²	146.5	85%	0.845	79%	0.79	S	S	*	*			trans	-107.8	95	168.6	0	0	0	0	0	109.5
156	E	30.3	Very low	27.6	Very low	190 Å²	190	144.7 Å²	144.7	89%	0.888	79%	0.789	S	S	*	*			trans	-160.8	177	152.1	-118.2	-175.6	-174.7	0	0	113
157	K	27.8	Very low	27.4	Very low	166 Å²	166	146.8 Å²	146.8	72%	0.722	79%	0.791	S	S	*	*			trans	-102.2	160.2	-149	-60.8	166.3	-177.5	159.5	0	115.6
158	F	26.6	Very low	27.5	Very low	192 Å²	192	145.2 Å²	145.2	84%	0.842	79%	0.789	S	S	*	*			trans	115.2	151.5	139.7	-74.7	-67.3	0	0	0	121.2
159	A	26.7	Very low	27.6	Very low	88 Å²	88	142.7 Å²	142.7	73%	0.727	78%	0.775	S	S	*	*			trans	78.4	82.5	170.6	0	0	0	0	0	116.9
160	T	24	Very low	27.4	Very low	127 Å²	127	143.7 Å²	143.7	78%	0.779	78%	0.778	S	S	*	*				81.3	120.9	72.6	-60.3	0	0	0	0	114.4
161	I	25.6	Very low	27.3	Very low	142 Å²	142	141.9 Å²	141.9	73%	0.728	77%	0.774	S	S	*	*				179.6	120.9	127.9	-90.1	154.3	0	0	0	110.2
162	R	25.1	Very low	27.2	Very low	235 Å²	235	141.6 Å²	141.6	89%	0.887	77%	0.771	S	S	*	*			trans	59.3	140.4	160.2	-73.5	172.9	174.8	146.8	-1.3	119.1
163	S	27.8	Very low	27.2	Very low	85 Å²	85	142 Å²	142	59%	0.594	78%	0.777	S	S	*	*			cis	-166.5	139.8	0.5	39.7	0	0	0	0	111.2
164	E	28.5	Very low	27	Very low	190 Å²	190	142.5 Å²	142.5	89%	0.888	78%	0.779	S	S	*	*			trans	59.7	149.4	147.8	-64.8	158.9	-149.2	0	0	118.5
165	S	29	Very low	26.7	Very low	95 Å²	95	143.3 Å²	143.3	66%	0.664	77%	0.773	S	S	*	*			cis	-166.3	162.3	-20.2	66	0	0	0	0	106.2
166	N	31.4	Very low	26.7	Very low	156 Å²	156	145.2 Å²	145.2	83%	0.834	77%	0.769	S	S	*	*			cis	-140.7	169.1	8.4	-96.2	-55.6	0	0	0	110.8
167	Y	25.5	Very low	26.5	Very low	212 Å²	212	142.3 Å²	142.3	83%	0.831	76%	0.755	S	S	*	*			trans	-93	167.1	161.4	-133.9	-109.2	0	0	0	109.4
168	V	27	Very low	26.4	Very low	139 Å²	139	143.2 Å²	143.2	84%	0.842	75%	0.754	S	S	*	*			trans	-173.7	147.1	133.8	139.3	0	0	0	0	110.7
169	P	30.4	Very low	26.5	Very low	86 Å²	86	139.8 Å²	139.8	56%	0.558	74%	0.744	S	S	*	*			trans	-127.5	-159.9	-154.8	34.6	-12.2	0	0	0	113.9
170	M	23.7	Very low	26.7	Very low	165 Å²	165	143 Å²	143	81%	0.813	75%	0.75	S	S	*	*			trans	73.8	152.2	168.6	-53.4	-78.3	-96.5	0	0	113.9
171	T	23.9	Very low	27.1	Very low	119 Å²	119	140.3 Å²	140.3	73%	0.73	75%	0.747	S	S	*	*			cis	-158.4	175.9	1.2	0.4	0	0	0	0	110.7
172	S	25.7	Very low	27.2	Very low	102 Å²	102	139.5 Å²	139.5	71%	0.713	75%	0.752	S	S	*	*			trans	-73.1	145.4	-180	53.1	0	0	0	0	117.8
173	S	28	Very low	27.5	Very low	117 Å²	117	134.2 Å²	134.2	82%	0.818	75%	0.746	S	S	*	*			trans	-161.5	128.7	142.9	48.6	0	0	0	0	107.1
174	F	23.1	Very low	27.5	Very low	182 Å²	182	140.5 Å²	140.5	80%	0.798	76%	0.756	S	S	*	*			cis	71	116.8	45.4	-87.2	-69.7	0	0	0	116.8
175	L	25.2	Very low	27.7	Very low	140 Å²	140	136 Å²	136	73%	0.733	75%	0.746	S	S	*	*			trans	84.6	121.1	154.5	-62.4	170.8	0	0	0	121.5
176	T	24.5	Very low	27.8	Very low	122 Å²	122	135.1 Å²	135.1	75%	0.748	74%	0.74	S	S	*	*			trans	65.8	146.6	139.5	53.4	0	0	0	0	118.9
177	E	26.7	Very low	27.7	Very low	129 Å²	129	134 Å²	134	60%	0.603	73%	0.734	S	S	*	*			cis	-162.7	157.7	20.9	-132	176.4	-169.7	0	0	110.2
178	R	26.3	Very low	27.8	Very low	184 Å²	184	129.5 Å²	129.5	69%	0.694	73%	0.728	S	S	*	*			trans	38.5	146.8	149.4	-67.8	-178.8	-158.3	108.8	18.8	121.5
179	D	28.8	Very low	27.8	Very low	120 Å²	120	131.5 Å²	131.5	64%	0.642	73%	0.731	S	S	*	*			cis	-168.5	160.4	0.1	-108.9	-23.6	0	0	0	111
180	N	30.6	Very low	27.7	Very low	157 Å²	157	136.1 Å²	136.1	84%	0.84	75%	0.745	S	S	*	*			trans	61.8	125.4	157.2	-57.9	-35.1	0	0	0	120.9
181	G	31.3	Very low	27.8	Very low	70 Å²	70	140.2 Å²	140.2	72%	0.722	75%	0.751	S	S	*	*			cis	169	151.3	-9.4	0	0	0	0	0	115.3
182	C	28.5	Very low	28	Very low	125 Å²	125	139.5 Å²	139.5	85%	0.845	75%	0.751	S	S	*	*			trans	58.2	142.1	153.3	-97.6	0	0	0	0	120.6
183	V	31.5	Very low	28	Very low	124 Å²	124	141.4 Å²	141.4	75%	0.752	76%	0.758	S	S	*	*			cis	-143.5	119.7	14.3	-168.6	0	0	0	0	107.1
184	R	28.7	Very low	28	Very low	216 Å²	216	142.9 Å²	142.9	82%	0.815	76%	0.756	S	S	*	*				44.6	139.2	93.6	-81.3	-166.3	179.9	-158	-0.5	115.5
185	S	31.3	Very low	28.2	Very low	96 Å²	96	141.9 Å²	141.9	67%	0.671	75%	0.754	S	S	*	*			cis	-159.1	170.9	19.6	-104.9	0	0	0	0	109.3
186	S	32.1	Very low	28.3	Very low	77 Å²	77	141.2 Å²	141.2	54%	0.538	76%	0.758	S	S	.	*			cis	177.5	155.6	-19.9	-90.6	0	0	0	0	107
187	D	28.9	Very low	28.5	Very low	131 Å²	131	143.8 Å²	143.8	70%	0.701	76%	0.759	S	S	*	*			cis	-157.1	121	-29.6	-82.8	-43.9	0	0	0	104.4
188	V	28.1	Very low	28.5	Very low	119 Å²	119	146.3 Å²	146.3	72%	0.721	77%	0.77	S	S	*	*				61.5	91.6	83.2	-176.1	0	0	0	0	114.6
189	M	26.5	Very low	28.6	Very low	180 Å²	180	144.5 Å²	144.5	89%	0.887	77%	0.773	S	S	*	*				24.6	104.9	125	-163.1	160.4	74.6	0	0	117.3
190	Q	28.7	Very low	28.4	Very low	184 Å²	184	144.1 Å²	144.1	86%	0.86	78%	0.775	S	S	*	*			trans	-108.2	120.1	164.4	-78.1	-172.3	-15.2	0	0	111.5
191	R	26.3	Very low	28.3	Very low	251 Å²	251	142.4 Å²	142.4	95%	0.947	77%	0.77	S	S	*	*			trans	-65.6	129.9	159.8	-80.7	173.3	163.6	164.8	-6.5	108.9
192	S	27.7	Very low	28.2	Very low	103 Å²	103	144.7 Å²	144.7	72%	0.72	77%	0.77	S	S	*	*			trans	-120.7	111.8	162.5	32.4	0	0	0	0	109.4
193	T	25.4	Very low	28.1	Very low	142 Å²	142	146.5 Å²	146.5	87%	0.871	77%	0.768	S	S	*	*			trans	-65.7	129.6	170.6	43.7	0	0	0	0	110.3
194	L	27.8	Very low	28.3	Very low	148 Å²	148	146 Å²	146	78%	0.775	77%	0.767	S	S	*	*			trans	-132.1	137.1	173.2	-96.4	158.1	0	0	0	110.9
195	H	27.8	Very low	28.5	Very low	162 Å²	162	142 Å²	142	75%	0.75	77%	0.767	S	S	*	*			trans	-62.4	158.1	-173.5	-78.3	-100.2	0	0	0	113.8	K197	H195-K197 PolarHBondContact O-N 3.42Å
196	P	27	Very low	28.7	Very low	125 Å²	125	144.5 Å²	144.5	81%	0.812	78%	0.778	S	S	*	*			trans	-64.6	101.6	162.3	29.8	-33.2	0	0	0	108.6	H198	P196-H198 PolarHBondContact O-N 2.88Å
197	K	28.1	Very low	28.8	Very low	176 Å²	176	148.9 Å²	148.9	77%	0.765	79%	0.79	S	S	*	*			trans	-75.3	117.6	169.4	-76	-175.4	175.7	-179.5	0	108.2	H195 I199	H195-K197 PolarHBondContact O-N 3.42Å; K197-I199 PolarHBondContact O-N 3.38Å; K197-I199 VanDerWaalsContact O-N 3.08Å
198	H	27	Very low	28.8	Very low	182 Å²	182	151 Å²	151	84%	0.843	80%	0.801	S	S	*	*			trans	-50.7	115	156	-95.6	-103.7	0	0	0	108.2	P196 T200	P196-H198 PolarHBondContact O-N 2.88Å; H198-T200 VanDerWaalsContact C-N 3.3Å; H198-T200 PolarHBondContact O-N 2.87Å; H198-T200 VanDerWaalsContact O-N 3.14Å
199	I	28	Very low	28.9	Very low	147 Å²	147	149 Å²	149	75%	0.754	80%	0.804	S	S	*	*			trans	-83.2	86.3	167.9	-59.3	179.1	0	0	0	106.5	K197 V201	K197-I199 PolarHBondContact O-N 3.38Å; K197-I199 VanDerWaalsContact O-N 3.08Å; I199-V201 HydrophobicContact CG2-CG2 3.93Å; I199-V201 PolarHBondContact O-N 3.15Å; I199-V201 VanDerWaalsContact O-N 3.14Å
200	T	26.1	Very low	29.1	Very low	112 Å²	112	149.1 Å²	149.1	69%	0.687	81%	0.807	S	S	*	*			trans	-66	105.2	160.8	-54.8	0	0	0	0	107	H198 T202	H198-T200 VanDerWaalsContact C-N 3.3Å; H198-T200 PolarHBondContact O-N 2.87Å; H198-T200 VanDerWaalsContact O-N 3.14Å; T200-T202 VanDerWaalsContact C-N 3.32Å; T200-T202 PolarHBondContact O-N 3.38Å
201	V	27.8	Very low	29.1	Very low	121 Å²	121	145.7 Å²	145.7	73%	0.733	80%	0.804	S	S	*	*			trans	-75.4	89.6	174.5	-178.4	0	0	0	0	108.2	I199 M203	I199-V201 HydrophobicContact CG2-CG2 3.93Å; I199-V201 PolarHBondContact O-N 3.15Å; I199-V201 VanDerWaalsContact O-N 3.14Å; V201-M203 PolarHBondContact O-N 3.15Å
202	T	29	Very low	29.4	Very low	117 Å²	117	139 Å²	139	72%	0.718	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-68.8	122.1	170.8	-39.2	0	0	0	0	108.9	T200 P204	T200-T202 VanDerWaalsContact C-N 3.32Å; T200-T202 PolarHBondContact O-N 3.38Å; T202-P204 WeakPolarHBondContact O-CD 3.15Å
203	M	27.2	Very low	29.5	Very low	164 Å²	164	137.6 Å²	137.6	81%	0.808	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-56.8	123.2	176.5	-73.3	-77.8	-75.5	0	0	111.1	V201 T205	V201-M203 PolarHBondContact O-N 3.15Å; M203-T205 PolarHBondContact O-N 3.41Å
204	P	36	Very low	29.7	Very low	114 Å²	114	136.4 Å²	136.4	74%	0.74	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-75.9	120.8	168.4	29.8	-30.9	0	0	0	109.8	T202	T202-P204 WeakPolarHBondContact O-CD 3.15Å
205	T	32.3	Very low	29.9	Very low	131 Å²	131	137.7 Å²	137.7	80%	0.804	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-68.8	126.8	172.1	43.9	0	0	0	0	110.8	M203	M203-T205 PolarHBondContact O-N 3.41Å
206	V	34.3	Very low	30.1	Very low	148 Å²	148	135.1 Å²	135.1	90%	0.897	80%	0.803	S	S	*	*			trans	-82.4	115.8	169.5	-83.2	0	0	0	0	110.4
207	E	34.2	Very low	30.2	Very low	169 Å²	169	132.9 Å²	132.9	79%	0.79	80%	0.803	S	S	*	*			trans	-110.2	155	158.6	-68.3	-157.8	154.7	0	0	109.6
208	D	28.8	Very low	30.2	Very low	176 Å²	176	129.6 Å²	129.6	94%	0.941	80%	0.802	S	S	*	*			trans	-62.7	135	-164.9	-61	-73.1	0	0	0	114.5
209	G	30.9	Very low	30.4	Very low	76 Å²	76	126.5 Å²	126.5	78%	0.784	80%	0.798	S	S	*	*			trans	-153.5	87.7	-177.1	0	0	0	0	0	112.9
210	L	29.8	Very low	30.3	Very low	183 Å²	183	124.6 Å²	124.6	96%	0.958	80%	0.796	S	S	*	*			trans	-61.9	132.9	177.8	-64.1	160.4	0	0	0	112.6
211	S	29.9	Very low	30.5	Very low	113 Å²	113	126.5 Å²	126.5	79%	0.79	80%	0.802	S	S	*	*			trans	-158.6	124.7	141.3	-167.3	0	0	0	0	112.8
212	S	32.5	Very low	30.4	Very low	110 Å²	110	126.6 Å²	126.6	77%	0.769	80%	0.803	S	S	*	*			trans	-50.1	159	152.4	46.2	0	0	0	0	112.1
213	G	29.4	Very low	30.4	Very low	73 Å²	73	127.1 Å²	127.1	75%	0.753	81%	0.811	S	S	*	*			cis	131.3	130.7	7.1	0	0	0	0	0	110.4
214	S	31	Very low	30.4	Very low	117 Å²	117	130.6 Å²	130.6	82%	0.818	82%	0.815	S	S	*	*			trans	-165	69.1	171.1	61.9	0	0	0	0	112.2
215	D	31.7	Very low	30.2	Very low	176 Å²	176	130.6 Å²	130.6	94%	0.941	82%	0.818	S	S	*	*			trans	-75.9	123.8	155.6	-107.2	-35.1	0	0	0	108.1
216	S	31.8	Very low	29.9	Very low	107 Å²	107	134.8 Å²	134.8	75%	0.748	82%	0.819	S	S	*	*			trans	-119.9	47.8	176.6	55.3	0	0	0	0	112.2	S218	S216-S218 PolarHBondContact O-N 2.92Å
217	G	27.8	Very low	29.8	Very low	79 Å²	79	133.2 Å²	133.2	81%	0.814	81%	0.809	S	S	*	*			trans	-64.8	100.9	161.7	0	0	0	0	0	110.7
218	S	29	Very low	29.6	Very low	107 Å²	107	133.2 Å²	133.2	75%	0.748	81%	0.807	S	S	*	*			trans	-108.6	131	175.8	-61.6	0	0	0	0	110.6	S216	S216-S218 PolarHBondContact O-N 2.92Å
219	P	30.8	Very low	29.7	Very low	116 Å²	116	130.3 Å²	130.3	75%	0.753	79%	0.791	S	S	*	*			trans	-101	-162.4	-170.6	38	-32.5	0	0	0	113.2
220	C	26.8	Very low	29.7	Very low	108 Å²	108	131.9 Å²	131.9	73%	0.73	79%	0.79	S	S	*	*			trans	88.7	150	165.9	-56.3	0	0	0	0	117.1
221	L	29.4	Very low	29.8	Very low	152 Å²	152	127.6 Å²	127.6	80%	0.796	78%	0.775	S	S	*	*			cis	-159.3	164.9	-15.4	-113.3	168.5	0	0	0	110.1
222	T	25.9	Very low	29.9	Very low	123 Å²	123	132.1 Å²	132.1	76%	0.755	78%	0.781	S	S	*	*			trans	-63.5	151.6	-178.7	55	0	0	0	0	116.1
223	S	28.9	Very low	29.8	Very low	127 Å²	127	132.7 Å²	132.7	89%	0.888	78%	0.776	S	S	*	*			trans	-159.9	148.9	132.7	35.9	0	0	0	0	113.9
224	R	26.6	Very low	29.9	Very low	237 Å²	237	135 Å²	135	89%	0.894	77%	0.768	S	S	*	*			trans	-94.7	148.5	-170.8	-68.5	159.8	148.3	170.3	-6.6	112.8
225	S	31.8	Very low	30	Very low	114 Å²	114	136.3 Å²	136.3	80%	0.797	76%	0.755	S	S	*	*			trans	-169	91.1	139.8	-175.6	0	0	0	0	110.7
226	R	27.6	Very low	29.9	Very low	220 Å²	220	131.9 Å²	131.9	83%	0.83	74%	0.738	S	S	*	*				57.4	126.2	90.2	-101.1	-169.4	-174.9	-168	2.6	116.8
227	V	31.5	Very low	29.9	Very low	114 Å²	114	136 Å²	136	69%	0.691	74%	0.743	S	S	*	*			trans	101.5	104.5	139.7	170.3	0	0	0	0	119.9
228	K	29.4	Very low	30	Very low	170 Å²	170	137.5 Å²	137.5	74%	0.739	74%	0.741	S	S	*	*			trans	65.5	152.7	134.6	-65.4	-173.5	158.4	-138.7	0	120.6
229	D	31.3	Very low	30	Very low	114 Å²	114	136 Å²	136	61%	0.61	74%	0.743	S	S	*	*			cis	-164.3	159.6	-11	-96.7	-23.3	0	0	0	107.9
230	S	31.9	Very low	30	Very low	110 Å²	110	136.1 Å²	136.1	77%	0.769	75%	0.746	S	S	*	*			trans	58.4	127.8	157.1	54.4	0	0	0	0	120.1
231	S	31.5	Very low	30.5	Very low	93 Å²	93	136.1 Å²	136.1	65%	0.65	75%	0.745	S	S	*	*			cis	106.1	122.1	31.4	70.9	0	0	0	0	113.1
232	F	31.3	Very low	30.3	Very low	208 Å²	208	136.3 Å²	136.3	91%	0.912	75%	0.747	S	S	*	*				174.1	136.3	119.7	-105.5	-75.5	0	0	0	113.5
233	D	29.7	Very low	30.5	Very low	122 Å²	122	135.7 Å²	135.7	65%	0.652	75%	0.747	S	S	*	*			trans	-86.4	160.9	178.6	-103.4	-52.3	0	0	0	114.1
234	M	32.2	Very low	30.5	Very low	120 Å²	120	136.1 Å²	136.1	59%	0.591	74%	0.744	S	S	*	*				178.3	121.7	116.6	-91	-121.8	173.7	0	0	115
235	R	32.2	Very low	30.7	Very low	145 Å²	145	130 Å²	130	55%	0.547	73%	0.733	S	S	.	*			trans	52.7	156	132.4	-61	-173.2	-171.5	155.7	9.6	121.5	N701 N702	R235-N701 PolarHBondContact NH2-O 2.89Å; R235-N702 VanDerWaalsContact NH2-N 3.12Å
236	S	31.3	Very low	30.4	Very low	83 Å²	83	132.4 Å²	132.4	58%	0.58	74%	0.737	S	S	*	*			cis	174.9	161.6	-27.4	-83.8	0	0	0	0	106.5
237	F	31.1	Very low	30.5	Very low	193 Å²	193	128.4 Å²	128.4	85%	0.846	73%	0.731	S	S	*	*			trans	70.1	151.5	167.5	-54	-75.1	0	0	0	116.7
238	S	29.1	Very low	30.4	Very low	111 Å²	111	132.8 Å²	132.8	78%	0.776	74%	0.737	S	S	*	*			cis	-176.5	148.8	-24.2	52.8	0	0	0	0	108.1
239	G	30.7	Very low	30.4	Very low	77 Å²	77	130.4 Å²	130.4	79%	0.794	74%	0.74	S	S	*	*			trans	130.9	100.1	159.7	0	0	0	0	0	115.6
240	S	29	Very low	30.4	Very low	117 Å²	117	129 Å²	129	82%	0.818	75%	0.752	S	S	*	*			trans	-66.8	161.7	143.8	-33	0	0	0	0	108.5
241	P	37.3	Very low	30.3	Very low	108 Å²	108	134.8 Å²	134.8	70%	0.701	76%	0.757	S	S	*	*				-143.8	164.3	58.2	37	-16.7	0	0	0	117.1
242	D	26.2	Very low	30.2	Very low	157 Å²	157	135.7 Å²	135.7	84%	0.84	76%	0.761	S	S	*	*			trans	28.8	107.8	139.9	-45.2	-23.9	0	0	0	119.8
243	S	30.3	Very low	29.9	Very low	110 Å²	110	131 Å²	131	77%	0.769	75%	0.749	S	S	*	*				-164.7	126.1	129.9	63.6	0	0	0	0	113.7
244	V	27.8	Very low	30	Very low	135 Å²	135	131.9 Å²	131.9	82%	0.818	75%	0.753	S	S	*	*			trans	-24.8	128.7	150.6	178.3	0	0	0	0	114.2
245	T	31	Very low	29.8	Very low	109 Å²	109	133.2 Å²	133.2	67%	0.669	76%	0.762	S	S	*	*			trans	-174.7	126.8	132.8	14.5	0	0	0	0	112.6	I247	T245-I247 PolarHBondContact O-N 3.27Å
246	D	25.2	Very low	29.7	Very low	164 Å²	164	131 Å²	131	88%	0.877	77%	0.769	S	S	*	*			trans	-61.2	122.7	159	-71.4	-66.8	0	0	0	110.3
247	I	31.4	Very low	29.6	Very low	137 Å²	137	138 Å²	138	70%	0.703	78%	0.783	S	S	*	*			trans	-132	104.1	169.1	-65.1	-173.5	0	0	0	111	T245	T245-I247 PolarHBondContact O-N 3.27Å
248	Y	29.2	Very low	29.3	Very low	205 Å²	205	133.3 Å²	133.3	80%	0.804	77%	0.774	S	S	*	*			trans	54.6	111.2	139.2	-79.4	-109.3	0	0	0	118.9
249	C	27.7	Very low	29.3	Very low	121 Å²	121	137.1 Å²	137.1	82%	0.818	78%	0.78	S	S	*	*				76.8	120.6	87.5	-67	0	0	0	0	115.1
250	G	32.8	Very low	29.1	Very low	83 Å²	83	138.5 Å²	138.5	86%	0.856	78%	0.777	S	S	*	*			trans	-170.2	30	-179.5	0	0	0	0	0	118.3
251	R	28.6	Very low	29.3	Very low	232 Å²	232	141.1 Å²	141.1	88%	0.875	78%	0.781	S	S	*	*			trans	-91.7	138	158.2	-99.9	-174	176.9	-176.8	0.9	108
252	P	29.5	Very low	28.9	Very low	112 Å²	112	143.8 Å²	143.8	73%	0.727	79%	0.789	S	S	*	*				-136.9	137.9	87.9	10.9	13.1	0	0	0	113.4
253	T	26.4	Very low	29.1	Very low	109 Å²	109	139.5 Å²	139.5	67%	0.669	78%	0.782	S	S	*	*				47.6	131.1	92.7	70.1	0	0	0	0	116.8
254	I	30.9	Very low	29.2	Very low	142 Å²	142	143 Å²	143	73%	0.728	79%	0.787	S	S	*	*				172.4	123.6	120.8	-90.4	157.5	0	0	0	110.8
255	N	27.4	Very low	29.8	Very low	147 Å²	147	145 Å²	145	79%	0.786	79%	0.787	S	S	*	*			trans	49.9	145.7	144.7	-59.3	-5.5	0	0	0	120.8
256	S	31.4	Very low	30.1	Very low	100 Å²	100	146.5 Å²	146.5	70%	0.699	79%	0.79	S	S	*	*			cis	-170.1	157.3	6	36	0	0	0	0	111.9
257	R	28.3	Very low	30.9	Very low	228 Å²	228	146.3 Å²	146.3	86%	0.86	79%	0.788	S	S	*	*			trans	64.9	110.9	145.7	-81.7	179.3	173.1	176.7	-3.6	119.4
258	S	25.9	Very low	31.5	Very low	96 Å²	96	144.4 Å²	144.4	67%	0.671	78%	0.779	S	S	*	*				40.3	118.7	127.5	61.3	0	0	0	0	119.2
259	E	29	Very low	32.4	Very low	190 Å²	190	138.4 Å²	138.4	89%	0.888	77%	0.765	S	S	*	*				-163.1	150.2	100.2	-103.1	161.6	-166.7	0	0	111.1
260	S	25.7	Very low	33.5	Very low	106 Å²	106	134.8 Å²	134.8	74%	0.741	74%	0.744	S	S	*	*			trans	-82.6	140.4	176	51.1	0	0	0	0	110.7
261	L	33.4	Very low	34.3	Very low	173 Å²	173	135.8 Å²	135.8	91%	0.906	73%	0.729	S	S	*	*			trans	-157.4	111.9	154.3	-108.6	161.3	0	0	0	109.5
262	D	28.1	Very low	35.5	Very low	163 Å²	163	129.3 Å²	129.3	87%	0.872	72%	0.715	S	S	*	*			trans	-65.1	144.3	166.3	-57.4	-70.9	0	0	0	109.8
263	G	31.4	Very low	36.4	Very low	67 Å²	67	130.6 Å²	130.6	69%	0.691	71%	0.711	S	S	*	*			trans	-162.3	85	-175.4	0	0	0	0	0	112.5
264	E	32.4	Very low	37.8	Very low	184 Å²	184	129.7 Å²	129.7	86%	0.86	70%	0.702	S	S	*	*			trans	-64.4	135.8	171.9	-61.6	-173.9	137.2	0	0	111.7
265	H	40.1	Very low	39.3	Very low	177 Å²	177	127.6 Å²	127.6	82%	0.819	69%	0.691	S	S	*	*			trans	-132.7	91.6	154.7	-85.3	-83.6	0	0	0	107.7
266	L	37.4	Very low	41	Very low	141 Å²	141	123.3 Å²	123.3	74%	0.738	67%	0.673	S	S	*	*				71.4	69.2	96	-77.1	162.8	0	0	0	114
267	L	42.8	Very low	42.8	Very low	160 Å²	160	124 Å²	124	84%	0.838	66%	0.664	S	S	*	*			trans	-71.4	131.8	148.7	-85.1	161.6	0	0	0	108.8
268	N	43.2	Very low	44.5	Very low	96 Å²	96	117.6 Å²	117.6	51%	0.513	65%	0.646	S	S	.	*			trans	-64.2	120.3	-166.9	-172.1	-3.6	0	0	0	111.9	A270 I271	N268-A270 PolarHBondContact O-N 3.32Å; N268-I271 HydrophobicContact CB-CD1 4.43Å; N268-I271 PolarHBondContact O-N 3.36Å; N268-I271 VanDerWaalsContact O-N 3.11Å
269	P	48.7	Very low	46.6	Very low	80 Å²	80	117.4 Å²	117.4	52%	0.519	64%	0.637	S	S	.	*	H	α-helix	trans	-64.2	-14.3	-173.5	24.1	-34.6	0	0	0	114.6	Q273	P269-Q273 WeakPolarHBondContact O-CB 3.44Å; P269-Q273 VanDerWaalsContact O-CG 3.29Å; P269-Q273 WeakPolarHBondContact O-CG 3.32Å; P269-Q273 PolarHBondContact O-N 3.19Å
270	A	49.1	Very low	48.1	Very low	45 Å²	45	113.1 Å²	113.1	37%	0.372	62%	0.618	S	S	.	*	H	α-helix	trans	-65.6	-44.8	172	0	0	0	0	0	112.6	N268 V272 Q273 D274	N268-A270 PolarHBondContact O-N 3.32Å; A270-V272 PolarHBondContact O-N 3.16Å; A270-Q273 PolarHBondContact O-N 2.87Å; A270-D274 PolarHBondContact O-N 3.48Å
271	I	49.6	Very low	50	Low	103 Å²	103	110.5 Å²	110.5	53%	0.528	60%	0.596	S	S	.	*	H	α-helix	trans	-71.4	-36.5	-173.6	-59.7	173.7	0	0	0	111	N268 Q273 D274 I275	N268-I271 HydrophobicContact CB-CD1 4.43Å; N268-I271 PolarHBondContact O-N 3.36Å; N268-I271 VanDerWaalsContact O-N 3.11Å; I271-Q273 VanDerWaalsContact C-N 3.34Å; I271-D274 PolarHBondContact O-N 3.21Å; I271-I275 HydrophobicContact CG2-CD1 3.98Å; I271-I275 WeakPolarHBondContact O-CG1 3.37Å; I271-I275 PolarHBondContact O-N 2.73Å
272	V	53.9	Low	51.2	Low	96 Å²	96	107 Å²	107	58%	0.582	58%	0.577	S	S	*	*	H	α-helix	trans	-70.1	-32.8	174.3	-177.5	0	0	0	0	111.1	A270 S276	A270-V272 PolarHBondContact O-N 3.16Å; V272-S276 WeakPolarHBondContact O-CB 3.39Å; V272-S276 PolarHBondContact O-N 3.47Å
273	Q	49.1	Very low	52.6	Low	139 Å²	139	106.6 Å²	106.6	65%	0.65	57%	0.567	S	S	*	*	H	α-helix	trans	-71.2	-41.1	173.1	-78.2	-177.8	7.3	0	0	112.4	P269 A270 I271 S276 K277	P269-Q273 WeakPolarHBondContact O-CB 3.44Å; P269-Q273 VanDerWaalsContact O-CG 3.29Å; P269-Q273 WeakPolarHBondContact O-CG 3.32Å; P269-Q273 PolarHBondContact O-N 3.19Å; A270-Q273 PolarHBondContact O-N 2.87Å; I271-Q273 VanDerWaalsContact C-N 3.34Å; Q273-S276 PolarHBondContact O-N 2.97Å; Q273-K277 WeakPolarHBondContact O-CB 3.46Å; Q273-K277 PolarHBondContact O-N 3.48Å
274	D	55.4	Low	53.7	Low	90 Å²	90	110.6 Å²	110.6	48%	0.481	56%	0.561	S	S	.	*	H	α-helix	trans	-67.5	-44.9	177.9	-73.5	-27.7	0	0	0	111.4	A270 I271 S276 K277 D278	A270-D274 PolarHBondContact O-N 3.48Å; I271-D274 PolarHBondContact O-N 3.21Å; D274-S276 VanDerWaalsContact C-N 3.31Å; D274-S276 PolarHBondContact O-N 3.29Å; D274-K277 CarbonylContact O-C 3.57Å; D274-K277 PolarHBondContact O-N 3Å; D274-K277 VanDerWaalsContact O-N 3.1Å; D274-D278 WeakPolarHBondContact O-CB 3.31Å; D274-D278 PolarHBondContact O-N 3.28Å
275	I	62	Low	54.7	Low	98 Å²	98	107 Å²	107	50%	0.503	55%	0.552	S	S	.	*	H	α-helix	trans	-62.4	-38.8	173.6	-65.2	168.5	0	0	0	111.3	I271 K277 I279	I271-I275 HydrophobicContact CG2-CD1 3.98Å; I271-I275 WeakPolarHBondContact O-CG1 3.37Å; I271-I275 PolarHBondContact O-N 2.73Å; I275-K277 VanDerWaalsContact C-N 3.33Å; I275-I279 HydrophobicContact CG2-CD1 3.81Å; I275-I279 WeakPolarHBondContact O-CB 3.36Å; I275-I279 WeakPolarHBondContact O-CD1 3.41Å; I275-I279 WeakPolarHBondContact O-CG1 3.41Å; I275-I279 PolarHBondContact O-N 3.48Å
276	S	63.6	Low	55	Low	58 Å²	58	105.4 Å²	105.4	41%	0.406	55%	0.549	S	S	.	.	H	α-helix	trans	-68.8	-32	175.3	-173.1	0	0	0	0	112.6	V272 Q273 D274 M280	V272-S276 WeakPolarHBondContact O-CB 3.39Å; V272-S276 PolarHBondContact O-N 3.47Å; Q273-S276 PolarHBondContact O-N 2.97Å; D274-S276 VanDerWaalsContact C-N 3.31Å; D274-S276 PolarHBondContact O-N 3.29Å; S276-M280 VanDerWaalsContact O-CB 3.28Å; S276-M280 WeakPolarHBondContact O-CB 3.19Å; S276-M280 WeakPolarHBondContact O-CE 3.3Å; S276-M280 VanDerWaalsContact O-CG 3.31Å; S276-M280 WeakPolarHBondContact O-CG 3.47Å; S276-M280 PolarHBondContact O-N 3.01Å
277	K	68.8	Low	55.2	Low	115 Å²	115	101.7 Å²	101.7	50%	0.5	55%	0.545	S	S	.	.	H	α-helix	trans	-75.4	-41.9	177.5	-173.1	179.4	177.3	-168.8	0	111.4	Q273 D274 I275 M280 D281	Q273-K277 WeakPolarHBondContact O-CB 3.46Å; Q273-K277 PolarHBondContact O-N 3.48Å; D274-K277 CarbonylContact O-C 3.57Å; D274-K277 PolarHBondContact O-N 3Å; D274-K277 VanDerWaalsContact O-N 3.1Å; I275-K277 VanDerWaalsContact C-N 3.33Å; K277-M280 CarbonylContact O-C 3.49Å; K277-M280 PolarHBondContact O-N 3Å; K277-D281 VanDerWaalsContact O-CB 3.25Å; K277-D281 WeakPolarHBondContact O-CB 3.48Å; K277-D281 VanDerWaalsContact O-CG 3.22Å; K277-D281 PolarHBondContact O-N 3.09Å
278	D	64.9	Low	55.1	Low	93 Å²	93	97.8 Å²	97.8	50%	0.497	54%	0.536	S	S	.	.	H	α-helix	trans	-65.5	-40.9	173.7	-69.8	-17.5	0	0	0	111	D274 M280 D281 I282	D274-D278 WeakPolarHBondContact O-CB 3.31Å; D274-D278 PolarHBondContact O-N 3.28Å; D278-M280 VanDerWaalsContact C-N 3.34Å; D278-M280 PolarHBondContact O-N 2.69Å; D278-D281 PolarHBondContact O-N 3.03Å; D278-I282 VanDerWaalsContact O-CB 3.27Å; D278-I282 WeakPolarHBondContact O-CB 3.13Å; D278-I282 WeakPolarHBondContact O-CD1 3.48Å; D278-I282 WeakPolarHBondContact O-CG1 3.36Å; D278-I282 PolarHBondContact O-N 3.11Å
279	I	68.9	Low	54.7	Low	91 Å²	91	98.4 Å²	98.4	47%	0.467	55%	0.547	S	S	.	.	H	α-helix	trans	-65.5	-37	172.5	-69.6	169.2	0	0	0	111.4	I275 K283	I275-I279 HydrophobicContact CG2-CD1 3.81Å; I275-I279 WeakPolarHBondContact O-CB 3.36Å; I275-I279 WeakPolarHBondContact O-CD1 3.41Å; I275-I279 WeakPolarHBondContact O-CG1 3.41Å; I275-I279 PolarHBondContact O-N 3.48Å; I279-K283 WeakPolarHBondContact O-CB 3.25Å; I279-K283 WeakPolarHBondContact O-CG 3.29Å; I279-K283 PolarHBondContact O-N 2.78Å
280	M	61.9	Low	54	Low	101 Å²	101	101.3 Å²	101.3	50%	0.498	56%	0.559	S	S	.	*	H	α-helix	trans	-72.3	-33	174.1	-83	-168	-74.5	0	0	113.1	S276 K277 D278 K283 R284	S276-M280 VanDerWaalsContact O-CB 3.28Å; S276-M280 WeakPolarHBondContact O-CB 3.19Å; S276-M280 WeakPolarHBondContact O-CE 3.3Å; S276-M280 VanDerWaalsContact O-CG 3.31Å; S276-M280 WeakPolarHBondContact O-CG 3.47Å; S276-M280 PolarHBondContact O-N 3.01Å; K277-M280 CarbonylContact O-C 3.49Å; K277-M280 PolarHBondContact O-N 3Å; D278-M280 VanDerWaalsContact C-N 3.34Å; D278-M280 PolarHBondContact O-N 2.69Å; M280-K283 CarbonylContact O-C 3.52Å; M280-R284 WeakPolarHBondContact O-CB 3.4Å; M280-R284 PolarHBondContact O-N 3.35Å
281	D	66	Low	53.2	Low	50 Å²	50	107.8 Å²	107.8	27%	0.267	58%	0.581	S	S	.	*	H	α-helix	trans	-80.2	-34.3	-179.9	-73.6	3.7	0	0	0	110.4	K277 D278 R284 T285	K277-D281 VanDerWaalsContact O-CB 3.25Å; K277-D281 WeakPolarHBondContact O-CB 3.48Å; K277-D281 VanDerWaalsContact O-CG 3.22Å; K277-D281 PolarHBondContact O-N 3.09Å; D278-D281 PolarHBondContact O-N 3.03Å; D281-R284 PolarHBondContact O-N 2.81Å; D281-R284 IonicContact OD1-CZ 2.73Å; D281-R284 IonicContact OD1-NH1 2.67Å; D281-R284 PolarHBondContact OD1-NH1 3.19Å; D281-R284 IonicContact OD1-NH2 3.1Å; D281-R284 PolarHBondContact OD1-NH2 3.48Å; D281-T285 VanDerWaalsContact O-CB 3.31Å; D281-T285 WeakPolarHBondContact O-CB 3.37Å; D281-T285 PolarHBondContact O-N 3.48Å; D281-T285 PolarHBondContact O-OG1 2.64Å
282	I	58.6	Low	52.3	Low	101 Å²	101	107.9 Å²	107.9	52%	0.518	60%	0.597	S	S	.	*	H	α-helix	trans	-63.9	-44.2	166.6	-70.3	165.7	0	0	0	110.2	D278 R284 T285 L286	D278-I282 VanDerWaalsContact O-CB 3.27Å; D278-I282 WeakPolarHBondContact O-CB 3.13Å; D278-I282 WeakPolarHBondContact O-CD1 3.48Å; D278-I282 WeakPolarHBondContact O-CG1 3.36Å; D278-I282 PolarHBondContact O-N 3.11Å; I282-R284 VanDerWaalsContact C-N 3.34Å; I282-R284 PolarHBondContact O-N 2.86Å; I282-T285 PolarHBondContact O-N 3.1Å; I282-L286 HydrophobicContact CG2-CD1 3.79Å; I282-L286 WeakPolarHBondContact O-CB 3.42Å; I282-L286 PolarHBondContact O-N 3.36Å
283	K	57	Low	51.1	Low	154 Å²	154	112.6 Å²	112.6	67%	0.67	61%	0.61	S	S	*	*	H	α-helix	trans	-66.8	-30	172.5	-80.3	-177.6	174	-180	0	113.6	I279 M280 G287	I279-K283 WeakPolarHBondContact O-CB 3.25Å; I279-K283 WeakPolarHBondContact O-CG 3.29Å; I279-K283 PolarHBondContact O-N 2.78Å; M280-K283 CarbonylContact O-C 3.52Å; K283-G287 WeakPolarHBondContact O-CA 3.47Å; K283-G287 PolarHBondContact O-N 2.77Å
284	R	53.4	Low	50.3	Low	150 Å²	150	114.3 Å²	114.3	57%	0.566	62%	0.622	S	S	*	*	H	α-helix	trans	-76.7	-32.3	175.7	-160	-179.3	-53.6	121.2	19.9	111.6	M280 D281 I282 A288	M280-R284 WeakPolarHBondContact O-CB 3.4Å; M280-R284 PolarHBondContact O-N 3.35Å; D281-R284 PolarHBondContact O-N 2.81Å; D281-R284 IonicContact OD1-CZ 2.73Å; D281-R284 IonicContact OD1-NH1 2.67Å; D281-R284 PolarHBondContact OD1-NH1 3.19Å; D281-R284 IonicContact OD1-NH2 3.1Å; D281-R284 PolarHBondContact OD1-NH2 3.48Å; I282-R284 VanDerWaalsContact C-N 3.34Å; I282-R284 PolarHBondContact O-N 2.86Å; R284-A288 WeakPolarHBondContact O-CB 3.35Å; R284-A288 PolarHBondContact O-N 2.7Å
285	T	55.1	Low	49	Very low	108 Å²	108	119.1 Å²	119.1	66%	0.663	64%	0.635	S	S	*	*	H	α-helix	trans	-77.3	-38.9	176.4	-50.8	0	0	0	0	111.6	D281 I282	D281-T285 VanDerWaalsContact O-CB 3.31Å; D281-T285 WeakPolarHBondContact O-CB 3.37Å; D281-T285 PolarHBondContact O-N 3.48Å; D281-T285 PolarHBondContact O-OG1 2.64Å; I282-T285 PolarHBondContact O-N 3.1Å
286	L	46.3	Very low	47.5	Very low	145 Å²	145	120 Å²	120	76%	0.759	64%	0.639	S	S	*	*	H	α-helix	trans	-78.6	-18	173	-71.8	164.3	0	0	0	113.5	I282	I282-L286 HydrophobicContact CG2-CD1 3.79Å; I282-L286 WeakPolarHBondContact O-CB 3.42Å; I282-L286 PolarHBondContact O-N 3.36Å
287	G	41.1	Very low	45.9	Very low	63 Å²	63	123.3 Å²	123.3	65%	0.649	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	4.9	176.7	0	0	0	0	0	115.3	K283	K283-G287 WeakPolarHBondContact O-CA 3.47Å; K283-G287 PolarHBondContact O-N 2.77Å
288	A	40.7	Very low	43.8	Very low	78 Å²	78	123.2 Å²	123.2	65%	0.645	67%	0.673	S	S	*	*	S	Bend	trans	-109.9	11.4	-178	0	0	0	0	0	114.3	R284	R284-A288 WeakPolarHBondContact O-CB 3.35Å; R284-A288 PolarHBondContact O-N 2.7Å
289	S	35.4	Very low	42.1	Very low	108 Å²	108	125 Å²	125	76%	0.755	69%	0.691	S	S	*	*			trans	-104.6	35.1	176.7	-170.6	0	0	0	0	113.3
290	D	33.2	Very low	40	Very low	142 Å²	142	128.6 Å²	128.6	76%	0.759	71%	0.706	S	S	*	*	S	Bend	trans	-124.8	131	164.5	-92.6	-46.7	0	0	0	109.3
291	H	31.5	Very low	38.4	Very low	180 Å²	180	131.7 Å²	131.7	83%	0.833	72%	0.719	S	S	*	*			trans	78.3	85	-177.4	-53.2	-49.5	0	0	0	118.9
292	A	31.9	Very low	36.5	Very low	106 Å²	106	135.8 Å²	135.8	88%	0.876	74%	0.741	S	S	*	*			trans	-117.7	107.4	144.4	0	0	0	0	0	110
293	K	28.5	Very low	35	Very low	195 Å²	195	137 Å²	137	85%	0.848	75%	0.753	S	S	*	*			trans	-92.3	129.8	170	-72.7	178.1	176.3	177	0	109.5
294	I	32.9	Very low	33.7	Very low	175 Å²	175	135.5 Å²	135.5	90%	0.897	76%	0.757	S	S	*	*			trans	-132.6	154.7	160.4	-60	-175.9	0	0	0	108.6
295	Y	28	Very low	32.5	Very low	191 Å²	191	134.6 Å²	134.6	75%	0.749	76%	0.763	S	S	*	*			trans	-134.7	123.5	-144.4	177.3	-90.3	0	0	0	112
296	I	30.4	Very low	31.3	Very low	117 Å²	117	135.2 Å²	135.2	60%	0.6	77%	0.767	S	S	*	*			trans	51.4	128.4	134.5	-63.6	-175.3	0	0	0	117.5
297	P	29.4	Very low	30.5	Very low	127 Å²	127	132.6 Å²	132.6	83%	0.825	76%	0.761	S	S	*	*				-144.9	153.2	72.2	38.9	-20.2	0	0	0	120
298	S	25.5	Very low	30.1	Very low	113 Å²	113	138.2 Å²	138.2	79%	0.79	77%	0.767	S	S	*	*			trans	-79.9	149.7	168.6	-36.3	0	0	0	0	112.2
299	C	27.6	Very low	29.5	Very low	130 Å²	130	138.9 Å²	138.9	88%	0.878	77%	0.768	S	S	*	*			trans	-156.3	140.4	147.9	-148.4	0	0	0	0	111
300	E	25	Very low	29.3	Very low	167 Å²	167	142.8 Å²	142.8	78%	0.78	77%	0.766	S	S	*	*			trans	-91.1	158.6	-177.8	-56.6	159.9	137.8	0	0	111.2
301	Q	28.8	Very low	29.1	Very low	166 Å²	166	141.7 Å²	141.7	78%	0.776	76%	0.756	S	S	*	*				164.2	128.4	119.8	-87.6	166.6	23.6	0	0	115.2
302	N	26.8	Very low	29.1	Very low	136 Å²	136	140.5 Å²	140.5	73%	0.727	75%	0.751	S	S	*	*			trans	58.9	101.8	137.3	-58.6	-12.2	0	0	0	122.8
303	T	26.9	Very low	29	Very low	126 Å²	126	142.1 Å²	142.1	77%	0.773	75%	0.745	S	S	*	*				27.5	137.6	117.7	52.1	0	0	0	0	122
304	V	30	Very low	29.3	Very low	122 Å²	122	140.9 Å²	140.9	74%	0.739	75%	0.746	S	S	*	*				169.7	107.9	114.4	159.4	0	0	0	0	113.2
305	N	27.7	Very low	29.2	Very low	131 Å²	131	140 Å²	140	70%	0.701	74%	0.743	S	S	*	*			trans	62.2	117.5	133.2	-57.5	-8	0	0	0	126.5
306	T	30	Very low	29.6	Very low	121 Å²	121	136.1 Å²	136.1	74%	0.742	74%	0.741	S	S	*	*				87.2	99.8	119.6	58.2	0	0	0	0	125.5
307	S	29.7	Very low	29.7	Very low	91 Å²	91	142.4 Å²	142.4	64%	0.636	76%	0.757	S	S	*	*				94.1	131.5	103.2	83.9	0	0	0	0	125.5
308	K	31.3	Very low	29.9	Very low	180 Å²	180	141.7 Å²	141.7	78%	0.783	76%	0.755	S	S	*	*			trans	100.6	109.5	130.5	-87.7	173.7	179.1	178	0	124.5
309	S	29.6	Very low	30.5	Very low	93 Å²	93	142.1 Å²	142.1	65%	0.65	76%	0.755	S	S	*	*				77.2	147.7	126.1	72	0	0	0	0	120
310	R	29.7	Very low	30.8	Very low	189 Å²	189	142 Å²	142	71%	0.713	75%	0.746	S	S	*	*			cis	-175.9	141.3	29.1	-147	-173.9	163.7	-178.3	-17	113.3
311	E	29.9	Very low	31	Very low	120 Å²	120	141.8 Å²	141.8	56%	0.561	74%	0.743	S	S	*	*			trans	65.6	137.1	138.3	-88.7	170.6	-138.4	0	0	128.6
312	Q	32.6	Very low	31.2	Very low	154 Å²	154	139.3 Å²	139.3	72%	0.72	74%	0.738	S	S	*	*			trans	105.5	99.5	131.2	-82.9	179.8	56.3	0	0	124.5
313	N	28.3	Very low	31.3	Very low	140 Å²	140	140 Å²	140	75%	0.749	74%	0.742	S	S	*	*				67.4	123.4	112.7	-104.9	-11.8	0	0	0	124.4
314	I	34.6	Very low	31.3	Very low	169 Å²	169	137.9 Å²	137.9	87%	0.867	75%	0.745	S	S	*	*				169.7	156.5	117.8	-85.4	156.4	0	0	0	113.6
315	N	31.9	Very low	31.3	Very low	156 Å²	156	138.8 Å²	138.8	83%	0.834	76%	0.755	S	S	*	*			trans	-81.9	172	-160.2	-100.4	-27	0	0	0	119.3
316	P	36.7	Very low	31.2	Very low	111 Å²	111	140.5 Å²	140.5	72%	0.721	76%	0.759	S	S	*	*			trans	-104.4	176.7	-165.6	41.7	-38.5	0	0	0	116.7
317	R	32.5	Very low	31.2	Very low	249 Å²	249	140.5 Å²	140.5	94%	0.94	76%	0.762	S	S	*	*			trans	-153.4	168	160.2	-112.1	176.3	-170.7	-160.3	1	114
318	S	33.2	Very low	31.2	Very low	111 Å²	111	143.1 Å²	143.1	78%	0.776	77%	0.769	S	S	*	*			trans	-88	172.7	-154.8	50.8	0	0	0	0	117.3
319	P	38.7	Very low	31	Very low	123 Å²	123	143.4 Å²	143.4	80%	0.799	77%	0.773	S	S	*	*			trans	-106.1	171.7	-161.3	41.5	-35.5	0	0	0	115.4
320	D	32.2	Very low	30.9	Very low	126 Å²	126	147.7 Å²	147.7	67%	0.674	79%	0.785	S	S	*	*			trans	-163.7	141.8	145.7	-134	-3.4	0	0	0	114.4
321	K	29.6	Very low	30.8	Very low	164 Å²	164	148.1 Å²	148.1	71%	0.713	79%	0.792	S	S	*	*			trans	61.5	128.2	144.9	-80.4	171.8	-169.5	123	0	126.1
322	V	32.4	Very low	30.9	Very low	114 Å²	114	149.4 Å²	149.4	69%	0.691	80%	0.801	S	S	*	*				102.7	126.3	121.3	163.4	0	0	0	0	121.3
323	N	30	Very low	30.5	Very low	151 Å²	151	150.4 Å²	150.4	81%	0.807	81%	0.806	S	S	*	*			trans	67.3	98.4	157.6	-66.2	-6.4	0	0	0	122.2
324	G	26.9	Very low	30.6	Very low	81 Å²	81	153 Å²	153	84%	0.835	81%	0.811	S	S	*	*				69.8	125.9	98.8	0	0	0	0	0	121.1
325	C	28.8	Very low	30.4	Very low	140 Å²	140	150.6 Å²	150.6	95%	0.946	80%	0.804	S	S	*	*			trans	-154.6	152.4	143.7	-151.3	0	0	0	0	112.2
326	H	26.3	Very low	30.3	Very low	168 Å²	168	149.1 Å²	149.1	78%	0.778	80%	0.804	S	S	*	*			trans	-98	155.8	-179.5	-125.6	57.4	0	0	0	110.9
327	C	29.9	Very low	30	Very low	121 Å²	121	151.7 Å²	151.7	82%	0.818	81%	0.81	S	S	*	*			trans	154.8	147.9	153.1	-86.2	0	0	0	0	108.9
328	N	31	Very low	29.7	Very low	145 Å²	145	148.7 Å²	148.7	78%	0.775	81%	0.807	S	S	*	*			cis	-174.4	155.1	-32.2	-111.4	5.5	0	0	0	104.1
329	E	25.4	Very low	29.6	Very low	187 Å²	187	151 Å²	151	87%	0.874	81%	0.809	S	S	*	*			trans	-62.4	148.4	-172.7	-59.8	171.1	110.2	0	0	114.6
330	M	29.2	Very low	29.1	Very low	182 Å²	182	149.3 Å²	149.3	90%	0.897	80%	0.8	S	S	*	*			trans	-129.3	122.4	148.4	-94.4	-167.7	178.4	0	0	109.9
331	K	27.1	Very low	29.1	Very low	198 Å²	198	152 Å²	152	86%	0.861	81%	0.808	S	S	*	*			trans	-106.4	121.8	176.7	-157.7	178.9	-170.8	-178.7	0	107.4
332	I	32.1	Very low	29.3	Very low	147 Å²	147	147.7 Å²	147.7	75%	0.754	80%	0.803	S	S	*	*			trans	-128.5	126.3	173	-58.9	-179.3	0	0	0	107.9	F334	I332-F334 HydrophobicContact CG2-CD2 4.48Å
333	E	22.9	Very low	29.3	Very low	176 Å²	176	149.7 Å²	149.7	82%	0.822	81%	0.81	S	S	*	*			trans	-123.3	128.2	-177.3	179.2	177.4	-126.2	0	0	107.1
334	F	31.7	Very low	29.2	Very low	193 Å²	193	151.2 Å²	151.2	85%	0.846	81%	0.809	S	S	*	*			trans	-146.2	144.2	170.1	-104.6	-78	0	0	0	111.8	I332	I332-F334 HydrophobicContact CG2-CD2 4.48Å
335	T	29.7	Very low	29.4	Very low	119 Å²	119	154.5 Å²	154.5	73%	0.73	81%	0.806	S	S	*	*			trans	-86.2	157.3	-161.3	47.3	0	0	0	0	115.1
336	P	30.5	Very low	29.4	Very low	126 Å²	126	152.6 Å²	152.6	82%	0.818	79%	0.794	S	S	*	*			trans	-81.7	163.7	178.8	35.1	-36.4	0	0	0	113.6
337	L	29.6	Very low	29.6	Very low	164 Å²	164	150.3 Å²	150.3	86%	0.859	79%	0.792	S	S	*	*			trans	-126.4	125.4	176.9	-141.4	87.3	0	0	0	110.8
338	E	25.4	Very low	29.4	Very low	186 Å²	186	149.5 Å²	149.5	87%	0.869	79%	0.788	S	S	*	*			trans	-86.3	146.6	169.6	-69.5	-169.2	143.9	0	0	111.7
339	I	33	Very low	29.5	Very low	159 Å²	159	146.3 Å²	146.3	82%	0.815	78%	0.777	S	S	*	*			trans	-135.2	127	147.9	-62.7	-174.5	0	0	0	109.7
340	S	26.5	Very low	29.7	Very low	88 Å²	88	147.4 Å²	147.4	62%	0.615	77%	0.773	S	S	*	*			trans	-76.9	159.3	-178.1	58	0	0	0	0	115
341	H	33.9	Very low	29.7	Very low	184 Å²	184	144.7 Å²	144.7	85%	0.852	76%	0.762	S	S	*	*			trans	174.3	139.9	131.1	-91.8	-69.9	0	0	0	108.9
342	A	32.6	Very low	29.7	Very low	72 Å²	72	145.4 Å²	145.4	60%	0.595	76%	0.759	S	S	*	*			cis	167.4	113.9	-22.3	0	0	0	0	0	105.9
343	N	32.6	Very low	29.4	Very low	157 Å²	157	145.8 Å²	145.8	84%	0.84	76%	0.758	S	S	*	*			trans	164.3	142.1	141.5	-86.7	-35.5	0	0	0	110.6
344	K	28.8	Very low	29.7	Very low	183 Å²	183	145.3 Å²	145.3	80%	0.796	76%	0.757	S	S	*	*			cis	166.9	146.3	-20.2	176.5	171.8	-176.5	178.5	0	105.3
345	I	30.3	Very low	29.5	Very low	150 Å²	150	144 Å²	144	77%	0.769	75%	0.752	S	S	*	*			trans	112.1	83.5	172.7	-61	159.7	0	0	0	110.6
346	S	28.1	Very low	29.3	Very low	99 Å²	99	145.8 Å²	145.8	69%	0.692	75%	0.749	S	S	*	*				73.3	135.6	77	81.4	0	0	0	0	113.4
347	V	30.8	Very low	29.2	Very low	121 Å²	121	145 Å²	145	73%	0.733	74%	0.738	S	S	*	*			cis	-158.6	129.2	29.5	169.5	0	0	0	0	112.4
348	S	27.2	Very low	29.4	Very low	104 Å²	104	144.3 Å²	144.3	73%	0.727	73%	0.731	S	S	*	*			trans	46.9	157.7	141.7	104.7	0	0	0	0	123.1
349	S	31.3	Very low	29.6	Very low	78 Å²	78	141.2 Å²	141.2	55%	0.545	72%	0.72	S	S	.	*			cis	-168.5	144.8	23.9	-102.8	0	0	0	0	114.4
350	R	30.8	Very low	29.5	Very low	210 Å²	210	141.6 Å²	141.6	79%	0.792	72%	0.716	S	S	*	*			trans	71.6	116.1	135.9	-66.8	171.5	179.2	154.1	0.9	121
351	N	29	Very low	29.7	Very low	124 Å²	124	144 Å²	144	66%	0.663	72%	0.717	S	S	*	*				93.5	144.8	88.6	-74.5	14.3	0	0	0	111.9
352	W	26.5	Very low	29.5	Very low	213 Å²	213	142.9 Å²	142.9	81%	0.807	71%	0.71	S	S	*	*			cis	-144.8	150.6	5	-87.9	-43.6	0	0	0	107.5
353	E	26.3	Very low	29.4	Very low	155 Å²	155	145.9 Å²	145.9	72%	0.724	72%	0.716	S	S	*	*			cis	98.1	141.6	44.3	-147.8	171.7	-136.7	0	0	113.8
354	M	28.5	Very low	29.1	Very low	166 Å²	166	144.1 Å²	144.1	82%	0.818	71%	0.711	S	S	*	*			trans	74.8	149.7	172	-61.6	178.8	60.4	0	0	120.8
355	F	27.3	Very low	29.1	Very low	167 Å²	167	141.3 Å²	141.3	73%	0.732	71%	0.709	S	S	*	*			cis	-175.4	131.7	-42.2	-121.6	-60.1	0	0	0	109.7
356	K	26.1	Very low	29	Very low	155 Å²	155	142.3 Å²	142.3	67%	0.674	71%	0.71	S	S	*	*			trans	67.6	134.1	140.3	-96.8	172.1	156.6	-110.2	0	125.8
357	D	28.5	Very low	28.9	Very low	110 Å²	110	142.1 Å²	142.1	59%	0.588	72%	0.715	S	S	*	*				101.3	132.4	122.7	-75.6	-20.1	0	0	0	124.2
358	H	33.1	Very low	28.7	Very low	150 Å²	150	141.8 Å²	141.8	69%	0.694	71%	0.712	S	S	*	*			trans	76.8	102.8	148.4	-75.7	-57.1	0	0	0	124.7
359	D	29.9	Very low	28.8	Very low	120 Å²	120	143.7 Å²	143.7	64%	0.642	72%	0.719	S	S	*	*				62.7	129.6	106.6	-85	-39	0	0	0	124.9
360	K	30.6	Very low	28.5	Very low	168 Å²	168	148 Å²	148	73%	0.73	73%	0.731	S	S	*	*			trans	94.3	124.4	132	-76.5	173.2	-174.3	173.3	0	124.5
361	E	31.5	Very low	28.4	Very low	137 Å²	137	144.5 Å²	144.5	64%	0.64	74%	0.737	S	S	*	*			trans	78.4	112.4	134.2	-72	-171.1	109.8	0	0	123.9
362	K	29.3	Very low	28.4	Very low	162 Å²	162	143.9 Å²	143.9	70%	0.704	74%	0.738	S	S	*	*				67.4	123	124.2	-68.4	175.6	178.1	160.9	0	121.8
363	N	31.3	Very low	28.5	Very low	134 Å²	134	140.9 Å²	140.9	72%	0.717	74%	0.738	S	S	*	*				148.4	110	112.6	-88.9	-15.6	0	0	0	116.9
364	T	26.7	Very low	28.5	Very low	121 Å²	121	143.2 Å²	143.2	74%	0.742	75%	0.749	S	S	*	*				55.6	146.3	124.9	64.1	0	0	0	0	125.7
365	V	28.3	Very low	28.6	Very low	123 Å²	123	138.4 Å²	138.4	75%	0.745	74%	0.742	S	S	*	*			trans	106.6	86.9	147.4	-163.3	0	0	0	0	120.6
366	Q	27.2	Very low	28.6	Very low	171 Å²	171	136.7 Å²	136.7	80%	0.799	75%	0.745	S	S	*	*				50.7	123.6	110.8	-163.1	177.3	7	0	0	124.5	V368	Q366-V368 HydrophobicContact CG-CG2 4.31Å
367	A	27.5	Very low	28.8	Very low	95 Å²	95	137.7 Å²	137.7	79%	0.785	75%	0.75	S	S	*	*			trans	179.3	115.3	137.6	0	0	0	0	0	108.1
368	V	25.6	Very low	28.7	Very low	114 Å²	114	138.7 Å²	138.7	69%	0.691	76%	0.755	S	S	*	*				65.4	104.4	56.9	-173.3	0	0	0	0	115	Q366	Q366-V368 HydrophobicContact CG-CG2 4.31Å
369	V	29.4	Very low	28.5	Very low	144 Å²	144	140.1 Å²	140.1	87%	0.873	76%	0.762	S	S	*	*				-157.1	128.6	129.7	167	0	0	0	0	108.2
370	E	25.3	Very low	28.4	Very low	168 Å²	168	139 Å²	139	79%	0.785	77%	0.77	S	S	*	*			trans	-97.2	162.7	170.7	-64.2	167.9	121.3	0	0	111.5
371	C	28.7	Very low	28.2	Very low	137 Å²	137	136.1 Å²	136.1	93%	0.926	77%	0.771	S	S	*	*			trans	-157.7	136.8	140.3	-102.7	0	0	0	0	109.7
372	T	28.2	Very low	28	Very low	111 Å²	111	133.2 Å²	133.2	68%	0.681	77%	0.765	S	S	*	*			trans	-104.9	164	-172	50.7	0	0	0	0	112.4
373	D	30.4	Very low	27.8	Very low	151 Å²	151	128.7 Å²	128.7	81%	0.807	75%	0.748	S	S	*	*				170.6	158.9	114.9	-86	-3.2	0	0	0	113
374	E	25.2	Very low	27.6	Very low	203 Å²	203	125.7 Å²	125.7	95%	0.949	74%	0.742	S	S	*	*			trans	-98.7	167.5	-163.2	-50.5	-154.2	145	0	0	115.3
375	G	30.5	Very low	27.6	Very low	65 Å²	65	126 Å²	126	67%	0.67	74%	0.744	S	S	*	*			trans	157.5	74.7	160.3	0	0	0	0	0	119.8
376	T	26.7	Very low	27.6	Very low	132 Å²	132	126.6 Å²	126.6	81%	0.81	74%	0.743	S	S	*	*			trans	47.7	148	135.2	-18	0	0	0	0	124.1
377	F	30.7	Very low	27.7	Very low	176 Å²	176	124.3 Å²	124.3	77%	0.772	74%	0.735	S	S	*	*			trans	93.8	97.4	156.1	-92	-79.6	0	0	0	121.6
378	D	26.9	Very low	27.9	Very low	131 Å²	131	127.1 Å²	127.1	70%	0.701	73%	0.732	S	S	*	*			trans	50.8	141.4	132.6	-71.5	-18.5	0	0	0	126.2
379	Q	29.6	Very low	28	Very low	179 Å²	179	128 Å²	128	84%	0.836	73%	0.732	S	S	*	*			trans	73.1	96.3	151	-75.1	-176.7	15.9	0	0	120.6
380	A	26.3	Very low	28	Very low	97 Å²	97	127.9 Å²	127.9	80%	0.802	73%	0.727	S	S	*	*				50.9	103.9	121.1	0	0	0	0	0	119.2
381	S	27.5	Very low	28.1	Very low	108 Å²	108	126.6 Å²	126.6	76%	0.755	72%	0.724	S	S	*	*				-165.3	148.4	102.4	54	0	0	0	0	112.6
382	C	26.5	Very low	28.2	Very low	75 Å²	75	126.7 Å²	126.7	51%	0.507	72%	0.715	S	S	.	*			trans	-58.7	144.3	169.4	43.7	0	0	0	0	112.7
383	N	25.2	Very low	28.3	Very low	67 Å²	67	129.2 Å²	129.2	36%	0.358	72%	0.719	S	S	.	*				174.2	128.4	93.4	-89.6	-67.4	0	0	0	113.6	T725	N383-T725 VanDerWaalsContact CB-OG1 3.31Å; N383-T725 WeakPolarHBondContact CB-OG1 3.22Å; N383-T725 PolarHBondContact ND2-OG1 3.21Å
384	A	28.3	Very low	27.9	Very low	71 Å²	71	126.9 Å²	126.9	59%	0.587	71%	0.714	S	S	*	*			trans	61.3	152.5	133.6	0	0	0	0	0	121.4
385	T	26.7	Very low	28.1	Very low	127 Å²	127	123.3 Å²	123.3	78%	0.779	71%	0.709	S	S	*	*			trans	66.8	136.7	170.1	65	0	0	0	0	113.6
386	D	26.9	Very low	28	Very low	136 Å²	136	127 Å²	127	73%	0.727	71%	0.712	S	S	*	*			cis	-167.3	-172.1	16.9	-140.4	-26.6	0	0	0	111.1
387	I	29.9	Very low	28	Very low	123 Å²	123	128 Å²	128	63%	0.631	71%	0.712	S	S	*	*			trans	77.5	101.6	147.3	-70.7	156.7	0	0	0	118.6
388	Q	30.8	Very low	27.7	Very low	154 Å²	154	125 Å²	125	72%	0.72	71%	0.713	S	S	*	*				63.3	114	124.7	-60.5	175.8	-9.6	0	0	121.6
389	N	28.8	Very low	27.8	Very low	132 Å²	132	125.1 Å²	125.1	71%	0.706	72%	0.722	S	S	*	*				66.9	141.1	118.3	-60.9	-23.2	0	0	0	122
390	N	28.3	Very low	27.7	Very low	142 Å²	142	121.6 Å²	121.6	76%	0.759	72%	0.717	S	S	*	*			trans	86.9	140.3	141.4	-73.6	-17.4	0	0	0	119.8
391	I	29	Very low	27.7	Very low	142 Å²	142	125.7 Å²	125.7	73%	0.728	72%	0.72	S	S	*	*			trans	89.6	116.3	150	-71.6	150.8	0	0	0	117.3
392	L	30.1	Very low	27.8	Very low	138 Å²	138	130.5 Å²	130.5	72%	0.723	73%	0.727	S	S	*	*			trans	64.9	150.3	153.3	-90	39.1	0	0	0	117.8
393	E	29.7	Very low	27.9	Very low	165 Å²	165	135 Å²	135	77%	0.771	74%	0.741	S	S	*	*			cis	-160.7	145.7	-20.6	-134.9	165.8	-157.7	0	0	106.5
394	S	23.2	Very low	28.3	Very low	102 Å²	102	137.4 Å²	137.4	71%	0.713	75%	0.751	S	S	*	*			trans	-97.7	139.2	175.7	57.7	0	0	0	0	111.6
395	P	29.5	Very low	28.6	Very low	128 Å²	128	139 Å²	139	83%	0.831	75%	0.746	S	S	*	*			trans	-104.6	136.9	147.5	-7.5	27.3	0	0	0	111.4
396	I	27.2	Very low	28.9	Very low	143 Å²	143	138.9 Å²	138.9	73%	0.733	74%	0.737	S	S	*	*			trans	-95.1	177.1	170.5	-62.5	167.4	0	0	0	107.5
397	D	26.4	Very low	29	Very low	152 Å²	152	138.5 Å²	138.5	81%	0.813	73%	0.725	S	S	*	*			trans	90.2	132.7	175.6	-54.8	-31	0	0	0	114.5
398	S	25.7	Very low	29	Very low	113 Å²	113	136.6 Å²	136.6	79%	0.79	72%	0.719	S	S	*	*			cis	-167.2	136.2	-3.9	47.9	0	0	0	0	110.1
399	C	27.8	Very low	29.1	Very low	133 Å²	133	134.4 Å²	134.4	90%	0.899	71%	0.708	S	S	*	*			trans	-157.2	146.5	157.8	-156.1	0	0	0	0	112.7
400	S	27.7	Very low	29	Very low	105 Å²	105	133.6 Å²	133.6	73%	0.734	71%	0.709	S	S	*	*			trans	-84.9	149.9	-168.4	52.4	0	0	0	0	115.2
401	H	26.1	Very low	29	Very low	184 Å²	184	130.3 Å²	130.3	85%	0.852	70%	0.702	S	S	*	*			trans	-5.1	123.7	157.8	-86.6	-92.3	0	0	0	118.1
402	K	31	Very low	28.9	Very low	208 Å²	208	129.5 Å²	129.5	90%	0.904	70%	0.695	S	S	*	*			trans	-150.1	140.3	137.2	-102.4	170.2	-173.7	-176.5	0	108.6
403	Q	28.7	Very low	28.8	Very low	171 Å²	171	128.2 Å²	128.2	80%	0.799	69%	0.693	S	S	*	*			trans	-91	115.2	-164.6	-166.9	165.7	1.1	0	0	110.7
404	M	32.3	Very low	28.7	Very low	117 Å²	117	126.7 Å²	126.7	58%	0.576	69%	0.686	S	S	*	*			trans	-73.4	133.2	173	-85.8	171.6	65.3	0	0	110.4
405	H	35.5	Very low	28.9	Very low	104 Å²	104	126 Å²	126	48%	0.481	68%	0.677	S	S	.	*			trans	-96.7	137.7	168.4	-73.3	-94	0	0	0	109.1	Q750	H405-Q750 PolarHBondContact CD2-NE2 2.98Å; H405-Q750 VanDerWaalsContact CG-NE2 3.27Å
406	H	33.4	Very low	28.8	Very low	125 Å²	125	126.4 Å²	126.4	58%	0.579	68%	0.677	S	S	*	*			trans	-118.8	149.4	-179.6	80.1	69.5	0	0	0	111.6	T408 R595	H406-T408 PolarHBondContact CE1-OG1 3.03Å; H406-T408 PolarHBondContact ND1-OG1 3.2Å; H406-T408 VanDerWaalsContact ND1-OG1 3.09Å; H406-R595 PolarHBondContact ND1-NH2 2.94Å
407	W	28.6	Very low	28.8	Very low	127 Å²	127	125.3 Å²	125.3	48%	0.481	67%	0.672	S	S	.	*			trans	-97.5	125.1	162.3	-67.2	90.3	0	0	0	109.1	Q754	W407-Q754 HydrophobicContact CH2-CB 4.45Å; W407-Q754 HydrophobicContact CZ2-CB 3.53Å; W407-Q754 HydrophobicContact CZ2-CG 3.54Å
408	T	29.7	Very low	28.7	Very low	84 Å²	84	123.9 Å²	123.9	52%	0.515	67%	0.674	S	S	.	*			trans	-104.7	115.6	170.9	-79.4	0	0	0	0	107.7	H406 R595	H406-T408 PolarHBondContact CE1-OG1 3.03Å; H406-T408 PolarHBondContact ND1-OG1 3.2Å; H406-T408 VanDerWaalsContact ND1-OG1 3.09Å; T408-R595 PolarHBondContact OG1-NH1 2.91Å
409	F	32.1	Very low	29.1	Very low	107 Å²	107	122.4 Å²	122.4	47%	0.469	66%	0.664	S	S	.	*			trans	-68.9	144.1	160.3	-59.1	-80.2	0	0	0	108.7	A411 F760	F409-A411 PolarHBondContact O-N 3.24Å; F409-F760 HydrophobicContact CE1-CB 4.14Å; F409-F760 HydrophobicContact CE1-CD2 4.49Å; F409-F760 HydrophobicContact CE1-CG 4.48Å; F409-F760 HydrophobicContact CZ-CD2 4.19Å
410	P	27.7	Very low	29.2	Very low	115 Å²	115	121.3 Å²	121.3	75%	0.747	66%	0.658	S	S	*	*			trans	-65.4	92	164	28.8	-32.5	0	0	0	108.3
411	A	28.3	Very low	29.5	Very low	73 Å²	73	125.3 Å²	125.3	60%	0.603	67%	0.665	S	S	*	*			trans	-63	134.6	160.6	0	0	0	0	0	107.4	F409 V413	F409-A411 PolarHBondContact O-N 3.24Å; A411-V413 VanDerWaalsContact C-N 3.33Å; A411-V413 PolarHBondContact O-N 3.13Å
412	Q	27.2	Very low	29.7	Very low	126 Å²	126	123.6 Å²	123.6	59%	0.589	66%	0.662	S	S	*	*			trans	-59.3	103.7	161.7	-81.2	170.5	-31.2	0	0	107	H414 D786	Q412-H414 PolarHBondContact O-N 3.19Å; Q412-D786 PolarHBondContact NE2-OD1 3.21Å; Q412-D786 PolarHBondContact NE2-OD2 2.84Å
413	V	27.5	Very low	29.8	Very low	111 Å²	111	122.3 Å²	122.3	67%	0.673	66%	0.66	S	S	*	*			trans	-74.1	99.9	174.5	-170.3	0	0	0	0	106	A411 T415	A411-V413 VanDerWaalsContact C-N 3.33Å; A411-V413 PolarHBondContact O-N 3.13Å; V413-T415 HydrophobicContact CG1-CG2 4.07Å; V413-T415 WeakPolarHBondContact CG1-OG1 3.37Å; V413-T415 PolarHBondContact O-N 3.5Å
414	H	26.8	Very low	29.8	Very low	133 Å²	133	119.4 Å²	119.4	62%	0.616	65%	0.653	S	S	*	*			trans	-68.9	75.4	157.2	-90.3	-93.5	0	0	0	107.9	Q412 V416 Q790	Q412-H414 PolarHBondContact O-N 3.19Å; H414-V416 PolarHBondContact O-N 3.44Å; H414-V416 VanDerWaalsContact O-N 3.14Å; H414-Q790 PolarHBondContact CE1-NE2 2.98Å; H414-Q790 PolarHBondContact NE2-NE2 2.74Å
415	T	27.7	Very low	29.6	Very low	87 Å²	87	117.8 Å²	117.8	53%	0.534	65%	0.654	S	S	.	*			trans	-74.4	99.5	166.2	-2.7	0	0	0	0	107.2	V413 D417	V413-T415 HydrophobicContact CG1-CG2 4.07Å; V413-T415 WeakPolarHBondContact CG1-OG1 3.37Å; V413-T415 PolarHBondContact O-N 3.5Å; T415-D417 WeakPolarHBondContact CG2-OD1 3.39Å; T415-D417 PolarHBondContact O-N 2.88Å
416	V	27.8	Very low	29.4	Very low	137 Å²	137	121 Å²	121	83%	0.83	67%	0.669	S	S	*	*			trans	-67.9	84.9	150.7	-95.1	0	0	0	0	107.1	H414 S418	H414-V416 PolarHBondContact O-N 3.44Å; H414-V416 VanDerWaalsContact O-N 3.14Å; V416-S418 PolarHBondContact O-N 3.38Å
417	D	26	Very low	29.2	Very low	119 Å²	119	125.7 Å²	125.7	64%	0.636	68%	0.681	S	S	*	*			trans	-71.1	80	169.9	-77.4	-35.6	0	0	0	109.4	T415 S419	T415-D417 WeakPolarHBondContact CG2-OD1 3.39Å; T415-D417 PolarHBondContact O-N 2.88Å; D417-S419 PolarHBondContact O-N 3.43Å
418	S	26	Very low	29.3	Very low	122 Å²	122	124.2 Å²	124.2	85%	0.853	69%	0.69	S	S	*	*			trans	-80.2	72.5	148.9	-67.5	0	0	0	0	108.3	V416	V416-S418 PolarHBondContact O-N 3.38Å
419	S	32.4	Very low	29.1	Very low	83 Å²	83	127.4 Å²	127.4	58%	0.58	70%	0.704	S	S	*	*			trans	-110.9	103.9	172.8	43.9	0	0	0	0	110.1	D417	D417-S419 PolarHBondContact O-N 3.43Å
420	S	30.9	Very low	29.1	Very low	110 Å²	110	130.5 Å²	130.5	77%	0.769	72%	0.724	S	S	*	*			trans	-69.8	129.2	158.6	51.2	0	0	0	0	109.3
421	E	33.6	Very low	29.1	Very low	188 Å²	188	129.1 Å²	129.1	88%	0.879	72%	0.717	S	S	*	*			trans	-110.6	118.6	160.9	-66.8	-164.1	142.9	0	0	109.3
422	D	31	Very low	29.2	Very low	148 Å²	148	134.4 Å²	134.4	79%	0.791	73%	0.726	S	S	*	*			trans	-71.6	125.3	170.9	-77.9	-63.1	0	0	0	109.9
423	E	32	Very low	29.5	Very low	182 Å²	182	133.4 Å²	133.4	85%	0.85	73%	0.733	S	S	*	*			trans	-114.1	100.6	153.7	-99.4	-71.1	124.7	0	0	108.4
424	T	28.3	Very low	29.7	Very low	109 Å²	109	134.6 Å²	134.6	67%	0.669	74%	0.74	S	S	*	*			trans	-56.6	139.9	168.6	55.3	0	0	0	0	109.5
425	S	28.6	Very low	30.2	Very low	84 Å²	84	133 Å²	133	59%	0.587	74%	0.742	S	S	*	*				173	156.8	83.2	50	0	0	0	0	112.5
426	H	31.9	Very low	30.3	Very low	172 Å²	172	135.8 Å²	135.8	80%	0.796	75%	0.754	S	S	*	*			trans	69.4	138.4	160.6	-52	-40.8	0	0	0	118.5
427	R	28.7	Very low	30.4	Very low	223 Å²	223	138.8 Å²	138.8	84%	0.842	76%	0.755	S	S	*	*			cis	-168.3	151.9	-19.8	-159.8	176.7	-172.4	-165.8	2.9	108.4
428	S	31.4	Very low	30.9	Very low	95 Å²	95	138.4 Å²	138.4	66%	0.664	76%	0.762	S	S	*	*			trans	58.2	111	164.6	43.8	0	0	0	0	117.5
429	N	26	Very low	31	Very low	151 Å²	151	140.8 Å²	140.8	81%	0.807	76%	0.76	S	S	*	*				51.9	113.5	76.2	-64.7	-26.3	0	0	0	114.2
430	I	31.1	Very low	31	Very low	172 Å²	172	142.4 Å²	142.4	88%	0.882	76%	0.761	S	S	*	*				-171.5	135.8	107	-92.4	153.8	0	0	0	110.9
431	S	28	Very low	30.9	Very low	86 Å²	86	146.3 Å²	146.3	60%	0.601	76%	0.764	S	S	*	*			trans	-90.6	151.6	179.2	58	0	0	0	0	113.7
432	K	30.9	Very low	30.9	Very low	185 Å²	185	141.8 Å²	141.8	80%	0.804	75%	0.753	S	S	*	*				142.5	145.3	128.4	-79.1	161	-175.5	179.1	0	116.4
433	S	32	Very low	31	Very low	105 Å²	105	145.7 Å²	145.7	73%	0.734	76%	0.756	S	S	*	*			trans	59	119.6	148.5	54.2	0	0	0	0	120.3
434	V	33.4	Very low	30.9	Very low	135 Å²	135	143.6 Å²	143.6	82%	0.818	75%	0.751	S	S	*	*				62.2	137.4	57	-177.9	0	0	0	0	112.1
435	P	36.5	Very low	31.1	Very low	99 Å²	99	145.2 Å²	145.2	64%	0.643	76%	0.756	S	S	*	*			cis	-137.9	-169.1	-0.3	33.9	-10.8	0	0	0	117.4
436	N	30.1	Very low	31.3	Very low	147 Å²	147	146.2 Å²	146.2	79%	0.786	76%	0.763	S	S	*	*			trans	103.5	103.8	136.8	-80.5	-12.7	0	0	0	124.3
437	K	30.6	Very low	31.5	Very low	199 Å²	199	144 Å²	144	87%	0.865	76%	0.757	S	S	*	*			trans	11.9	129.9	130.8	-81.6	-178.6	169.7	-178.8	0	121.9
438	S	35.1	Very low	31.6	Very low	111 Å²	111	144.2 Å²	144.2	78%	0.776	76%	0.758	S	S	*	*				-175.9	121.8	113.1	54.6	0	0	0	0	110
439	E	29.1	Very low	31.6	Very low	173 Å²	173	143 Å²	143	81%	0.808	76%	0.76	S	S	*	*				64.3	118.4	84.4	-132.5	-172.3	-119.9	0	0	112.5
440	I	31.3	Very low	32.1	Very low	117 Å²	117	144 Å²	144	60%	0.6	76%	0.76	S	S	*	*				172.8	135.8	85.5	-93.7	172.5	0	0	0	112.1
441	K	30	Very low	32.1	Very low	191 Å²	191	142 Å²	142	83%	0.83	75%	0.751	S	S	*	*			trans	53.2	156.2	145.2	-68	174.2	-163.5	164.3	0	121.4
442	S	32.7	Very low	32.3	Very low	93 Å²	93	143.1 Å²	143.1	65%	0.65	76%	0.755	S	S	*	*			cis	-173.3	169.1	-1.6	43.3	0	0	0	0	113.5
443	R	34.1	Very low	32.2	Very low	230 Å²	230	143.4 Å²	143.4	87%	0.868	76%	0.756	S	S	*	*			trans	102.8	144.6	152.5	-65.1	176.4	172.3	172	-3.4	115.8
444	N	29.1	Very low	31.9	Very low	139 Å²	139	143.4 Å²	143.4	74%	0.743	76%	0.755	S	S	*	*			cis	168.9	161.2	-27.1	-109.5	24.4	0	0	0	106.7
445	N	33.4	Very low	31.8	Very low	142 Å²	142	142.9 Å²	142.9	76%	0.759	76%	0.757	S	S	*	*			trans	83.9	114.6	172.5	-50.6	-11.8	0	0	0	114.6
446	S	32.5	Very low	31.3	Very low	106 Å²	106	143.6 Å²	143.6	74%	0.741	76%	0.764	S	S	*	*				66.7	134.6	63.4	77.1	0	0	0	0	113.1
447	D	34.9	Very low	31.6	Very low	124 Å²	124	141.8 Å²	141.8	66%	0.663	76%	0.761	S	S	*	*			cis	-165.3	160.4	34.1	-156.9	8.9	0	0	0	114
448	R	31	Very low	31.4	Very low	229 Å²	229	140.5 Å²	140.5	86%	0.864	76%	0.762	S	S	*	*			trans	39.2	142.7	153.9	-77.7	160.2	-169.9	-159.6	-4.5	126
449	G	31.8	Very low	31	Very low	70 Å²	70	140.1 Å²	140.1	72%	0.722	76%	0.76	S	S	*	*			trans	144.8	70.1	144.5	0	0	0	0	0	117.4
450	Q	37.5	Very low	31	Very low	171 Å²	171	137 Å²	137	80%	0.799	76%	0.757	S	S	*	*				73.7	122.9	103.5	-76.8	-165.3	15.3	0	0	119.9
451	N	30.2	Very low	30.6	Very low	129 Å²	129	137 Å²	137	69%	0.69	76%	0.762	S	S	*	*			trans	68.8	143.5	140.9	-62.3	-19.8	0	0	0	119.6
452	T	32.7	Very low	30.7	Very low	111 Å²	111	138 Å²	138	68%	0.681	77%	0.767	S	S	*	*			cis	-164.7	151.5	1.6	11.8	0	0	0	0	111.5
453	K	28.9	Very low	30.3	Very low	190 Å²	190	140.9 Å²	140.9	83%	0.826	77%	0.771	S	S	*	*			trans	26.4	152.3	136.8	-61.2	-177.4	178.3	-179.3	0	121.4
454	C	24.9	Very low	30.1	Very low	106 Å²	106	136.7 Å²	136.7	72%	0.716	77%	0.765	S	S	*	*			cis	-177.9	170.5	-12	-99.6	0	0	0	0	109.2
455	S	31.1	Very low	30	Very low	123 Å²	123	134 Å²	134	86%	0.86	76%	0.757	S	S	*	*			trans	76.5	153.9	149.2	32.5	0	0	0	0	121.4
456	S	26.7	Very low	29.8	Very low	115 Å²	115	135.9 Å²	135.9	80%	0.804	76%	0.759	S	S	*	*			trans	-115.4	-152.5	-162.2	50.2	0	0	0	0	112.6
457	P	36	Very low	29.6	Very low	109 Å²	109	138.6 Å²	138.6	71%	0.708	76%	0.76	S	S	*	*				-106.5	175.2	-112.9	39.8	-24.8	0	0	0	114.7
458	L	27	Very low	29.1	Very low	171 Å²	171	141.7 Å²	141.7	90%	0.895	77%	0.767	S	S	*	*			trans	176.6	170.5	138.8	-97.8	163.1	0	0	0	113.5
459	S	25.3	Very low	28.9	Very low	103 Å²	103	135.5 Å²	135.5	72%	0.72	76%	0.759	S	S	*	*			trans	-82.7	155.6	-170.7	55.5	0	0	0	0	116.9
460	S	29.3	Very low	28.6	Very low	109 Å²	109	139.6 Å²	139.6	76%	0.762	76%	0.759	S	S	*	*			trans	-169.6	123	130.3	58.8	0	0	0	0	115.2
461	T	24.2	Very low	28	Very low	115 Å²	115	140 Å²	140	71%	0.706	76%	0.759	S	S	*	*			trans	6.1	140	141.5	-34.9	0	0	0	0	121	E463	T461-E463 HydrophobicContact CG2-CG 4.23Å
462	F	31.6	Very low	27.8	Very low	214 Å²	214	142.9 Å²	142.9	94%	0.939	77%	0.765	S	S	*	*			trans	-139	126.9	139.7	-109.1	-83	0	0	0	111.4
463	E	24.5	Very low	27.5	Very low	153 Å²	153	141.7 Å²	141.7	72%	0.715	77%	0.766	S	S	*	*			trans	-92	160.5	174.3	-63.5	-179.2	117.1	0	0	112.2	T461	T461-E463 HydrophobicContact CG2-CG 4.23Å
464	N	29.4	Very low	27.2	Very low	141 Å²	141	137.3 Å²	137.3	75%	0.754	76%	0.76	S	S	*	*			trans	142.5	152.2	134.8	-83.2	-66.8	0	0	0	112.2
465	S	27.4	Very low	27.3	Very low	82 Å²	82	139 Å²	139	57%	0.573	76%	0.761	S	S	*	*			cis	176.8	151.8	-25.7	-104.2	0	0	0	0	107.8
466	K	28.9	Very low	27	Very low	182 Å²	182	140.1 Å²	140.1	79%	0.791	76%	0.757	S	S	*	*			trans	68.3	154.9	165.1	-64.6	162.1	-175.6	171.5	0	115.9
467	Q	29.4	Very low	26.9	Very low	163 Å²	163	139 Å²	139	76%	0.762	75%	0.748	S	S	*	*			cis	-150.6	135.8	-3.6	-109.3	147.2	-44.9	0	0	105.4
468	K	24.2	Very low	26.4	Very low	190 Å²	190	138.7 Å²	138.7	83%	0.826	75%	0.749	S	S	*	*				71.4	101.5	60.7	-168.7	-172.5	-175.5	-179.2	0	115.6
469	S	26.1	Very low	26.6	Very low	98 Å²	98	139.1 Å²	139.1	69%	0.685	75%	0.746	S	S	*	*			trans	158.7	125.5	136.5	59.4	0	0	0	0	111.3
470	Q	25.9	Very low	26.8	Very low	156 Å²	156	140.4 Å²	140.4	73%	0.729	75%	0.752	S	S	*	*				55.4	136.8	97.9	-52.6	174	-23.4	0	0	114
471	F	25.4	Very low	26.7	Very low	180 Å²	180	138.2 Å²	138.2	79%	0.789	75%	0.746	S	S	*	*			cis	-144.2	154.5	23.9	-81.5	-103	0	0	0	108.2
472	K	24.2	Very low	26.7	Very low	189 Å²	189	139.1 Å²	139.1	82%	0.822	75%	0.752	S	S	*	*				62.9	81	50.4	-158.8	178.9	-175.7	178.2	0	116.9
473	A	26.5	Very low	26.5	Very low	86 Å²	86	134.6 Å²	134.6	71%	0.711	74%	0.742	S	S	*	*			trans	-171.8	125	143.8	0	0	0	0	0	105.9
474	S	24.2	Very low	26.6	Very low	99 Å²	99	132.4 Å²	132.4	69%	0.692	74%	0.739	S	S	*	*			cis	65.4	145.5	42.5	-49.4	0	0	0	0	113.5
475	I	25.7	Very low	26.4	Very low	142 Å²	142	131.9 Å²	131.9	73%	0.728	74%	0.736	S	S	*	*			trans	93.4	111.3	162.2	-56	168.7	0	0	0	115.9
476	N	24.4	Very low	26.3	Very low	146 Å²	146	136.1 Å²	136.1	78%	0.781	74%	0.744	S	S	*	*			trans	75.4	148.1	147.1	-66.5	2.2	0	0	0	120.3
477	S	26.1	Very low	26.3	Very low	90 Å²	90	133.8 Å²	133.8	63%	0.629	74%	0.74	S	S	*	*			cis	-170	151.4	-11.5	46	0	0	0	0	112.4
478	S	25.4	Very low	26.1	Very low	103 Å²	103	131.9 Å²	131.9	72%	0.72	74%	0.735	S	S	*	*			trans	51.4	122.7	140.1	66.6	0	0	0	0	121.7
479	H	30.5	Very low	26.2	Very low	181 Å²	181	126.1 Å²	126.1	84%	0.838	72%	0.719	S	S	*	*				-14.3	151.5	127.5	-64	-51.7	0	0	0	116.1
480	P	30.2	Very low	26.3	Very low	130 Å²	130	130.3 Å²	130.3	84%	0.844	72%	0.724	S	S	*	*			cis	-136.2	-175.8	41.5	34.5	-12.7	0	0	0	112.8
481	G	25.9	Very low	26.4	Very low	62 Å²	62	127.8 Å²	127.8	64%	0.639	72%	0.724	S	S	*	*			cis	153.9	158.8	2.2	0	0	0	0	0	110.1
482	T	24.8	Very low	26.5	Very low	134 Å²	134	123.5 Å²	123.5	82%	0.822	72%	0.722	S	S	*	*			trans	74.2	162.8	142.1	-46.5	0	0	0	0	118.9
483	V	28.1	Very low	26.7	Very low	119 Å²	119	120.2 Å²	120.2	72%	0.721	72%	0.718	S	S	*	*			trans	82.5	82.8	-179.3	-166.8	0	0	0	0	113
484	T	25.3	Very low	26.7	Very low	107 Å²	107	126.1 Å²	126.1	66%	0.656	72%	0.722	S	S	*	*				49.2	100.3	67.2	80.1	0	0	0	0	115
485	N	25.1	Very low	26.9	Very low	130 Å²	130	127.7 Å²	127.7	70%	0.695	72%	0.721	S	S	*	*				168.5	124.8	129.1	-87.8	-43.7	0	0	0	108.3
486	K	26.9	Very low	26.9	Very low	171 Å²	171	126.8 Å²	126.8	74%	0.743	72%	0.718	S	S	*	*				78.9	152.8	62.6	-167.5	-177.1	-169	175.9	0	110.9
487	L	28.1	Very low	27.1	Very low	134 Å²	134	124.7 Å²	124.7	70%	0.702	71%	0.71	S	S	*	*			trans	82.4	141.5	176.5	-45.3	166.4	0	0	0	113.7
488	N	24.8	Very low	27.2	Very low	122 Å²	122	126.9 Å²	126.9	65%	0.652	72%	0.715	S	S	*	*			cis	-166.9	131.4	-19.4	-114.6	-2.4	0	0	0	106.8
489	S	27	Very low	27.3	Very low	70 Å²	70	125.5 Å²	125.5	49%	0.49	71%	0.705	S	S	.	*				73.1	137.8	84.1	93.1	0	0	0	0	116
490	K	28.1	Very low	27.1	Very low	185 Å²	185	123.8 Å²	123.8	80%	0.804	70%	0.702	S	S	*	*			trans	79.2	147.9	162.9	-50.1	156.3	-172.6	179.1	0	114
491	S	27.4	Very low	26.9	Very low	104 Å²	104	125.5 Å²	125.5	73%	0.727	70%	0.699	S	S	*	*			cis	-140.6	134.1	16.1	-45.1	0	0	0	0	109.5
492	A	27.5	Very low	26.8	Very low	89 Å²	89	127.1 Å²	127.1	74%	0.736	70%	0.696	S	S	*	*				51.7	128.6	96.4	0	0	0	0	0	113.6
493	T	28.1	Very low	26.8	Very low	121 Å²	121	130.3 Å²	130.3	74%	0.742	69%	0.694	S	S	*	*				168.2	137.8	87.6	-68.1	0	0	0	0	105.4
494	R	27.1	Very low	26.7	Very low	209 Å²	209	133.2 Å²	133.2	79%	0.789	70%	0.698	S	S	*	*			cis	-173.4	174.8	-5.7	-117.7	-174.9	-168.8	-173.1	0.8	107.4
495	I	28.4	Very low	26.9	Very low	133 Å²	133	133.2 Å²	133.2	68%	0.682	70%	0.702	S	S	*	*			trans	72.7	129.7	146.5	-76.6	158.3	0	0	0	116.2
496	N	26.3	Very low	27.3	Very low	123 Å²	123	132 Å²	132	66%	0.658	70%	0.701	S	S	*	*			cis	-175.8	155.2	-21.3	-126.8	19.2	0	0	0	107.6
497	T	28.3	Very low	27.2	Very low	101 Å²	101	130.4 Å²	130.4	62%	0.62	70%	0.699	S	S	*	*			trans	51.8	139.8	140	64.4	0	0	0	0	119.6
498	N	28.2	Very low	27	Very low	136 Å²	136	130.1 Å²	130.1	73%	0.727	70%	0.698	S	S	*	*			cis	-167.2	127.8	7	-114	8	0	0	0	105.6
499	S	26.6	Very low	27	Very low	74 Å²	74	132.9 Å²	132.9	52%	0.517	70%	0.699	S	S	.	*				78	125.3	90.2	81.4	0	0	0	0	113
500	D	26.8	Very low	27	Very low	146 Å²	146	137.9 Å²	137.9	78%	0.781	71%	0.714	S	S	*	*			trans	68.6	141.3	137.4	-53	-7.9	0	0	0	117.9
501	E	25.6	Very low	27	Very low	166 Å²	166	132.9 Å²	132.9	78%	0.776	70%	0.703	S	S	*	*			cis	-168	173.3	-16.4	-131	-156.8	151.2	0	0	107.2
502	V	25.5	Very low	27.1	Very low	95 Å²	95	134.4 Å²	134.4	58%	0.576	70%	0.703	S	S	*	*			trans	62.4	108.9	139.9	165.3	0	0	0	0	119.8
503	Y	24.4	Very low	27.2	Very low	201 Å²	201	134 Å²	134	79%	0.788	69%	0.693	S	S	*	*			trans	86.1	139.6	137.9	-85.5	-127.1	0	0	0	122.1
504	K	25.1	Very low	27.2	Very low	181 Å²	181	138.4 Å²	138.4	79%	0.787	70%	0.696	S	S	*	*			trans	65.5	112.1	151.2	-81.4	178.1	175	177.6	0	117.8
505	S	30.5	Very low	27.5	Very low	106 Å²	106	135.8 Å²	135.8	74%	0.741	70%	0.698	S	S	*	*			trans	-35.7	150.3	137.3	49.8	0	0	0	0	112.3
506	P	32.7	Very low	27.8	Very low	104 Å²	104	133 Å²	133	68%	0.675	70%	0.702	S	S	*	*			cis	-152.8	-170.4	39.6	37.9	-13.7	0	0	0	116.7
507	I	24.4	Very low	28.3	Very low	138 Å²	138	133.3 Å²	133.3	71%	0.708	70%	0.703	S	S	*	*			trans	71.7	114.4	135	-84.2	163.5	0	0	0	119.7
508	L	24.8	Very low	29	Very low	129 Å²	129	136.9 Å²	136.9	68%	0.675	71%	0.711	S	S	*	*			trans	83.9	131.3	131.6	-106.8	65.8	0	0	0	123
509	R	24.6	Very low	29.5	Very low	179 Å²	179	137.6 Å²	137.6	68%	0.675	71%	0.714	S	S	*	*			trans	94.7	115.8	137.5	-59.5	-84.7	173.1	179.8	1.2	118.9
510	H	27.6	Very low	30.2	Very low	176 Å²	176	138.1 Å²	138.1	82%	0.815	72%	0.718	S	S	*	*				65.4	139.8	127.1	-64	-32.5	0	0	0	118.5
511	S	28.3	Very low	31.4	Very low	80 Å²	80	138.3 Å²	138.3	56%	0.559	72%	0.719	S	S	*	*			cis	-161.6	174.5	1.2	48	0	0	0	0	110.9
512	D	29.4	Very low	32.9	Very low	136 Å²	136	136.5 Å²	136.5	73%	0.727	71%	0.711	S	S	*	*			trans	71.4	133.2	156.9	-55.3	-52.5	0	0	0	117.5
513	C	28.4	Very low	34	Very low	79 Å²	79	137.5 Å²	137.5	53%	0.534	71%	0.713	S	S	.	*			cis	-165.2	142.2	-1.2	-122.1	0	0	0	0	110
514	R	29.4	Very low	35.4	Very low	215 Å²	215	132.6 Å²	132.6	81%	0.811	70%	0.704	S	S	*	*			trans	67.1	137	142.5	-64.6	177.6	-155.1	-146.8	1	118.5
515	D	33.1	Very low	36.9	Very low	154 Å²	154	126.9 Å²	126.9	82%	0.824	69%	0.691	S	S	*	*			cis	-151.7	160.6	1.3	-75.7	-45.9	0	0	0	108.4
516	G	35	Very low	37.9	Very low	74 Å²	74	127.1 Å²	127.1	76%	0.763	68%	0.68	S	S	*	*			trans	123.4	63.5	157.5	0	0	0	0	0	118.6
517	D	35.6	Very low	38.6	Very low	129 Å²	129	129.5 Å²	129.5	69%	0.69	69%	0.686	S	S	*	*			trans	-40.8	168.5	177.1	-53.4	-39.9	0	0	0	121.7
518	F	42.1	Very low	39.6	Very low	176 Å²	176	130 Å²	130	77%	0.772	69%	0.69	S	S	*	*			trans	88	104.8	159.5	-47.6	-60.7	0	0	0	117.2
519	D	39	Very low	40.5	Very low	151 Å²	151	130.4 Å²	130.4	81%	0.807	69%	0.692	S	S	*	*			cis	63.2	137	49.5	-59.6	-40.9	0	0	0	114
520	S	42.3	Very low	41.1	Very low	85 Å²	85	129.4 Å²	129.4	59%	0.594	69%	0.693	S	S	*	*			cis	-164.5	157.1	-16.8	57.2	0	0	0	0	108.9	E522	S520-E522 PolarHBondContact O-N 2.9Å
521	D	51.3	Low	41.5	Very low	151 Å²	151	129.6 Å²	129.6	81%	0.807	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	18.8	-170.4	-65.3	-53.1	0	0	0	116.6
522	E	56.9	Low	41.6	Very low	127 Å²	127	136.9 Å²	136.9	59%	0.593	71%	0.711	S	S	*	*	H	α-helix	trans	-82.6	-22	-171	-159.5	67.7	-149.8	0	0	113.7	S520 Q526	S520-E522 PolarHBondContact O-N 2.9Å; E522-Q526 WeakPolarHBondContact O-CG 3.44Å; E522-Q526 PolarHBondContact O-NE2 3.07Å
523	D	49.6	Very low	41.7	Very low	117 Å²	117	137.4 Å²	137.4	63%	0.626	71%	0.709	S	S	*	*	H	α-helix	trans	-81.4	-29.2	-177.7	-75.4	-23.5	0	0	0	113.1	A525 Q526 L527	D523-A525 VanDerWaalsContact C-N 3.31Å; D523-A525 PolarHBondContact O-N 3.27Å; D523-Q526 PolarHBondContact O-N 2.98Å; D523-L527 PolarHBondContact O-N 3.36Å
524	T	54	Low	41.8	Very low	97 Å²	97	137.5 Å²	137.5	60%	0.595	72%	0.716	S	S	*	*	H	α-helix	trans	-67.5	-33.1	177.2	-49	0	0	0	0	111.7
525	A	55.1	Low	42	Very low	62 Å²	62	133.9 Å²	133.9	51%	0.512	71%	0.713	S	S	.	*	H	α-helix	trans	-73.5	-29	175.8	0	0	0	0	0	112.7	D523	D523-A525 VanDerWaalsContact C-N 3.31Å; D523-A525 PolarHBondContact O-N 3.27Å
526	Q	52.5	Low	42	Very low	110 Å²	110	136.3 Å²	136.3	51%	0.514	72%	0.716	S	S	.	*	H	α-helix	trans	-82.3	-20.1	-177.8	-70.9	-178.9	69.9	0	0	113.9	E522 D523 L528	E522-Q526 WeakPolarHBondContact O-CG 3.44Å; E522-Q526 PolarHBondContact O-NE2 3.07Å; D523-Q526 PolarHBondContact O-N 2.98Å; Q526-L528 VanDerWaalsContact C-N 3.34Å
527	L	48.4	Very low	42.1	Very low	155 Å²	155	141.6 Å²	141.6	81%	0.812	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	-14.1	174.6	-77.9	169	0	0	0	114.3	D523	D523-L527 PolarHBondContact O-N 3.36Å
528	L	45.1	Very low	42.1	Very low	149 Å²	149	141.2 Å²	141.2	78%	0.78	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	-6.9	-176	-73.3	168.1	0	0	0	114.8	Q526	Q526-L528 VanDerWaalsContact C-N 3.34Å
529	D	43.5	Very low	41.8	Very low	136 Å²	136	141.9 Å²	141.9	73%	0.727	72%	0.721	S	S	*	*	S	Bend	trans	-133.1	11.5	-162.7	-147.5	24	0	0	0	116.7
530	K	36.6	Very low	42.1	Very low	158 Å²	158	138.5 Å²	138.5	69%	0.687	70%	0.702	S	S	*	*			trans	-149.5	100.3	173.6	-64.4	-171.9	-172.2	73.9	0	114.7
531	Q	35.9	Very low	42.3	Very low	181 Å²	181	137.7 Å²	137.7	85%	0.846	70%	0.695	S	S	*	*				168.7	75.8	122	-171.2	158.2	-7.4	0	0	112.7
532	Y	30.8	Very low	42	Very low	232 Å²	232	137.5 Å²	137.5	91%	0.91	69%	0.689	S	S	*	*			trans	-84	123.4	155.1	-118.9	-89.9	0	0	0	108.6
533	Q	30.4	Very low	41.3	Very low	148 Å²	148	136.4 Å²	136.4	69%	0.692	69%	0.687	S	S	*	*			trans	149.7	133.8	160.9	-90.6	169.8	0.4	0	0	108.2
534	A	32.2	Very low	40.9	Very low	81 Å²	81	137.9 Å²	137.9	67%	0.669	69%	0.688	S	S	*	*			cis	-177.9	160.3	-15.2	0	0	0	0	0	105.6
535	D	32.4	Very low	40.5	Very low	139 Å²	139	138.4 Å²	138.4	74%	0.743	69%	0.687	S	S	*	*			trans	63.8	80.7	155.2	-55.6	-23.6	0	0	0	121.2
536	K	34.5	Very low	40	Very low	205 Å²	205	141.9 Å²	141.9	89%	0.891	69%	0.69	S	S	*	*				-141.9	99	115	-113.6	178.7	-176.5	177.9	0	110	V538	K536-V538 PolarHBondContact O-N 3Å; K536-V538 VanDerWaalsContact O-N 3.12Å
537	Q	35.7	Very low	39.4	Very low	185 Å²	185	139.7 Å²	139.7	86%	0.864	69%	0.687	S	S	*	*			trans	-68.5	108.2	173.7	-72.7	-175	0.8	0	0	109.9	Y539	Q537-Y539 PolarHBondContact O-N 2.95Å
538	V	37	Very low	39.2	Very low	120 Å²	120	136 Å²	136	73%	0.727	67%	0.674	S	S	*	*			trans	-77.7	109.3	162.3	-175.3	0	0	0	0	106.8	K536 I540	K536-V538 PolarHBondContact O-N 3Å; K536-V538 VanDerWaalsContact O-N 3.12Å; V538-I540 HydrophobicContact CG1-CD1 4.22Å; V538-I540 HydrophobicContact CG1-CG1 3.91Å; V538-I540 PolarHBondContact O-N 3.22Å; V538-I540 VanDerWaalsContact O-N 3.15Å
539	Y	35	Very low	39.1	Very low	191 Å²	191	133.4 Å²	133.4	75%	0.749	66%	0.66	S	S	*	*			trans	-74.7	101.6	178.4	178.3	-105.5	0	0	0	109.7	Q537 P541	Q537-Y539 PolarHBondContact O-N 2.95Å; Y539-P541 HydrophobicContact CD1-CG 4.15Å; Y539-P541 HydrophobicContact CE1-CG 3.63Å
540	I	45.1	Very low	39.2	Very low	80 Å²	80	132.7 Å²	132.7	41%	0.41	65%	0.652	S	S	.	*			trans	-112.4	103.1	172.2	-54.1	178.8	0	0	0	107.1	V538 E542 L543	V538-I540 HydrophobicContact CG1-CD1 4.22Å; V538-I540 HydrophobicContact CG1-CG1 3.91Å; V538-I540 PolarHBondContact O-N 3.22Å; V538-I540 VanDerWaalsContact O-N 3.15Å; I540-E542 HydrophobicContact CG2-CB 4.28Å; I540-E542 PolarHBondContact O-N 3.32Å; I540-L543 HydrophobicContact CB-CD1 4.18Å; I540-L543 HydrophobicContact CD1-CD1 4.07Å; I540-L543 HydrophobicContact CG2-CD1 4.07Å; I540-L543 HydrophobicContact CG2-CG 4.1Å
541	P	47	Very low	39.4	Very low	68 Å²	68	127.8 Å²	127.8	44%	0.442	64%	0.641	S	S	.	*	T	Hydrogen-bonded Turn	trans	-55.5	-38.3	-179	-26.6	34.4	0	0	0	113.4	Y539 L543 K544	Y539-P541 HydrophobicContact CD1-CG 4.15Å; Y539-P541 HydrophobicContact CE1-CG 3.63Å; P541-L543 VanDerWaalsContact C-N 3.26Å; P541-L543 PolarHBondContact O-N 3.46Å; P541-K544 PolarHBondContact O-N 2.74Å
542	E	43.6	Very low	39.8	Very low	147 Å²	147	122.1 Å²	122.1	69%	0.687	62%	0.616	S	S	*	*	H	α-helix	trans	-69	-14	-168.4	-62.2	158.9	-171.3	0	0	114.7	I540	I540-E542 HydrophobicContact CG2-CB 4.28Å; I540-E542 PolarHBondContact O-N 3.32Å
543	L	43.8	Very low	40.6	Very low	103 Å²	103	119.9 Å²	119.9	54%	0.539	61%	0.606	S	S	.	*	H	α-helix	trans	-93.6	-14.8	-179.5	-71.4	171.9	0	0	0	113.9	I540 P541 S547	I540-L543 HydrophobicContact CB-CD1 4.18Å; I540-L543 HydrophobicContact CD1-CD1 4.07Å; I540-L543 HydrophobicContact CG2-CD1 4.07Å; I540-L543 HydrophobicContact CG2-CG 4.1Å; P541-L543 VanDerWaalsContact C-N 3.26Å; P541-L543 PolarHBondContact O-N 3.46Å; L543-S547 PolarHBondContact O-OG 2.94Å
544	K	40.5	Very low	41.4	Very low	149 Å²	149	120.2 Å²	120.2	65%	0.648	61%	0.608	S	S	*	*	H	α-helix	trans	-71.5	-39.8	171.5	-84.9	-172.2	172.6	-176.7	0	111.5	P541 K546 S547 C548	P541-K544 PolarHBondContact O-N 2.74Å; K544-K546 PolarHBondContact O-N 3.03Å; K544-S547 PolarHBondContact O-N 2.81Å; K544-S547 PolarHBondContact O-OG 3.36Å; K544-C548 VanDerWaalsContact O-CB 3.3Å; K544-C548 WeakPolarHBondContact O-CB 3.35Å; K544-C548 PolarHBondContact O-N 3.22Å; K544-C548 PolarHBondContact O-SG 3.24Å
545	D	46.2	Very low	42.2	Very low	107 Å²	107	124.7 Å²	124.7	57%	0.572	61%	0.607	S	S	*	*	H	α-helix	trans	-64.1	-41.9	-177.8	-63.9	-26.4	0	0	0	111.8	C548 I549	D545-C548 PolarHBondContact O-N 2.8Å; D545-I549 WeakPolarHBondContact O-CB 2.93Å; D545-I549 WeakPolarHBondContact O-CD1 3.4Å; D545-I549 WeakPolarHBondContact O-CG1 3.44Å; D545-I549 PolarHBondContact O-N 3.19Å
546	K	43.7	Very low	43.5	Very low	135 Å²	135	123.5 Å²	123.5	59%	0.587	59%	0.593	S	S	*	*	H	α-helix	trans	-61.9	-48.1	176.6	-64.3	-164.6	176.1	-165.4	0	112.8	K544 C548 I549 E550	K544-K546 PolarHBondContact O-N 3.03Å; K546-C548 PolarHBondContact O-N 2.94Å; K546-I549 PolarHBondContact O-N 3.47Å; K546-E550 PolarHBondContact O-N 3.01Å
547	S	40.2	Very low	45.1	Very low	65 Å²	65	115.9 Å²	115.9	46%	0.455	56%	0.563	S	S	.	*	H	α-helix	trans	-69.4	-30.6	178.8	52.9	0	0	0	0	113.4	L543 K544 A551	L543-S547 PolarHBondContact O-OG 2.94Å; K544-S547 PolarHBondContact O-N 2.81Å; K544-S547 PolarHBondContact O-OG 3.36Å; S547-A551 VanDerWaalsContact O-CB 3.24Å; S547-A551 WeakPolarHBondContact O-CB 3.24Å; S547-A551 PolarHBondContact O-N 2.86Å; S547-A551 VanDerWaalsContact O-N 3.09Å
548	C	43	Very low	47	Very low	78 Å²	78	114.4 Å²	114.4	53%	0.527	55%	0.55	S	S	.	.	H	α-helix	trans	-68.9	-42	170.4	-73.2	0	0	0	0	112.1	K544 D545 K546 A551 D552	K544-C548 VanDerWaalsContact O-CB 3.3Å; K544-C548 WeakPolarHBondContact O-CB 3.35Å; K544-C548 PolarHBondContact O-N 3.22Å; K544-C548 PolarHBondContact O-SG 3.24Å; D545-C548 PolarHBondContact O-N 2.8Å; K546-C548 PolarHBondContact O-N 2.94Å; C548-A551 PolarHBondContact O-N 3Å; C548-D552 WeakPolarHBondContact O-CB 3.35Å; C548-D552 PolarHBondContact O-N 3.21Å
549	I	44.7	Very low	49.1	Very low	94 Å²	94	115.4 Å²	115.4	48%	0.482	55%	0.546	S	S	.	.	H	α-helix	trans	-66.6	-40.7	178.9	-69.4	161.8	0	0	0	111.7	D545 K546 D552 R553	D545-I549 WeakPolarHBondContact O-CB 2.93Å; D545-I549 WeakPolarHBondContact O-CD1 3.4Å; D545-I549 WeakPolarHBondContact O-CG1 3.44Å; D545-I549 PolarHBondContact O-N 3.19Å; K546-I549 PolarHBondContact O-N 3.47Å; I549-D552 PolarHBondContact O-N 3.39Å; I549-R553 WeakPolarHBondContact O-CG 3.13Å; I549-R553 PolarHBondContact O-N 2.95Å
550	E	45	Very low	51.4	Low	120 Å²	120	108 Å²	108	56%	0.561	52%	0.521	S	S	*	.	H	α-helix	trans	-66.9	-45.1	175.3	-72.2	176	159.6	0	0	111.8	K546 D552 R553 Q554	K546-E550 PolarHBondContact O-N 3.01Å; E550-D552 PolarHBondContact O-N 3.12Å; E550-R553 PolarHBondContact O-N 3.19Å; E550-Q554 PolarHBondContact O-N 3.43Å; E550-Q554 PolarHBondContact O-OE1 3.44Å
551	A	39.8	Very low	53.1	Low	55 Å²	55	107 Å²	107	46%	0.455	52%	0.521	S	S	.	.	H	α-helix	trans	-62.5	-30.6	175.7	0	0	0	0	0	113.2	S547 C548 R555	S547-A551 VanDerWaalsContact O-CB 3.24Å; S547-A551 WeakPolarHBondContact O-CB 3.24Å; S547-A551 PolarHBondContact O-N 2.86Å; S547-A551 VanDerWaalsContact O-N 3.09Å; C548-A551 PolarHBondContact O-N 3Å; A551-R555 WeakPolarHBondContact O-CG 3.21Å; A551-R555 PolarHBondContact O-N 3.15Å
552	D	44.1	Very low	54.7	Low	62 Å²	62	104.5 Å²	104.5	33%	0.332	50%	0.504	S	S	.	.	H	α-helix	trans	-80.6	-28	176.9	-134.1	50.2	0	0	0	112.7	C548 I549 E550 R555 R556	C548-D552 WeakPolarHBondContact O-CB 3.35Å; C548-D552 PolarHBondContact O-N 3.21Å; I549-D552 PolarHBondContact O-N 3.39Å; E550-D552 PolarHBondContact O-N 3.12Å; D552-R555 IonicContact OD1-NH1 2.7Å; D552-R556 WeakPolarHBondContact O-CG 3.48Å; D552-R556 PolarHBondContact O-NE 3.41Å; D552-R556 IonicContact OD2-CZ 2.69Å; D552-R556 IonicContact OD2-NE 2.79Å; D552-R556 IonicContact OD2-NH2 3.58Å; D552-R556 PolarHBondContact OD2-NH2 3.09Å
553	R	48.1	Very low	56.5	Low	186 Å²	186	105.8 Å²	105.8	70%	0.702	50%	0.503	S	S	*	.	H	α-helix	trans	-67.7	-45.7	167.8	-78.5	176.9	169.1	175.3	-3.2	111.7	I549 E550 R555 R556	I549-R553 WeakPolarHBondContact O-CG 3.13Å; I549-R553 PolarHBondContact O-N 2.95Å; E550-R553 PolarHBondContact O-N 3.19Å; R553-R555 PolarHBondContact O-N 3.01Å; R553-R555 VanDerWaalsContact O-N 3.12Å; R553-R556 PolarHBondContact O-N 3.3Å
554	Q	47.4	Very low	58.3	Low	155 Å²	155	101.9 Å²	101.9	72%	0.724	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-15.3	177.4	-122.5	81.1	11.1	0	0	114.2	E550	E550-Q554 PolarHBondContact O-N 3.43Å; E550-Q554 PolarHBondContact O-OE1 3.44Å
555	R	49.7	Very low	60	Low	174 Å²	174	97.2 Å²	97.2	66%	0.657	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-23.7	-178.4	-89.8	177.8	174.1	-179.4	-0.1	115	A551 D552 R553	A551-R555 WeakPolarHBondContact O-CG 3.21Å; A551-R555 PolarHBondContact O-N 3.15Å; D552-R555 IonicContact OD1-NH1 2.7Å; R553-R555 PolarHBondContact O-N 3.01Å; R553-R555 VanDerWaalsContact O-N 3.12Å
556	R	58.4	Low	61.4	Low	115 Å²	115	97.5 Å²	97.5	43%	0.434	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-41.6	-162	-61.6	176.4	-162.7	-167.4	3.4	113.6	D552 R553 E748	D552-R556 WeakPolarHBondContact O-CG 3.48Å; D552-R556 PolarHBondContact O-NE 3.41Å; D552-R556 IonicContact OD2-CZ 2.69Å; D552-R556 IonicContact OD2-NE 2.79Å; D552-R556 IonicContact OD2-NH2 3.58Å; D552-R556 PolarHBondContact OD2-NH2 3.09Å; R553-R556 PolarHBondContact O-N 3.3Å; R556-E748 WeakPolarHBondContact CD-OE1 3.45Å; R556-E748 IonicContact NH1-OE1 2.73Å; R556-E748 PolarHBondContact NH1-OE1 3.01Å
557	V	68.1	Low	63.2	Low	44 Å²	44	96.3 Å²	96.3	27%	0.267	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	124.7	168.9	-172.3	0	0	0	0	108.2	L575 F577 L751	V557-L575 HydrophobicContact CG1-CB 4.3Å; V557-L575 HydrophobicContact CG1-CD2 4.04Å; V557-F577 HydrophobicContact CB-CE1 4.34Å; V557-F577 HydrophobicContact CG1-CD1 4.49Å; V557-F577 HydrophobicContact CG1-CE1 3.9Å; V557-F577 HydrophobicContact CG1-CZ 3.98Å; V557-F577 HydrophobicContact CG2-CD1 3.92Å; V557-F577 HydrophobicContact CG2-CE1 3.54Å; V557-F577 HydrophobicContact CG2-CZ 4.4Å; V557-L751 HydrophobicContact CG2-CD2 3.95Å
558	R	76	Confident	64.9	Low	155 Å²	155	96.9 Å²	96.9	59%	0.585	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.3	129	176.1	-61.7	-177.7	-174	173.1	3.8	110.5	V560 L576	R558-V560 HydrophobicContact CB-CG2 3.75Å; R558-L576 HydrophobicContact CB-CB 4.31Å; R558-L576 PolarHBondContact N-O 3.27Å; R558-L576 WeakPolarHBondContact O-CB 3.31Å; R558-L576 PolarHBondContact O-N 2.79Å
559	E	82	Confident	66.5	Low	141 Å²	141	101 Å²	101	66%	0.659	48%	0.48	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.9	120.2	165.8	-173	168.5	-123.6	0	0	108.6	H573 L575	E559-H573 VanDerWaalsContact CD-NE2 3.32Å; E559-H573 WeakPolarHBondContact CG-NE2 3.37Å; E559-H573 IonicContact OE1-CD2 3.04Å; E559-H573 IonicContact OE1-NE2 2.81Å; E559-H573 PolarHBondContact OE1-NE2 2.92Å; E559-L575 HydrophobicContact CB-CD2 4.02Å; E559-L575 HydrophobicContact CG-CD2 4.43Å
560	V	82.8	Confident	68.2	Low	36 Å²	36	99.6 Å²	99.6	22%	0.218	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	148.3	-170	-176.6	0	0	0	0	109.5	R558 V562 G574 L576	R558-V560 HydrophobicContact CB-CG2 3.75Å; V560-V562 HydrophobicContact CG1-CG2 4.18Å; V560-G574 PolarHBondContact N-O 2.78Å; V560-G574 PolarHBondContact O-N 3.27Å; V560-G574 VanDerWaalsContact O-O 3.07Å; V560-L576 HydrophobicContact CG2-CB 4.12Å; V560-L576 HydrophobicContact CG2-CD2 4.38Å
561	S	80.7	Confident	69.7	Low	59 Å²	59	98.9 Å²	98.9	41%	0.413	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	117.3	169.3	-64.7	0	0	0	0	110.3	I572 H573	S561-I572 CarbonylContact C-O 3.54Å; S561-I572 WeakPolarHBondContact CA-O 3.27Å; S561-H573 PolarHBondContact OG-ND1 3.02Å
562	V	80.8	Confident	71.7	Confident	15 Å²	15	96.6 Å²	96.6	9%	0.091	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	145.2	-178.9	178.4	0	0	0	0	109.6	V560 I572 F625 M632 L634	V560-V562 HydrophobicContact CG1-CG2 4.18Å; V562-I572 PolarHBondContact N-O 3.45Å; V562-I572 PolarHBondContact O-N 3.45Å; V562-F625 HydrophobicContact CB-CD1 4.41Å; V562-F625 HydrophobicContact CB-CD2 4.29Å; V562-F625 HydrophobicContact CB-CE1 4.19Å; V562-F625 HydrophobicContact CB-CE2 4.06Å; V562-F625 HydrophobicContact CB-CG 4.45Å; V562-F625 HydrophobicContact CB-CZ 4.01Å; V562-F625 HydrophobicContact CG2-CD1 4.39Å; V562-F625 HydrophobicContact CG2-CD2 3.52Å; V562-F625 HydrophobicContact CG2-CE1 4.45Å; V562-F625 HydrophobicContact CG2-CE2 3.58Å; V562-F625 HydrophobicContact CG2-CG 3.94Å; V562-F625 HydrophobicContact CG2-CZ 4.06Å; V562-M632 HydrophobicContact CG1-CE 4.28Å; V562-L634 HydrophobicContact CG1-CD1 4.2Å; V562-L634 HydrophobicContact CG2-CD1 4.12Å
563	R	81.3	Confident	73.6	Confident	174 Å²	174	98.5 Å²	98.5	66%	0.657	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.4	135.5	179.7	-64.6	-176.2	-176	-171.1	0.7	111.3	L571	R563-L571 HydrophobicContact CG-CD2 3.86Å
564	H	81	Confident	75.5	Confident	21 Å²	21	90 Å²	90	10%	0.097	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	129.7	179.4	-179.1	-88.8	0	0	0	111	E566 Q567 V570 I572 R630	H564-E566 VanDerWaalsContact C-N 3.33Å; H564-E566 PolarHBondContact ND1-N 3.48Å; H564-E566 PolarHBondContact O-N 3.32Å; H564-Q567 WeakPolarHBondContact CB-O 3.34Å; H564-Q567 PolarHBondContact ND1-N 3.47Å; H564-Q567 CarbonylContact O-C 3.56Å; H564-Q567 PolarHBondContact O-N 2.98Å; H564-V570 HydrophobicContact CB-CB 4.2Å; H564-V570 WeakPolarHBondContact CB-O 3.19Å; H564-V570 PolarHBondContact N-O 3.21Å; H564-I572 HydrophobicContact CB-CD1 3.92Å; H564-I572 HydrophobicContact CB-CG1 3.78Å; H564-R630 PolarHBondContact CD2-NE 3.14Å; H564-R630 PolarHBondContact CE1-NH2 3.05Å; H564-R630 PolarHBondContact NE2-NE 2.89Å; H564-R630 VanDerWaalsContact NE2-NE 3.16Å; H564-R630 PolarHBondContact NE2-NH2 2.89Å
565	P	76.1	Confident	77.5	Confident	50 Å²	50	85.2 Å²	85.2	33%	0.325	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-32.9	-169.8	20.1	-31.7	0	0	0	114.5	M632 I641 D644	P565-M632 HydrophobicContact CG-CE 4.4Å; P565-I641 HydrophobicContact CB-CD1 3.92Å; P565-D644 WeakPolarHBondContact CG-OD2 3.46Å
566	E	77.6	Confident	79.5	Confident	113 Å²	113	77.2 Å²	77.2	53%	0.528	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-9.7	178.4	-59.4	156.7	-150	0	0	112.4	H564 R630 K646	H564-E566 VanDerWaalsContact C-N 3.33Å; H564-E566 PolarHBondContact ND1-N 3.48Å; H564-E566 PolarHBondContact O-N 3.32Å; E566-R630 IonicContact OE1-CZ 2.72Å; E566-R630 IonicContact OE1-NH1 2.59Å; E566-R630 IonicContact OE1-NH2 3.93Å; E566-R630 PolarHBondContact OE1-NH2 2.79Å; E566-R630 IonicContact OE2-NH2 3.95Å; E566-K646 VanDerWaalsContact CD-NZ 3.3Å; E566-K646 WeakPolarHBondContact OE1-CE 3.48Å; E566-K646 IonicContact OE1-NZ 3.73Å; E566-K646 PolarHBondContact OE1-NZ 3.01Å; E566-K646 IonicContact OE2-NZ 3.39Å; E566-K646 PolarHBondContact OE2-NZ 3.2Å
567	Q	79.5	Confident	81	Confident	111 Å²	111	71.8 Å²	71.8	52%	0.519	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	79.9	-173.1	-65.8	-174	-1.9	0	0	110	H564 D569 V570	H564-Q567 WeakPolarHBondContact CB-O 3.34Å; H564-Q567 PolarHBondContact ND1-N 3.47Å; H564-Q567 CarbonylContact O-C 3.56Å; H564-Q567 PolarHBondContact O-N 2.98Å; Q567-D569 PolarHBondContact O-N 3.37Å; Q567-V570 HydrophobicContact CB-CB 4.4Å; Q567-V570 HydrophobicContact CB-CG2 4.13Å; Q567-V570 PolarHBondContact O-N 2.89Å
568	P	76.5	Confident	82.1	Confident	77 Å²	77	77 Å²	77	50%	0.5	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	-13.8	-168.8	26.4	-36.1	0	0	0	115	V570	P568-V570 VanDerWaalsContact C-N 3.33Å
569	D	77.1	Confident	82.8	Confident	163 Å²	163	69.9 Å²	69.9	87%	0.872	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.7	-20.8	173.9	-57.1	-40.6	0	0	0	112.8	Q567	Q567-D569 PolarHBondContact O-N 3.37Å
570	V	81	Confident	83.3	Confident	65 Å²	65	66.5 Å²	66.5	39%	0.394	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	129.1	178.5	-178.2	0	0	0	0	109.4	H564 Q567 P568	H564-V570 HydrophobicContact CB-CB 4.2Å; H564-V570 WeakPolarHBondContact CB-O 3.19Å; H564-V570 PolarHBondContact N-O 3.21Å; Q567-V570 HydrophobicContact CB-CB 4.4Å; Q567-V570 HydrophobicContact CB-CG2 4.13Å; Q567-V570 PolarHBondContact O-N 2.89Å; P568-V570 VanDerWaalsContact C-N 3.33Å
571	L	76.3	Confident	83.7	Confident	105 Å²	105	67.3 Å²	67.3	55%	0.55	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	119	175.1	-73.2	176.3	0	0	0	110.1	R563	R563-L571 HydrophobicContact CG-CD2 3.86Å
572	I	80.6	Confident	84.2	Confident	7 Å²	7	65.8 Å²	65.8	4%	0.036	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	125.8	170.6	-44	178.6	0	0	0	107.6	S561 V562 H564 F625 S627 R630 M632	S561-I572 CarbonylContact C-O 3.54Å; S561-I572 WeakPolarHBondContact CA-O 3.27Å; V562-I572 PolarHBondContact N-O 3.45Å; V562-I572 PolarHBondContact O-N 3.45Å; H564-I572 HydrophobicContact CB-CD1 3.92Å; H564-I572 HydrophobicContact CB-CG1 3.78Å; I572-F625 HydrophobicContact CB-CE1 4.18Å; I572-F625 HydrophobicContact CB-CZ 4.18Å; I572-F625 HydrophobicContact CG2-CE1 4Å; I572-F625 HydrophobicContact CG2-CZ 4.09Å; I572-F625 WeakPolarHBondContact O-CZ 3.41Å; I572-S627 VanDerWaalsContact CG2-OG 3.23Å; I572-S627 WeakPolarHBondContact CG2-OG 3.32Å; I572-R630 HydrophobicContact CD1-CG 4.33Å; I572-M632 HydrophobicContact CD1-SD 4.4Å
573	H	84.7	Confident	84.6	Confident	102 Å²	102	65.7 Å²	65.7	47%	0.472	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	142	173.1	-155.6	57.5	0	0	0	110.7	E559 S561 S627	E559-H573 VanDerWaalsContact CD-NE2 3.32Å; E559-H573 WeakPolarHBondContact CG-NE2 3.37Å; E559-H573 IonicContact OE1-CD2 3.04Å; E559-H573 IonicContact OE1-NE2 2.81Å; E559-H573 PolarHBondContact OE1-NE2 2.92Å; S561-H573 PolarHBondContact OG-ND1 3.02Å; H573-S627 WeakPolarHBondContact O-CB 3.31Å
574	G	87.1	Confident	85	Confident	9 Å²	9	59.8 Å²	59.8	9%	0.093	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.5	-177.8	-178.7	0	0	0	0	0	113.9	V560 F625 V626	V560-G574 PolarHBondContact N-O 2.78Å; V560-G574 PolarHBondContact O-N 3.27Å; V560-G574 VanDerWaalsContact O-O 3.07Å; G574-F625 VanDerWaalsContact CA-CE2 3.47Å; G574-V626 CarbonylContact C-O 3.55Å; G574-V626 VanDerWaalsContact CA-O 3.24Å; G574-V626 WeakPolarHBondContact CA-O 3.43Å
575	L	90.4	Very high	85.4	Confident	53 Å²	53	60.4 Å²	60.4	28%	0.277	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	133.7	-177.3	-64.4	171.9	0	0	0	110.5	V557 E559 F577 F625 V626 T755	V557-L575 HydrophobicContact CG1-CB 4.3Å; V557-L575 HydrophobicContact CG1-CD2 4.04Å; E559-L575 HydrophobicContact CB-CD2 4.02Å; E559-L575 HydrophobicContact CG-CD2 4.43Å; L575-F577 HydrophobicContact CB-CE2 3.74Å; L575-F577 HydrophobicContact CB-CZ 4.2Å; L575-F625 WeakPolarHBondContact O-CA 3.14Å; L575-V626 PolarHBondContact N-O 2.87Å; L575-V626 PolarHBondContact O-N 2.93Å; L575-T755 HydrophobicContact CB-CG2 4.41Å; L575-T755 HydrophobicContact CD1-CG2 3.56Å
576	L	90.6	Very high	85.8	Confident	6 Å²	6	62.7 Å²	62.7	3%	0.031	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	128.1	179.1	-161.2	79.5	0	0	0	109.9	R558 V560 E623 L624 F625 L634 L638	R558-L576 HydrophobicContact CB-CB 4.31Å; R558-L576 PolarHBondContact N-O 3.27Å; R558-L576 WeakPolarHBondContact O-CB 3.31Å; R558-L576 PolarHBondContact O-N 2.79Å; V560-L576 HydrophobicContact CG2-CB 4.12Å; V560-L576 HydrophobicContact CG2-CD2 4.38Å; L576-E623 HydrophobicContact CD1-CB 3.86Å; L576-E623 HydrophobicContact CD2-CB 4.16Å; L576-E623 HydrophobicContact CD2-CG 4.29Å; L576-E623 HydrophobicContact CG-CB 4.03Å; L576-L624 WeakPolarHBondContact CA-O 3.35Å; L576-F625 HydrophobicContact CD1-CB 4.02Å; L576-F625 HydrophobicContact CD1-CD2 4.36Å; L576-L634 HydrophobicContact CD1-CD1 4.19Å; L576-L638 HydrophobicContact CD1-CD2 3.79Å; L576-L638 HydrophobicContact CD2-CD1 4.1Å; L576-L638 HydrophobicContact CD2-CD2 3.84Å; L576-L638 HydrophobicContact CG-CD2 4.43Å
577	F	91.5	Very high	86.2	Confident	1 Å²	1	57.8 Å²	57.8	0%	0.004	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	130.1	177.4	-62.8	-90.6	0	0	0	110.7	V557 L575 L624 V626 L751 I752 T755	V557-F577 HydrophobicContact CB-CE1 4.34Å; V557-F577 HydrophobicContact CG1-CD1 4.49Å; V557-F577 HydrophobicContact CG1-CE1 3.9Å; V557-F577 HydrophobicContact CG1-CZ 3.98Å; V557-F577 HydrophobicContact CG2-CD1 3.92Å; V557-F577 HydrophobicContact CG2-CE1 3.54Å; V557-F577 HydrophobicContact CG2-CZ 4.4Å; L575-F577 HydrophobicContact CB-CE2 3.74Å; L575-F577 HydrophobicContact CB-CZ 4.2Å; F577-L624 HydrophobicContact CB-CB 4.41Å; F577-L624 PolarHBondContact N-O 3.39Å; F577-L624 PolarHBondContact O-N 3.23Å; F577-V626 HydrophobicContact CD2-CG2 4.28Å; F577-V626 HydrophobicContact CE2-CG2 4.32Å; F577-L751 HydrophobicContact CE1-CD2 4.1Å; F577-L751 HydrophobicContact CE1-CG 4.09Å; F577-I752 HydrophobicContact CB-CD1 3.93Å; F577-I752 HydrophobicContact CB-CG1 3.86Å; F577-I752 HydrophobicContact CD1-CD1 4.43Å; F577-I752 HydrophobicContact CD1-CG1 3.62Å; F577-I752 HydrophobicContact CD2-CG1 4.19Å; F577-I752 HydrophobicContact CE1-CG1 4.18Å; F577-I752 HydrophobicContact CG-CD1 4.27Å; F577-I752 HydrophobicContact CG-CG1 3.63Å; F577-T755 HydrophobicContact CE2-CG2 3.8Å; F577-T755 HydrophobicContact CZ-CG2 3.77Å; F577-T755 WeakPolarHBondContact CZ-OG1 3.32Å
578	R	90.1	Very high	86.2	Confident	154 Å²	154	57.8 Å²	57.8	58%	0.581	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	129.1	174.3	-167.2	170.2	-178	-152.4	-0.9	110.7	E623 S746	R578-E623 WeakPolarHBondContact CG-OE1 3.28Å; R578-S746 PolarHBondContact O-OG 2.64Å
579	A	91.7	Very high	85.9	Confident	5 Å²	5	54.4 Å²	54.4	4%	0.041	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	165.7	179.7	0	0	0	0	0	111.7	V622 L744	A579-V622 HydrophobicContact CB-CG2 4.3Å; A579-V622 PolarHBondContact N-O 3.24Å; A579-V622 WeakPolarHBondContact O-CG2 3.4Å; A579-V622 PolarHBondContact O-N 2.86Å; A579-L744 HydrophobicContact CB-CB 4.21Å; A579-L744 HydrophobicContact CB-CD2 3.93Å
580	Q	91.5	Very high	85.4	Confident	71 Å²	71	52.4 Å²	52.4	33%	0.332	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	111.2	170.9	-75.1	-171.6	88.6	0	0	108.7	M582 S619 V620 T621 L744 E745	Q580-M582 PolarHBondContact O-N 2.97Å; Q580-S619 PolarHBondContact OE1-OG 2.83Å; Q580-V620 CarbonylContact C-O 3.57Å; Q580-V620 WeakPolarHBondContact CA-O 3.33Å; Q580-T621 HydrophobicContact CG-CG2 4.35Å; Q580-L744 CarbonylContact O-C 3.53Å; Q580-L744 WeakPolarHBondContact O-CA 3.33Å; Q580-E745 HydrophobicContact CB-CB 4.15Å; Q580-E745 PolarHBondContact N-O 3.32Å; Q580-E745 PolarHBondContact NE2-OE2 3.26Å; Q580-E745 VanDerWaalsContact NE2-OE2 3.07Å; Q580-E745 PolarHBondContact O-N 3.47Å
581	Y	92.6	Very high	84.4	Confident	52 Å²	52	53 Å²	53	20%	0.204	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	119.2	176.3	174.3	-98.9	0	0	0	109.6	G583 S584 V620 I633 I643 L744	Y581-G583 WeakPolarHBondContact CE2-O 3.21Å; Y581-G583 VanDerWaalsContact CZ-C 3.47Å; Y581-S584 WeakPolarHBondContact OH-CB 3.12Å; Y581-S584 PolarHBondContact OH-N 3.35Å; Y581-S584 PolarHBondContact OH-OG 3.32Å; Y581-V620 PolarHBondContact N-O 3.07Å; Y581-V620 PolarHBondContact O-N 2.93Å; Y581-V620 VanDerWaalsContact O-N 3.07Å; Y581-I633 HydrophobicContact CD2-CD1 4.34Å; Y581-I643 HydrophobicContact CD2-CD1 4.41Å; Y581-I643 HydrophobicContact CE2-CD1 3.63Å; Y581-L744 HydrophobicContact CD2-CG 4.29Å
582	M	90.3	Very high	83.4	Confident	28 Å²	28	55 Å²	55	14%	0.138	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	-31.8	179.8	-61.5	-175.3	71.9	0	0	112.4	Q580 I609 K610 L659 V743 E745	Q580-M582 PolarHBondContact O-N 2.97Å; M582-I609 HydrophobicContact CB-CG2 3.9Å; M582-K610 HydrophobicContact CE-CG 4.44Å; M582-L659 HydrophobicContact SD-CD2 3.48Å; M582-L659 WeakPolarHBondContact SD-CD2 3.48Å; M582-V743 HydrophobicContact CB-CB 4.45Å; M582-V743 HydrophobicContact CB-CG1 4.33Å; M582-V743 HydrophobicContact CG-CG1 4.46Å; M582-V743 PolarHBondContact N-O 3.12Å; M582-V743 HydrophobicContact SD-CG1 3.85Å; M582-E745 HydrophobicContact CG-CB 4.15Å; M582-E745 HydrophobicContact SD-CB 4.11Å
583	G	89.9	Confident	82.7	Confident	13 Å²	13	55.6 Å²	55.6	13%	0.134	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.1	-178	179.2	0	0	0	0	0	115	Y581 V743	Y581-G583 WeakPolarHBondContact CE2-O 3.21Å; Y581-G583 VanDerWaalsContact CZ-C 3.47Å; G583-V743 PolarHBondContact N-O 2.99Å; G583-V743 PolarHBondContact O-N 3.03Å
584	S	89.6	Confident	82.3	Confident	49 Å²	49	55 Å²	55	34%	0.343	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	146.9	171.5	-64.6	0	0	0	0	110.7	Y581 C741 H742	Y581-S584 WeakPolarHBondContact OH-CB 3.12Å; Y581-S584 PolarHBondContact OH-N 3.35Å; Y581-S584 PolarHBondContact OH-OG 3.32Å; S584-C741 CarbonylContact C-O 3.56Å; S584-C741 VanDerWaalsContact CA-O 3.24Å; S584-C741 WeakPolarHBondContact CA-O 3.4Å; S584-H742 PolarHBondContact OG-CE1 2.79Å; S584-H742 PolarHBondContact OG-ND1 2.81Å
585	T	89	Confident	81.6	Confident	35 Å²	35	60.9 Å²	60.9	22%	0.215	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	163.2	165.3	-166.6	0	0	0	0	110.3	I587 V605 I609 C741	T585-I587 HydrophobicContact CG2-CG2 4.3Å; T585-V605 HydrophobicContact CG2-CB 4.03Å; T585-V605 HydrophobicContact CG2-CG1 3.63Å; T585-V605 HydrophobicContact CG2-CG2 3.57Å; T585-I609 HydrophobicContact CG2-CD1 4.16Å; T585-C741 HydrophobicContact CG2-CB 4.47Å; T585-C741 PolarHBondContact N-O 2.75Å; T585-C741 PolarHBondContact O-N 2.82Å
586	Q	85.3	Confident	81.1	Confident	98 Å²	98	63.9 Å²	63.9	46%	0.458	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	136	172.2	-67.9	178.4	53.3	0	0	108.7	M739 I740	Q586-M739 WeakPolarHBondContact CA-O 3.44Å; Q586-I740 HydrophobicContact CG-CG1 4.48Å
587	I	84.5	Confident	80.8	Confident	10 Å²	10	65.5 Å²	65.5	5%	0.051	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	152.6	174.9	66.7	176	0	0	0	110.6	T585 Q601 V605 M663 M739 C741	T585-I587 HydrophobicContact CG2-CG2 4.3Å; I587-Q601 HydrophobicContact CD1-CB 3.65Å; I587-Q601 HydrophobicContact CD1-CG 3.94Å; I587-V605 HydrophobicContact CD1-CG2 4.39Å; I587-V605 HydrophobicContact CG2-CG2 3.46Å; I587-V605 VanDerWaalsContact CG2-CG2 3.46Å; I587-M663 HydrophobicContact CD1-SD 3.85Å; I587-M739 HydrophobicContact CD1-CB 4.3Å; I587-M739 HydrophobicContact CG1-CB 3.66Å; I587-M739 PolarHBondContact N-O 3.32Å; I587-M739 PolarHBondContact O-N 2.86Å; I587-C741 VanDerWaalsContact CD1-SG 3.54Å
588	L	80.4	Confident	80.5	Confident	110 Å²	110	67.7 Å²	67.7	58%	0.576	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.7	120.1	178	-152.1	68.1	0	0	0	109.3	P736	L588-P736 HydrophobicContact CD1-CB 3.6Å; L588-P736 HydrophobicContact CD1-CG 3.4Å; L588-P736 VanDerWaalsContact CD1-CG 3.4Å; L588-P736 HydrophobicContact CD2-CB 4Å; L588-P736 HydrophobicContact CD2-CG 3.99Å; L588-P736 HydrophobicContact CG-CB 3.68Å; L588-P736 HydrophobicContact CG-CG 3.92Å
589	C	69.7	Low	80.4	Confident	6 Å²	6	63.8 Å²	63.8	4%	0.041	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	125.2	-179.3	-163.6	0	0	0	0	111	S593 M737 M739	C589-S593 PolarHBondContact SG-OG 3.17Å; C589-M737 PolarHBondContact N-O 2.78Å; C589-M737 PolarHBondContact O-N 2.94Å; C589-M739 HydrophobicContact CB-CG 3.47Å; C589-M739 VanDerWaalsContact CB-CG 3.47Å
590	N	66.3	Low	80.2	Confident	122 Å²	122	69 Å²	69	65%	0.652	35%	0.349	S	S	*	.			trans	-70.2	141	166.9	-65.8	-23.8	0	0	0	108.5	Q592	N590-Q592 PolarHBondContact O-N 3.48Å
591	K	59.5	Low	80	Confident	76 Å²	76	66.8 Å²	66.8	33%	0.33	34%	0.339	S	S	.	.	S	Bend	trans	-54.7	-26.4	-173.5	-79.4	-161.1	-172.3	-168.6	0	113.9	S682 N683 N686	K591-S682 PolarHBondContact NZ-O 3.06Å; K591-N683 PolarHBondContact NZ-OD1 3.46Å; K591-N686 HydrophobicContact CD-CB 3.67Å
592	Q	56.6	Low	79.8	Confident	147 Å²	147	64.3 Å²	64.3	69%	0.687	33%	0.329	S	S	*	.	S	Bend	trans	-110.8	73.7	-179.5	-144.8	161.2	10	0	0	110.3	N590	N590-Q592 PolarHBondContact O-N 3.48Å
593	S	66.2	Low	79.8	Confident	20 Å²	20	66.5 Å²	66.5	14%	0.14	34%	0.339	C	S	.	.			trans	-97.3	116	176.9	40.5	0	0	0	0	111.3	C589 R598	C589-S593 PolarHBondContact SG-OG 3.17Å; S593-R598 PolarHBondContact OG-NE 3.25Å; S593-R598 VanDerWaalsContact OG-NE 3.07Å; S593-R598 PolarHBondContact OG-NH2 3.11Å
594	T	76.6	Confident	79.7	Confident	91 Å²	91	70 Å²	70	56%	0.558	35%	0.352	S	S	*	.			trans	-65.8	160.4	174.2	63.8	0	0	0	0	111.6	M596 S597 R598	T594-M596 PolarHBondContact O-N 2.86Å; T594-S597 WeakPolarHBondContact O-CB 3.48Å; T594-S597 PolarHBondContact O-N 3.13Å; T594-S597 WeakPolarHBondContact OG1-CB 3.23Å; T594-S597 PolarHBondContact OG1-N 3.37Å; T594-S597 VanDerWaalsContact OG1-N 3.13Å; T594-R598 PolarHBondContact O-N 2.97Å
595	R	71.4	Confident	79.7	Confident	132 Å²	132	67.6 Å²	67.6	50%	0.498	34%	0.336	S	S	.	.	H	α-helix	trans	-52.1	-42.5	173.4	-179.7	179.2	173.4	177	-1.6	111.8	H406 T408 R598 M599	H406-R595 PolarHBondContact ND1-NH2 2.94Å; T408-R595 PolarHBondContact OG1-NH1 2.91Å; R595-R598 PolarHBondContact O-N 3.05Å; R595-M599 PolarHBondContact O-N 2.88Å
596	M	81	Confident	79.7	Confident	115 Å²	115	66.3 Å²	66.3	57%	0.567	33%	0.327	S	S	*	.	H	α-helix	trans	-63.4	-44.3	176.3	-172.5	58.8	67.2	0	0	112.1	T594 R598 M599 L600	T594-M596 PolarHBondContact O-N 2.86Å; M596-R598 VanDerWaalsContact C-N 3.28Å; M596-R598 PolarHBondContact O-N 2.98Å; M596-M599 HydrophobicContact CE-CE 4.25Å; M596-M599 PolarHBondContact O-N 3.21Å; M596-M599 HydrophobicContact SD-CE 3.5Å; M596-M599 VanDerWaalsContact SD-CE 3.5Å; M596-L600 PolarHBondContact O-N 2.99Å
597	S	83.3	Confident	79.8	Confident	40 Å²	40	66.8 Å²	66.8	28%	0.28	33%	0.333	S	S	.	.	H	α-helix	trans	-61.5	-35.6	175.1	-179.6	0	0	0	0	112.5	T594 Q601	T594-S597 WeakPolarHBondContact O-CB 3.48Å; T594-S597 PolarHBondContact O-N 3.13Å; T594-S597 WeakPolarHBondContact OG1-CB 3.23Å; T594-S597 PolarHBondContact OG1-N 3.37Å; T594-S597 VanDerWaalsContact OG1-N 3.13Å; S597-Q601 WeakPolarHBondContact O-CB 3.49Å; S597-Q601 WeakPolarHBondContact O-CG 3.44Å; S597-Q601 PolarHBondContact O-N 3.21Å; S597-Q601 PolarHBondContact OG-NE2 3.28Å
598	R	85.2	Confident	79.9	Confident	47 Å²	47	73.1 Å²	73.1	18%	0.177	36%	0.356	C	S	.	.	H	α-helix	trans	-72.4	-34.5	176.2	-68.8	-174.6	-176.5	-138.6	-10.6	112.7	S593 T594 R595 M596 Q601 A602 S651 Y652 M663	S593-R598 PolarHBondContact OG-NE 3.25Å; S593-R598 VanDerWaalsContact OG-NE 3.07Å; S593-R598 PolarHBondContact OG-NH2 3.11Å; T594-R598 PolarHBondContact O-N 2.97Å; R595-R598 PolarHBondContact O-N 3.05Å; M596-R598 VanDerWaalsContact C-N 3.28Å; M596-R598 PolarHBondContact O-N 2.98Å; R598-Q601 PolarHBondContact O-N 3.3Å; R598-A602 WeakPolarHBondContact O-CB 3.44Å; R598-A602 PolarHBondContact O-N 2.87Å; R598-S651 PolarHBondContact NH1-O 2.94Å; R598-S651 PolarHBondContact NH1-OG 2.99Å; R598-Y652 HydrophobicContact CB-CD1 4.47Å; R598-Y652 HydrophobicContact CB-CD2 3.99Å; R598-Y652 HydrophobicContact CB-CE2 4.32Å; R598-Y652 HydrophobicContact CB-CG 4.07Å; R598-M663 HydrophobicContact CB-CE 3.72Å; R598-M663 HydrophobicContact CG-CE 4.17Å; R598-M663 VanDerWaalsContact O-CE 3.26Å; R598-M663 WeakPolarHBondContact O-CE 3.41Å
599	M	87.3	Confident	80.2	Confident	73 Å²	73	69.6 Å²	69.6	36%	0.36	34%	0.338	S	S	.	.	H	α-helix	trans	-65.9	-45.8	174.1	-168.2	-178.9	83	0	0	111.5	R595 M596 Q601 A602 Q603	R595-M599 PolarHBondContact O-N 2.88Å; M596-M599 HydrophobicContact CE-CE 4.25Å; M596-M599 PolarHBondContact O-N 3.21Å; M596-M599 HydrophobicContact SD-CE 3.5Å; M596-M599 VanDerWaalsContact SD-CE 3.5Å; M599-Q601 VanDerWaalsContact C-N 3.34Å; M599-Q601 PolarHBondContact O-N 3.46Å; M599-A602 PolarHBondContact O-N 3.08Å; M599-Q603 PolarHBondContact O-N 2.91Å
600	L	87.4	Confident	80.8	Confident	113 Å²	113	73.6 Å²	73.6	59%	0.592	36%	0.355	S	S	*	.	H	α-helix	trans	-60.8	-42.4	174.1	-71	171.4	0	0	0	111.9	M596 Q603 E604	M596-L600 PolarHBondContact O-N 2.99Å; L600-Q603 PolarHBondContact O-N 3.39Å; L600-E604 WeakPolarHBondContact O-CB 3.44Å; L600-E604 PolarHBondContact O-N 3.28Å
601	Q	88	Confident	81	Confident	25 Å²	25	69.3 Å²	69.3	12%	0.117	34%	0.336	C	S	.	.	H	α-helix	trans	-60.8	-43.1	173.1	-80.4	167.3	10.8	0	0	112.7	I587 S597 R598 M599 E604 V605 M663	I587-Q601 HydrophobicContact CD1-CB 3.65Å; I587-Q601 HydrophobicContact CD1-CG 3.94Å; S597-Q601 WeakPolarHBondContact O-CB 3.49Å; S597-Q601 WeakPolarHBondContact O-CG 3.44Å; S597-Q601 PolarHBondContact O-N 3.21Å; S597-Q601 PolarHBondContact OG-NE2 3.28Å; R598-Q601 PolarHBondContact O-N 3.3Å; M599-Q601 VanDerWaalsContact C-N 3.34Å; M599-Q601 PolarHBondContact O-N 3.46Å; Q601-E604 PolarHBondContact O-N 2.99Å; Q601-V605 WeakPolarHBondContact O-CB 3.49Å; Q601-V605 VanDerWaalsContact O-CG2 3.23Å; Q601-V605 WeakPolarHBondContact O-CG2 3.38Å; Q601-V605 PolarHBondContact O-N 2.95Å; Q601-M663 HydrophobicContact CB-CE 4.36Å
602	A	88.5	Confident	81.6	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-64.2	-41	176.8	0	0	0	0	0	111.8	R598 M599 V605 V606 Y652 V661 M663	R598-A602 WeakPolarHBondContact O-CB 3.44Å; R598-A602 PolarHBondContact O-N 2.87Å; M599-A602 PolarHBondContact O-N 3.08Å; A602-V605 WeakPolarHBondContact O-CB 3.21Å; A602-V605 PolarHBondContact O-N 3.33Å; A602-V606 WeakPolarHBondContact O-CG2 3.32Å; A602-V606 PolarHBondContact O-N 2.63Å; A602-Y652 HydrophobicContact CB-CD1 4.26Å; A602-Y652 HydrophobicContact CB-CE1 3.86Å; A602-V661 HydrophobicContact CB-CG1 4.08Å; A602-M663 HydrophobicContact CB-CE 4.49Å; A602-M663 HydrophobicContact CB-SD 4.29Å
603	Q	90.1	Very high	81.9	Confident	75 Å²	75	69.5 Å²	69.5	35%	0.35	35%	0.351	S	S	.	.	H	α-helix	trans	-66.3	-41.3	175.1	-169.9	62.9	60.3	0	0	112	M599 L600 V605 V606 N607	M599-Q603 PolarHBondContact O-N 2.91Å; L600-Q603 PolarHBondContact O-N 3.39Å; Q603-V605 VanDerWaalsContact C-N 3.3Å; Q603-V605 PolarHBondContact O-N 3.02Å; Q603-V606 PolarHBondContact O-N 2.87Å; Q603-N607 PolarHBondContact NE2-OD1 2.95Å; Q603-N607 WeakPolarHBondContact O-CB 3.26Å; Q603-N607 PolarHBondContact O-N 2.84Å; Q603-N607 PolarHBondContact O-OD1 2.88Å
604	E	88.8	Confident	81.6	Confident	85 Å²	85	76.3 Å²	76.3	40%	0.397	39%	0.385	S	S	.	.	H	α-helix	trans	-59.4	-41.3	173.6	-173.1	-171.6	179.6	0	0	111.4	L600 Q601 N607 R608	L600-E604 WeakPolarHBondContact O-CB 3.44Å; L600-E604 PolarHBondContact O-N 3.28Å; Q601-E604 PolarHBondContact O-N 2.99Å; E604-N607 PolarHBondContact O-N 3.4Å; E604-R608 WeakPolarHBondContact O-CB 3.42Å; E604-R608 WeakPolarHBondContact O-CD 3.44Å; E604-R608 WeakPolarHBondContact O-CG 3.45Å; E604-R608 PolarHBondContact O-N 2.94Å; E604-R608 IonicContact OE1-CZ 3.6Å; E604-R608 VanDerWaalsContact OE1-CZ 3.27Å; E604-R608 IonicContact OE1-NE 3.97Å; E604-R608 PolarHBondContact OE1-NE 2.72Å; E604-R608 IonicContact OE1-NH2 3.47Å; E604-R608 PolarHBondContact OE1-NH2 3.36Å
605	V	88.6	Confident	81.1	Confident	0 Å²	0	78.7 Å²	78.7	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-61.8	-47	174.3	164.2	0	0	0	0	111.9	T585 I587 Q601 A602 Q603 R608 I609 C741 V743	T585-V605 HydrophobicContact CG2-CB 4.03Å; T585-V605 HydrophobicContact CG2-CG1 3.63Å; T585-V605 HydrophobicContact CG2-CG2 3.57Å; I587-V605 HydrophobicContact CD1-CG2 4.39Å; I587-V605 HydrophobicContact CG2-CG2 3.46Å; I587-V605 VanDerWaalsContact CG2-CG2 3.46Å; Q601-V605 WeakPolarHBondContact O-CB 3.49Å; Q601-V605 VanDerWaalsContact O-CG2 3.23Å; Q601-V605 WeakPolarHBondContact O-CG2 3.38Å; Q601-V605 PolarHBondContact O-N 2.95Å; A602-V605 WeakPolarHBondContact O-CB 3.21Å; A602-V605 PolarHBondContact O-N 3.33Å; Q603-V605 VanDerWaalsContact C-N 3.3Å; Q603-V605 PolarHBondContact O-N 3.02Å; V605-R608 PolarHBondContact O-N 2.87Å; V605-I609 HydrophobicContact CG1-CD1 3.9Å; V605-I609 WeakPolarHBondContact O-CG1 3.44Å; V605-I609 PolarHBondContact O-N 2.98Å; V605-C741 HydrophobicContact CB-CB 4.38Å; V605-C741 HydrophobicContact CG1-CB 3.8Å; V605-C741 HydrophobicContact CG2-CB 3.82Å; V605-V743 HydrophobicContact CG1-CG2 3.68Å
606	V	89.3	Confident	80.6	Confident	7 Å²	7	78.2 Å²	78.2	4%	0.042	41%	0.407	C	S	.	.	H	α-helix	trans	-60.9	-45.9	177	168.3	0	0	0	0	110.6	A602 Q603 R608 I609 K610 I656 L659 V661 V743	A602-V606 WeakPolarHBondContact O-CG2 3.32Å; A602-V606 PolarHBondContact O-N 2.63Å; Q603-V606 PolarHBondContact O-N 2.87Å; V606-R608 PolarHBondContact O-N 2.89Å; V606-I609 PolarHBondContact O-N 2.81Å; V606-I609 VanDerWaalsContact O-N 3.13Å; V606-K610 WeakPolarHBondContact O-CB 3.43Å; V606-K610 PolarHBondContact O-N 2.97Å; V606-I656 HydrophobicContact CG2-CD1 4.21Å; V606-L659 HydrophobicContact CG1-CD1 3.59Å; V606-L659 HydrophobicContact CG2-CD1 4.32Å; V606-V661 HydrophobicContact CG2-CG2 3.55Å; V606-V743 HydrophobicContact CG2-CG1 4.42Å; V606-V743 HydrophobicContact CG2-CG2 4.24Å
607	N	88	Confident	79.7	Confident	109 Å²	109	75.7 Å²	75.7	58%	0.583	39%	0.394	S	S	*	.	H	α-helix	trans	-65.9	-21.3	178.7	-64.8	2.8	0	0	0	113.4	Q603 E604	Q603-N607 PolarHBondContact NE2-OD1 2.95Å; Q603-N607 WeakPolarHBondContact O-CB 3.26Å; Q603-N607 PolarHBondContact O-N 2.84Å; Q603-N607 PolarHBondContact O-OD1 2.88Å; E604-N607 PolarHBondContact O-N 3.4Å
608	R	86.6	Confident	79.3	Confident	142 Å²	142	79.6 Å²	79.6	54%	0.536	42%	0.418	S	S	.	.	H	α-helix	trans	-84.9	-21.8	174.6	-74.9	166.4	175.9	-146.5	1.4	113.6	E604 V605 V606	E604-R608 WeakPolarHBondContact O-CB 3.42Å; E604-R608 WeakPolarHBondContact O-CD 3.44Å; E604-R608 WeakPolarHBondContact O-CG 3.45Å; E604-R608 PolarHBondContact O-N 2.94Å; E604-R608 IonicContact OE1-CZ 3.6Å; E604-R608 VanDerWaalsContact OE1-CZ 3.27Å; E604-R608 IonicContact OE1-NE 3.97Å; E604-R608 PolarHBondContact OE1-NE 2.72Å; E604-R608 IonicContact OE1-NH2 3.47Å; E604-R608 PolarHBondContact OE1-NH2 3.36Å; V605-R608 PolarHBondContact O-N 2.87Å; V606-R608 PolarHBondContact O-N 2.89Å
609	I	85.9	Confident	79.1	Confident	36 Å²	36	79.6 Å²	79.6	19%	0.185	43%	0.426	C	S	.	.	H	α-helix	trans	-105	-37.1	-174.7	-68.1	171.8	0	0	0	111.4	M582 T585 V605 V606 A611 V743	M582-I609 HydrophobicContact CB-CG2 3.9Å; T585-I609 HydrophobicContact CG2-CD1 4.16Å; V605-I609 HydrophobicContact CG1-CD1 3.9Å; V605-I609 WeakPolarHBondContact O-CG1 3.44Å; V605-I609 PolarHBondContact O-N 2.98Å; V606-I609 PolarHBondContact O-N 2.81Å; V606-I609 VanDerWaalsContact O-N 3.13Å; I609-A611 PolarHBondContact O-N 3.19Å; I609-V743 HydrophobicContact CD1-CB 4.28Å; I609-V743 HydrophobicContact CD1-CG2 3.74Å
610	K	82.3	Confident	79.1	Confident	91 Å²	91	79.9 Å²	79.9	40%	0.396	43%	0.431	S	S	.	.	S	Bend	trans	-72.6	117.4	173.2	-163.2	-168.1	176.9	-143.4	0	108.7	M582 V606 D613 H617	M582-K610 HydrophobicContact CE-CG 4.44Å; V606-K610 WeakPolarHBondContact O-CB 3.43Å; V606-K610 PolarHBondContact O-N 2.97Å; K610-D613 IonicContact NZ-OD1 2.8Å; K610-D613 PolarHBondContact NZ-OD1 2.86Å; K610-H617 VanDerWaalsContact CG-NE2 3.32Å; K610-H617 WeakPolarHBondContact CG-NE2 3.44Å
611	A	70.7	Confident	79.3	Confident	31 Å²	31	77.3 Å²	77.3	26%	0.256	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-70	161.2	172.8	0	0	0	0	0	109.9	I609 H617	I609-A611 PolarHBondContact O-N 3.19Å; A611-H617 VanDerWaalsContact CB-CE1 3.44Å; A611-H617 WeakPolarHBondContact CB-CE1 3.33Å; A611-H617 PolarHBondContact N-CE1 3.21Å; A611-H617 VanDerWaalsContact N-CE1 3.32Å; A611-H617 PolarHBondContact O-CE1 2.74Å; A611-H617 VanDerWaalsContact O-CE1 3.27Å
612	P	72.1	Confident	79.5	Confident	96 Å²	96	76.1 Å²	76.1	62%	0.623	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-54.8	152.6	168.9	24.2	-34.7	0	0	0	111.2	D614 E615	P612-D614 PolarHBondContact O-N 2.88Å; P612-E615 PolarHBondContact O-N 2.78Å
613	D	62.5	Low	79.6	Confident	132 Å²	132	77.5 Å²	77.5	71%	0.706	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-3.6	-162.9	-59.5	-64.5	0	0	0	115.6	K610	K610-D613 IonicContact NZ-OD1 2.8Å; K610-D613 PolarHBondContact NZ-OD1 2.86Å
614	D	61	Low	79.8	Confident	163 Å²	163	74 Å²	74	87%	0.872	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-6.3	-178.8	-65.2	-52.3	0	0	0	114.9	P612	P612-D614 PolarHBondContact O-N 2.88Å
615	E	65.5	Low	80	Confident	140 Å²	140	69.9 Å²	69.9	65%	0.654	39%	0.386	S	S	*	.	S	Bend	trans	-119.9	130.7	-180	-68.7	-163.4	157.1	0	0	114.2	P612 H617	P612-E615 PolarHBondContact O-N 2.78Å; E615-H617 PolarHBondContact O-CE1 2.96Å; E615-H617 PolarHBondContact O-N 3.07Å; E615-H617 VanDerWaalsContact O-N 3.15Å; E615-H617 PolarHBondContact O-ND1 2.83Å
616	S	60	Low	80.1	Confident	123 Å²	123	70.1 Å²	70.1	86%	0.86	39%	0.387	S	S	*	.			trans	-64.8	113.3	177.4	59.6	0	0	0	0	111.7
617	H	63.2	Low	80.2	Confident	61 Å²	61	70 Å²	70	28%	0.282	39%	0.386	S	S	.	.			trans	-68.5	138.3	-178.1	-56	-7.8	0	0	0	111.7	K610 A611 E615 S619	K610-H617 VanDerWaalsContact CG-NE2 3.32Å; K610-H617 WeakPolarHBondContact CG-NE2 3.44Å; A611-H617 VanDerWaalsContact CB-CE1 3.44Å; A611-H617 WeakPolarHBondContact CB-CE1 3.33Å; A611-H617 PolarHBondContact N-CE1 3.21Å; A611-H617 VanDerWaalsContact N-CE1 3.32Å; A611-H617 PolarHBondContact O-CE1 2.74Å; A611-H617 VanDerWaalsContact O-CE1 3.27Å; E615-H617 PolarHBondContact O-CE1 2.96Å; E615-H617 PolarHBondContact O-N 3.07Å; E615-H617 VanDerWaalsContact O-N 3.15Å; E615-H617 PolarHBondContact O-ND1 2.83Å; H617-S619 PolarHBondContact O-N 2.87Å
618	P	74	Confident	80.1	Confident	122 Å²	122	67.2 Å²	67.2	79%	0.792	37%	0.374	S	S	*	.			trans	-77	83.8	174.4	31.6	-34.3	0	0	0	110.8
619	S	80.8	Confident	80	Confident	48 Å²	48	65.4 Å²	65.4	34%	0.336	37%	0.371	S	S	.	.			trans	-87.3	148.4	173.6	63.8	0	0	0	0	112.4	Q580 H617	Q580-S619 PolarHBondContact OE1-OG 2.83Å; H617-S619 PolarHBondContact O-N 2.87Å
620	V	88.9	Confident	80.2	Confident	78 Å²	78	63.9 Å²	63.9	47%	0.473	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	129	174.3	179.6	0	0	0	0	109.4	Q580 Y581 V622	Q580-V620 CarbonylContact C-O 3.57Å; Q580-V620 WeakPolarHBondContact CA-O 3.33Å; Y581-V620 PolarHBondContact N-O 3.07Å; Y581-V620 PolarHBondContact O-N 2.93Å; Y581-V620 VanDerWaalsContact O-N 3.07Å; V620-V622 HydrophobicContact CG1-CG1 4.26Å; V620-V622 PolarHBondContact O-N 3.17Å
621	T	90.3	Very high	80.7	Confident	59 Å²	59	59.6 Å²	59.6	36%	0.362	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	121.3	174.6	53.2	0	0	0	0	110.6	Q580 S636	Q580-T621 HydrophobicContact CG-CG2 4.35Å; T621-S636 PolarHBondContact O-OG 2.85Å; T621-S636 PolarHBondContact OG1-OG 2.8Å
622	V	92.3	Very high	81.7	Confident	1 Å²	1	58.1 Å²	58.1	1%	0.006	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	160.7	-178	-63.5	0	0	0	0	110.5	A579 V620 I633 L634 L642 L744	A579-V622 HydrophobicContact CB-CG2 4.3Å; A579-V622 PolarHBondContact N-O 3.24Å; A579-V622 WeakPolarHBondContact O-CG2 3.4Å; A579-V622 PolarHBondContact O-N 2.86Å; V620-V622 HydrophobicContact CG1-CG1 4.26Å; V620-V622 PolarHBondContact O-N 3.17Å; V622-I633 HydrophobicContact CB-CG2 3.65Å; V622-I633 HydrophobicContact CG1-CG2 3.85Å; V622-I633 HydrophobicContact CG2-CG2 3.75Å; V622-L634 WeakPolarHBondContact CA-O 3.34Å; V622-L634 WeakPolarHBondContact CB-O 3.48Å; V622-L642 HydrophobicContact CG1-CD1 3.77Å; V622-L744 HydrophobicContact CG2-CD2 3.86Å
623	E	91.6	Very high	82.7	Confident	29 Å²	29	53.7 Å²	53.7	14%	0.136	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	113.1	172.5	-63.5	-67.9	159.8	0	0	108.1	L576 R578 L634 L638	L576-E623 HydrophobicContact CD1-CB 3.86Å; L576-E623 HydrophobicContact CD2-CB 4.16Å; L576-E623 HydrophobicContact CD2-CG 4.29Å; L576-E623 HydrophobicContact CG-CB 4.03Å; R578-E623 WeakPolarHBondContact CG-OE1 3.28Å; E623-L634 HydrophobicContact CB-CB 4.39Å; E623-L634 PolarHBondContact N-O 3.45Å; E623-L634 WeakPolarHBondContact O-CB 3.43Å; E623-L634 PolarHBondContact O-N 3.06Å; E623-L638 HydrophobicContact CB-CD2 3.66Å; E623-L638 HydrophobicContact CG-CD2 3.94Å
624	L	92.8	Very high	84.1	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	113	178.5	177	70.5	0	0	0	109.1	L576 F577 V626 I631 I633 F660 I752	L576-L624 WeakPolarHBondContact CA-O 3.35Å; F577-L624 HydrophobicContact CB-CB 4.41Å; F577-L624 PolarHBondContact N-O 3.39Å; F577-L624 PolarHBondContact O-N 3.23Å; L624-V626 HydrophobicContact CD2-CG2 4.42Å; L624-V626 HydrophobicContact CG-CG2 4.19Å; L624-I631 HydrophobicContact CD1-CG2 3.75Å; L624-I633 HydrophobicContact CD1-CG1 3.72Å; L624-F660 HydrophobicContact CD2-CD1 4.31Å; L624-F660 HydrophobicContact CD2-CE1 4.19Å; L624-I752 HydrophobicContact CD2-CD1 4.25Å; L624-I752 HydrophobicContact CD2-CG1 4.49Å; L624-I752 HydrophobicContact CD2-CG2 3.43Å; L624-I752 VanDerWaalsContact CD2-CG2 3.43Å
625	F	93.2	Very high	85.3	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	128.4	175.6	176.7	-101.4	0	0	0	110.7	V562 I572 G574 L575 L576 I631 M632 L634	V562-F625 HydrophobicContact CB-CD1 4.41Å; V562-F625 HydrophobicContact CB-CD2 4.29Å; V562-F625 HydrophobicContact CB-CE1 4.19Å; V562-F625 HydrophobicContact CB-CE2 4.06Å; V562-F625 HydrophobicContact CB-CG 4.45Å; V562-F625 HydrophobicContact CB-CZ 4.01Å; V562-F625 HydrophobicContact CG2-CD1 4.39Å; V562-F625 HydrophobicContact CG2-CD2 3.52Å; V562-F625 HydrophobicContact CG2-CE1 4.45Å; V562-F625 HydrophobicContact CG2-CE2 3.58Å; V562-F625 HydrophobicContact CG2-CG 3.94Å; V562-F625 HydrophobicContact CG2-CZ 4.06Å; I572-F625 HydrophobicContact CB-CE1 4.18Å; I572-F625 HydrophobicContact CB-CZ 4.18Å; I572-F625 HydrophobicContact CG2-CE1 4Å; I572-F625 HydrophobicContact CG2-CZ 4.09Å; I572-F625 WeakPolarHBondContact O-CZ 3.41Å; G574-F625 VanDerWaalsContact CA-CE2 3.47Å; L575-F625 WeakPolarHBondContact O-CA 3.14Å; L576-F625 HydrophobicContact CD1-CB 4.02Å; L576-F625 HydrophobicContact CD1-CD2 4.36Å; F625-I631 WeakPolarHBondContact O-CA 3.24Å; F625-M632 HydrophobicContact CB-CB 4.31Å; F625-M632 HydrophobicContact CD1-CB 4.3Å; F625-M632 HydrophobicContact CD1-CG 4.37Å; F625-M632 HydrophobicContact CD1-SD 3.94Å; F625-M632 HydrophobicContact CE1-SD 4.32Å; F625-M632 PolarHBondContact N-O 3.34Å; F625-M632 PolarHBondContact O-N 3.14Å; F625-L634 HydrophobicContact CB-CD1 3.98Å; F625-L634 HydrophobicContact CB-CG 4.44Å
626	V	91.9	Very high	86.1	Confident	4 Å²	4	37.4 Å²	37.4	2%	0.024	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	120.8	-179	-179.6	0	0	0	0	109.7	G574 L575 F577 L624 T755 V756 A759	G574-V626 CarbonylContact C-O 3.55Å; G574-V626 VanDerWaalsContact CA-O 3.24Å; G574-V626 WeakPolarHBondContact CA-O 3.43Å; L575-V626 PolarHBondContact N-O 2.87Å; L575-V626 PolarHBondContact O-N 2.93Å; F577-V626 HydrophobicContact CD2-CG2 4.28Å; F577-V626 HydrophobicContact CE2-CG2 4.32Å; L624-V626 HydrophobicContact CD2-CG2 4.42Å; L624-V626 HydrophobicContact CG-CG2 4.19Å; V626-T755 HydrophobicContact CG1-CG2 4.29Å; V626-V756 HydrophobicContact CB-CG2 4.4Å; V626-V756 HydrophobicContact CG1-CB 4.41Å; V626-V756 HydrophobicContact CG1-CG2 3.69Å; V626-V756 HydrophobicContact CG2-CG2 3.74Å; V626-A759 HydrophobicContact CG1-CB 4.12Å
627	S	90.6	Very high	87	Confident	5 Å²	5	36.7 Å²	36.7	4%	0.035	21%	0.211	C	C	.	.			trans	-127.9	176	170.8	77.5	0	0	0	0	111.9	I572 H573 E629 R630	I572-S627 VanDerWaalsContact CG2-OG 3.23Å; I572-S627 WeakPolarHBondContact CG2-OG 3.32Å; H573-S627 WeakPolarHBondContact O-CB 3.31Å; S627-E629 PolarHBondContact O-N 3.03Å; S627-E629 PolarHBondContact OG-N 3.36Å; S627-E629 VanDerWaalsContact OG-N 3.12Å; S627-R630 PolarHBondContact N-O 3.27Å; S627-R630 PolarHBondContact OG-N 2.95Å; S627-R630 PolarHBondContact OG-O 3.33Å
628	T	85.9	Confident	87.7	Confident	51 Å²	51	37 Å²	37	31%	0.313	22%	0.215	S	C	.	.	S	Bend	trans	-66.9	-15	170.6	49.8	0	0	0	0	113.3	L647 L762 A763	T628-L647 VanDerWaalsContact O-CD2 3.22Å; T628-L647 WeakPolarHBondContact O-CD2 3.44Å; T628-L762 HydrophobicContact CG2-CB 3.68Å; T628-L762 HydrophobicContact CG2-CD1 4.31Å; T628-A763 VanDerWaalsContact O-CB 3.25Å; T628-A763 WeakPolarHBondContact O-CB 3.45Å
629	E	85	Confident	87.7	Confident	103 Å²	103	38.2 Å²	38.2	48%	0.481	21%	0.209	S	C	.	.	S	Bend	trans	-104.5	-37.9	-178.3	-61.4	-174.7	167.7	0	0	113.5	S627 L647	S627-E629 PolarHBondContact O-N 3.03Å; S627-E629 PolarHBondContact OG-N 3.36Å; S627-E629 VanDerWaalsContact OG-N 3.12Å; E629-L647 WeakPolarHBondContact O-CB 3.18Å; E629-L647 PolarHBondContact O-N 2.84Å
630	R	89.6	Confident	87.8	Confident	4 Å²	4	40 Å²	40	2%	0.015	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	154.9	-166.6	-64.1	-173.6	178.6	-107.8	6.6	112.4	H564 E566 I572 S627 M632 D644 H645	H564-R630 PolarHBondContact CD2-NE 3.14Å; H564-R630 PolarHBondContact CE1-NH2 3.05Å; H564-R630 PolarHBondContact NE2-NE 2.89Å; H564-R630 VanDerWaalsContact NE2-NE 3.16Å; H564-R630 PolarHBondContact NE2-NH2 2.89Å; E566-R630 IonicContact OE1-CZ 2.72Å; E566-R630 IonicContact OE1-NH1 2.59Å; E566-R630 IonicContact OE1-NH2 3.93Å; E566-R630 PolarHBondContact OE1-NH2 2.79Å; E566-R630 IonicContact OE2-NH2 3.95Å; I572-R630 HydrophobicContact CD1-CG 4.33Å; S627-R630 PolarHBondContact N-O 3.27Å; S627-R630 PolarHBondContact OG-N 2.95Å; S627-R630 PolarHBondContact OG-O 3.33Å; R630-M632 HydrophobicContact CB-CG 4.17Å; R630-M632 HydrophobicContact CB-SD 4.33Å; R630-D644 IonicContact CZ-OD1 3.06Å; R630-D644 IonicContact CZ-OD2 2.76Å; R630-D644 IonicContact NH1-OD1 3.67Å; R630-D644 PolarHBondContact NH1-OD1 3.24Å; R630-D644 IonicContact NH1-OD2 3.68Å; R630-D644 PolarHBondContact NH1-OD2 2.95Å; R630-H645 CarbonylContact C-O 3.55Å; R630-H645 VanDerWaalsContact CA-O 3.27Å; R630-H645 WeakPolarHBondContact CA-O 3.43Å
631	I	92.1	Very high	87.7	Confident	2 Å²	2	39.8 Å²	39.8	1%	0.01	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	122.9	164.1	-63.7	171.4	0	0	0	106.9	L624 F625 H645 L647 V650 L662 V756	L624-I631 HydrophobicContact CD1-CG2 3.75Å; F625-I631 WeakPolarHBondContact O-CA 3.24Å; I631-H645 PolarHBondContact N-O 2.83Å; I631-H645 PolarHBondContact O-N 2.98Å; I631-L647 HydrophobicContact CD1-CD1 3.68Å; I631-L647 HydrophobicContact CG1-CD1 3.95Å; I631-V650 HydrophobicContact CD1-CG2 4.25Å; I631-L662 HydrophobicContact CD1-CD1 4.21Å; I631-L662 HydrophobicContact CG2-CD2 3.95Å; I631-V756 HydrophobicContact CD1-CB 4.49Å; I631-V756 HydrophobicContact CD1-CG1 3.54Å; I631-V756 HydrophobicContact CD1-CG2 4.04Å
632	M	92.1	Very high	87.6	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	138.3	-174.2	-59.3	166.5	67	0	0	109.4	V562 P565 I572 F625 R630 L634 I641 I643	V562-M632 HydrophobicContact CG1-CE 4.28Å; P565-M632 HydrophobicContact CG-CE 4.4Å; I572-M632 HydrophobicContact CD1-SD 4.4Å; F625-M632 HydrophobicContact CB-CB 4.31Å; F625-M632 HydrophobicContact CD1-CB 4.3Å; F625-M632 HydrophobicContact CD1-CG 4.37Å; F625-M632 HydrophobicContact CD1-SD 3.94Å; F625-M632 HydrophobicContact CE1-SD 4.32Å; F625-M632 PolarHBondContact N-O 3.34Å; F625-M632 PolarHBondContact O-N 3.14Å; R630-M632 HydrophobicContact CB-CG 4.17Å; R630-M632 HydrophobicContact CB-SD 4.33Å; M632-L634 HydrophobicContact CB-CD2 4.28Å; M632-L634 HydrophobicContact CE-CD2 4.18Å; M632-I641 HydrophobicContact CE-CB 4.39Å; M632-I641 HydrophobicContact CE-CD1 3.47Å; M632-I641 VanDerWaalsContact CE-CD1 3.47Å; M632-I641 HydrophobicContact CE-CG1 3.7Å; M632-I641 HydrophobicContact CE-CG2 3.76Å; M632-I643 CarbonylContact C-O 3.57Å; M632-I643 VanDerWaalsContact CA-O 3.27Å; M632-I643 WeakPolarHBondContact CA-O 3.39Å
633	I	93.2	Very high	87.4	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.01	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	117.7	170.7	-61	166.7	0	0	0	106.4	Y581 V622 L624 L642 I643 L744	Y581-I633 HydrophobicContact CD2-CD1 4.34Å; V622-I633 HydrophobicContact CB-CG2 3.65Å; V622-I633 HydrophobicContact CG1-CG2 3.85Å; V622-I633 HydrophobicContact CG2-CG2 3.75Å; L624-I633 HydrophobicContact CD1-CG1 3.72Å; I633-L642 HydrophobicContact CG2-CD1 4.43Å; I633-L642 WeakPolarHBondContact O-CA 3.45Å; I633-L642 WeakPolarHBondContact O-CB 3.5Å; I633-L642 PolarHBondContact O-N 2.91Å; I633-I643 HydrophobicContact CB-CB 4.09Å; I633-I643 HydrophobicContact CB-CD1 4.44Å; I633-I643 HydrophobicContact CD1-CB 4.19Å; I633-I643 HydrophobicContact CD1-CD1 3.63Å; I633-I643 HydrophobicContact CD1-CG1 4.48Å; I633-I643 HydrophobicContact CG1-CB 4.41Å; I633-I643 PolarHBondContact N-O 3.38Å; I633-I643 PolarHBondContact O-N 3.25Å; I633-L744 HydrophobicContact CD1-CD1 4.03Å; I633-L744 HydrophobicContact CD1-CD2 4.05Å; I633-L744 HydrophobicContact CG1-CD2 4.3Å
634	L	91.4	Very high	87.3	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	153.1	-175.7	-54.9	175.5	0	0	0	110.2	V562 L576 V622 E623 F625 M632 L638 D640 I641	V562-L634 HydrophobicContact CG1-CD1 4.2Å; V562-L634 HydrophobicContact CG2-CD1 4.12Å; L576-L634 HydrophobicContact CD1-CD1 4.19Å; V622-L634 WeakPolarHBondContact CA-O 3.34Å; V622-L634 WeakPolarHBondContact CB-O 3.48Å; E623-L634 HydrophobicContact CB-CB 4.39Å; E623-L634 PolarHBondContact N-O 3.45Å; E623-L634 WeakPolarHBondContact O-CB 3.43Å; E623-L634 PolarHBondContact O-N 3.06Å; F625-L634 HydrophobicContact CB-CD1 3.98Å; F625-L634 HydrophobicContact CB-CG 4.44Å; M632-L634 HydrophobicContact CB-CD2 4.28Å; M632-L634 HydrophobicContact CE-CD2 4.18Å; L634-L638 HydrophobicContact CB-CD2 4.15Å; L634-L638 HydrophobicContact CD1-CD2 3.69Å; L634-D640 WeakPolarHBondContact CA-O 3.4Å; L634-I641 HydrophobicContact CD2-CB 4.21Å; L634-I641 HydrophobicContact CD2-CG1 3.75Å; L634-I641 HydrophobicContact CD2-CG2 4.34Å
635	N	88.2	Confident	87.2	Confident	46 Å²	46	44.8 Å²	44.8	25%	0.246	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	158.6	166.3	-170.4	3.7	0	0	0	110.3	N637 L638 D640 L642	N635-N637 PolarHBondContact O-N 3.27Å; N635-L638 PolarHBondContact O-N 2.95Å; N635-D640 HydrophobicContact CB-CB 3.91Å; N635-D640 PolarHBondContact N-O 2.9Å; N635-D640 PolarHBondContact ND2-OD2 3.39Å; N635-L642 HydrophobicContact CB-CD1 4.49Å; N635-L642 HydrophobicContact CB-CG 4.49Å
636	S	80.9	Confident	86.9	Confident	47 Å²	47	47.2 Å²	47.2	33%	0.329	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-19.4	179.7	-68.2	0	0	0	0	114	T621	T621-S636 PolarHBondContact O-OG 2.85Å; T621-S636 PolarHBondContact OG1-OG 2.8Å
637	N	78.8	Confident	86.7	Confident	107 Å²	107	47.2 Å²	47.2	57%	0.572	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-9.1	176.8	-66.1	6.7	0	0	0	114.4	N635 E639	N635-N637 PolarHBondContact O-N 3.27Å; N637-E639 HydrophobicContact CB-CB 4.36Å; N637-E639 HydrophobicContact CB-CG 4.12Å; N637-E639 PolarHBondContact ND2-OE2 3.2Å; N637-E639 PolarHBondContact O-N 3.37Å
638	L	78	Confident	86.3	Confident	69 Å²	69	55.7 Å²	55.7	36%	0.361	28%	0.276	S	S	.	.	S	Bend	trans	62.8	7.3	-169.8	-50.6	176.5	0	0	0	115.8	L576 E623 L634 N635	L576-L638 HydrophobicContact CD1-CD2 3.79Å; L576-L638 HydrophobicContact CD2-CD1 4.1Å; L576-L638 HydrophobicContact CD2-CD2 3.84Å; L576-L638 HydrophobicContact CG-CD2 4.43Å; E623-L638 HydrophobicContact CB-CD2 3.66Å; E623-L638 HydrophobicContact CG-CD2 3.94Å; L634-L638 HydrophobicContact CB-CD2 4.15Å; L634-L638 HydrophobicContact CD1-CD2 3.69Å; N635-L638 PolarHBondContact O-N 2.95Å
639	E	74.4	Confident	86.2	Confident	146 Å²	146	54.6 Å²	54.6	68%	0.682	27%	0.269	S	S	*	.	S	Bend	trans	-84.4	-44.8	-179.3	-66.9	171.1	146.8	0	0	112.4	N637	N637-E639 HydrophobicContact CB-CB 4.36Å; N637-E639 HydrophobicContact CB-CG 4.12Å; N637-E639 PolarHBondContact ND2-OE2 3.2Å; N637-E639 PolarHBondContact O-N 3.37Å
640	D	83.4	Confident	86.3	Confident	86 Å²	86	50.1 Å²	50.1	46%	0.46	25%	0.249	S	C	.	.			trans	-98.6	132.2	-178.6	-50.7	-61	0	0	0	112.4	L634 N635	L634-D640 WeakPolarHBondContact CA-O 3.4Å; N635-D640 HydrophobicContact CB-CB 3.91Å; N635-D640 PolarHBondContact N-O 2.9Å; N635-D640 PolarHBondContact ND2-OD2 3.39Å
641	I	86	Confident	86.1	Confident	73 Å²	73	51.3 Å²	51.3	37%	0.374	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	106.6	171.8	-55.2	165.6	0	0	0	107.9	P565 M632 L634 D644	P565-I641 HydrophobicContact CB-CD1 3.92Å; M632-I641 HydrophobicContact CE-CB 4.39Å; M632-I641 HydrophobicContact CE-CD1 3.47Å; M632-I641 VanDerWaalsContact CE-CD1 3.47Å; M632-I641 HydrophobicContact CE-CG1 3.7Å; M632-I641 HydrophobicContact CE-CG2 3.76Å; L634-I641 HydrophobicContact CD2-CB 4.21Å; L634-I641 HydrophobicContact CD2-CG1 3.75Å; L634-I641 HydrophobicContact CD2-CG2 4.34Å; I641-D644 HydrophobicContact CG2-CB 4.02Å
642	L	87.5	Confident	85.9	Confident	88 Å²	88	53.1 Å²	53.1	46%	0.461	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	-43.3	-177.8	-56.6	175.2	0	0	0	111.3	V622 I633 N635	V622-L642 HydrophobicContact CG1-CD1 3.77Å; I633-L642 HydrophobicContact CG2-CD1 4.43Å; I633-L642 WeakPolarHBondContact O-CA 3.45Å; I633-L642 WeakPolarHBondContact O-CB 3.5Å; I633-L642 PolarHBondContact O-N 2.91Å; N635-L642 HydrophobicContact CB-CD1 4.49Å; N635-L642 HydrophobicContact CB-CG 4.49Å
643	I	89.9	Confident	85.9	Confident	29 Å²	29	54.3 Å²	54.3	15%	0.149	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	136.9	179.1	-61.7	158.4	0	0	0	108.4	Y581 M632 I633 H645 H742	Y581-I643 HydrophobicContact CD2-CD1 4.41Å; Y581-I643 HydrophobicContact CE2-CD1 3.63Å; M632-I643 CarbonylContact C-O 3.57Å; M632-I643 VanDerWaalsContact CA-O 3.27Å; M632-I643 WeakPolarHBondContact CA-O 3.39Å; I633-I643 HydrophobicContact CB-CB 4.09Å; I633-I643 HydrophobicContact CB-CD1 4.44Å; I633-I643 HydrophobicContact CD1-CB 4.19Å; I633-I643 HydrophobicContact CD1-CD1 3.63Å; I633-I643 HydrophobicContact CD1-CG1 4.48Å; I633-I643 HydrophobicContact CG1-CB 4.41Å; I633-I643 PolarHBondContact N-O 3.38Å; I633-I643 PolarHBondContact O-N 3.25Å; I643-H645 WeakPolarHBondContact CG2-NE2 3.46Å; I643-H742 WeakPolarHBondContact CD1-ND1 3.27Å
644	D	89.7	Confident	85.7	Confident	56 Å²	56	54.6 Å²	54.6	30%	0.299	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	122.5	178	167.2	36.7	0	0	0	109.6	P565 R630 I641	P565-D644 WeakPolarHBondContact CG-OD2 3.46Å; R630-D644 IonicContact CZ-OD1 3.06Å; R630-D644 IonicContact CZ-OD2 2.76Å; R630-D644 IonicContact NH1-OD1 3.67Å; R630-D644 PolarHBondContact NH1-OD1 3.24Å; R630-D644 IonicContact NH1-OD2 3.68Å; R630-D644 PolarHBondContact NH1-OD2 2.95Å; I641-D644 HydrophobicContact CG2-CB 4.02Å
645	H	89.2	Confident	85.7	Confident	21 Å²	21	55.4 Å²	55.4	10%	0.097	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	134.1	171.1	-71.1	-69.3	0	0	0	110.3	R630 I631 I643 V650 S664 H742	R630-H645 CarbonylContact C-O 3.55Å; R630-H645 VanDerWaalsContact CA-O 3.27Å; R630-H645 WeakPolarHBondContact CA-O 3.43Å; I631-H645 PolarHBondContact N-O 2.83Å; I631-H645 PolarHBondContact O-N 2.98Å; I643-H645 WeakPolarHBondContact CG2-NE2 3.46Å; H645-V650 HydrophobicContact CB-CG2 4.15Å; H645-S664 VanDerWaalsContact CE1-CB 3.46Å; H645-S664 WeakPolarHBondContact CE1-CB 3.43Å; H645-S664 PolarHBondContact CE1-OG 2.88Å; H645-S664 VanDerWaalsContact ND1-CB 3.34Å; H645-S664 WeakPolarHBondContact ND1-CB 3.32Å; H645-S664 PolarHBondContact ND1-OG 3.33Å; H645-H742 AromaticContact CD2-NE2 3.77Å; H645-H742 AromaticContact CE1-NE2 3.75Å; H645-H742 AromaticContact NE2-CD2 3.56Å; H645-H742 AromaticContact NE2-CE1 3.82Å; H645-H742 AromaticContact NE2-NE2 2.84Å; H645-H742 PolarHBondContact NE2-NE2 2.87Å
646	K	88	Confident	85.7	Confident	51 Å²	51	54.8 Å²	54.8	22%	0.222	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	137.1	168.1	-52.7	-168.8	-175.7	-161.3	0	107.8	E566 R648 T649	E566-K646 VanDerWaalsContact CD-NZ 3.3Å; E566-K646 WeakPolarHBondContact OE1-CE 3.48Å; E566-K646 IonicContact OE1-NZ 3.73Å; E566-K646 PolarHBondContact OE1-NZ 3.01Å; E566-K646 IonicContact OE2-NZ 3.39Å; E566-K646 PolarHBondContact OE2-NZ 3.2Å; K646-R648 HydrophobicContact CB-CG 4.08Å; K646-R648 PolarHBondContact O-N 2.84Å; K646-T649 HydrophobicContact CB-CG2 4.4Å; K646-T649 PolarHBondContact O-N 2.95Å; K646-T649 PolarHBondContact O-OG1 3.42Å
647	L	86.5	Confident	86.1	Confident	5 Å²	5	55.3 Å²	55.3	3%	0.026	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-53.7	-36.6	-173.4	-171.5	64.4	0	0	0	111.6	T628 E629 I631 T649 V650 V756 A759 F760 A763	T628-L647 VanDerWaalsContact O-CD2 3.22Å; T628-L647 WeakPolarHBondContact O-CD2 3.44Å; E629-L647 WeakPolarHBondContact O-CB 3.18Å; E629-L647 PolarHBondContact O-N 2.84Å; I631-L647 HydrophobicContact CD1-CD1 3.68Å; I631-L647 HydrophobicContact CG1-CD1 3.95Å; L647-T649 VanDerWaalsContact C-N 3.34Å; L647-T649 PolarHBondContact O-N 3.19Å; L647-V650 WeakPolarHBondContact O-CB 3.48Å; L647-V650 PolarHBondContact O-N 2.96Å; L647-V756 HydrophobicContact CD1-CG1 4.46Å; L647-A759 HydrophobicContact CD2-CB 4.33Å; L647-F760 HydrophobicContact CD1-CD1 4.02Å; L647-F760 HydrophobicContact CD1-CD2 4.26Å; L647-F760 HydrophobicContact CD1-CE1 3.72Å; L647-F760 HydrophobicContact CD1-CE2 3.96Å; L647-F760 HydrophobicContact CD1-CG 4.28Å; L647-F760 HydrophobicContact CD1-CZ 3.68Å; L647-F760 HydrophobicContact CD2-CD1 4.03Å; L647-F760 HydrophobicContact CD2-CE1 4.42Å; L647-F760 HydrophobicContact CD2-CG 4.35Å; L647-F760 HydrophobicContact CG-CD1 3.71Å; L647-F760 HydrophobicContact CG-CE1 3.6Å; L647-F760 HydrophobicContact CG-CG 4.32Å; L647-F760 HydrophobicContact CG-CZ 4.11Å; L647-F760 VanDerWaalsContact O-CE1 3.3Å; L647-F760 WeakPolarHBondContact O-CE1 3.37Å; L647-A763 HydrophobicContact CD2-CB 3.88Å
648	R	81.9	Confident	86.6	Confident	182 Å²	182	54.7 Å²	54.7	69%	0.687	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-62.3	-21.7	173.7	65.7	177.9	-179.2	-108.8	11.6	117.1	K646 R665	K646-R648 HydrophobicContact CB-CG 4.08Å; K646-R648 PolarHBondContact O-N 2.84Å; R648-R665 PolarHBondContact O-NH2 3.44Å
649	T	84.7	Confident	87.3	Confident	28 Å²	28	52.5 Å²	52.5	17%	0.172	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-84.9	-26.1	178.1	62.9	0	0	0	0	112	K646 L647 S664 R665	K646-T649 HydrophobicContact CB-CG2 4.4Å; K646-T649 PolarHBondContact O-N 2.95Å; K646-T649 PolarHBondContact O-OG1 3.42Å; L647-T649 VanDerWaalsContact C-N 3.34Å; L647-T649 PolarHBondContact O-N 3.19Å; T649-S664 PolarHBondContact OG1-OG 2.91Å; T649-S664 VanDerWaalsContact OG1-OG 3.05Å; T649-R665 WeakPolarHBondContact O-CB 3.46Å; T649-R665 PolarHBondContact O-N 3.01Å; T649-R665 PolarHBondContact O-NE 2.9Å
650	V	86.7	Confident	88.3	Confident	10 Å²	10	45.6 Å²	45.6	6%	0.061	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	142.7	173	180	0	0	0	0	109.6	I631 H645 L647 I653 L662 F760	I631-V650 HydrophobicContact CD1-CG2 4.25Å; H645-V650 HydrophobicContact CB-CG2 4.15Å; L647-V650 WeakPolarHBondContact O-CB 3.48Å; L647-V650 PolarHBondContact O-N 2.96Å; V650-I653 HydrophobicContact CG1-CG2 4.01Å; V650-L662 HydrophobicContact CB-CD1 4.35Å; V650-L662 HydrophobicContact CG1-CD1 3.47Å; V650-L662 VanDerWaalsContact CG1-CD1 3.47Å; V650-L662 HydrophobicContact CG2-CD1 3.89Å; V650-F760 HydrophobicContact CB-CZ 3.91Å; V650-F760 HydrophobicContact CG1-CE2 4.4Å; V650-F760 HydrophobicContact CG1-CZ 3.83Å
651	S	85	Confident	88.7	Confident	29 Å²	29	41.5 Å²	41.5	20%	0.203	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	-23.5	-162.3	-127.8	0	0	0	0	112.7	R598 M663 R665 M739	R598-S651 PolarHBondContact NH1-O 2.94Å; R598-S651 PolarHBondContact NH1-OG 2.99Å; S651-M663 PolarHBondContact N-O 3.27Å; S651-R665 PolarHBondContact OG-NE 3.05Å; S651-M739 VanDerWaalsContact CB-CE 3.48Å
652	Y	88.2	Confident	89.1	Confident	40 Å²	40	38 Å²	38	16%	0.157	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	145.4	168.7	-174.6	-106.4	0	0	0	109.3	R598 A602 A654 M663	R598-Y652 HydrophobicContact CB-CD1 4.47Å; R598-Y652 HydrophobicContact CB-CD2 3.99Å; R598-Y652 HydrophobicContact CB-CE2 4.32Å; R598-Y652 HydrophobicContact CB-CG 4.07Å; A602-Y652 HydrophobicContact CB-CD1 4.26Å; A602-Y652 HydrophobicContact CB-CE1 3.86Å; Y652-A654 HydrophobicContact CD1-CB 4.4Å; Y652-A654 HydrophobicContact CE1-CB 3.58Å; Y652-M663 HydrophobicContact CD1-CE 3.58Å; Y652-M663 HydrophobicContact CD1-CG 4.33Å; Y652-M663 HydrophobicContact CE1-CE 4.44Å; Y652-M663 HydrophobicContact CG-CE 3.84Å; Y652-M663 PolarHBondContact N-O 3.39Å; Y652-M663 PolarHBondContact O-N 2.84Å
653	I	91.5	Very high	89.2	Confident	25 Å²	25	33.9 Å²	33.9	13%	0.128	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	146.5	168.9	59.2	177.1	0	0	0	108	V650 F660 V661 L662 V756 F760	V650-I653 HydrophobicContact CG1-CG2 4.01Å; I653-F660 HydrophobicContact CB-CE2 4.15Å; I653-F660 HydrophobicContact CB-CZ 4.34Å; I653-F660 HydrophobicContact CG2-CE2 4.38Å; I653-F660 HydrophobicContact CG2-CZ 4.06Å; I653-V661 WeakPolarHBondContact CA-O 3.47Å; I653-L662 HydrophobicContact CG2-CD1 3.8Å; I653-V756 HydrophobicContact CD1-CB 3.98Å; I653-V756 HydrophobicContact CD1-CG1 3.76Å; I653-V756 HydrophobicContact CG2-CG1 4.2Å; I653-F760 HydrophobicContact CD1-CE2 4.5Å
654	A	89.5	Confident	89.1	Confident	8 Å²	8	32.5 Å²	32.5	7%	0.066	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	141.8	170.8	0	0	0	0	0	111.2	Y652 I656 V661	Y652-A654 HydrophobicContact CD1-CB 4.4Å; Y652-A654 HydrophobicContact CE1-CB 3.58Å; A654-I656 HydrophobicContact CB-CG1 4.37Å; A654-V661 PolarHBondContact N-O 3.38Å; A654-V661 VanDerWaalsContact N-O 3.11Å; A654-V661 PolarHBondContact O-N 3.3Å
655	D	91.9	Very high	88.8	Confident	17 Å²	17	34.6 Å²	34.6	9%	0.091	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	131.5	157.4	54.3	-61	0	0	0	110.1	L659 A753	D655-L659 CarbonylContact C-O 3.11Å; D655-L659 WeakPolarHBondContact CA-O 3.46Å; D655-A753 HydrophobicContact CB-CB 4.33Å
656	I	89	Confident	87.8	Confident	34 Å²	34	39.6 Å²	39.6	17%	0.174	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	80.7	177.9	-56.2	-179.5	0	0	0	106.7	V606 A654 D658 L659 V661	V606-I656 HydrophobicContact CG2-CD1 4.21Å; A654-I656 HydrophobicContact CB-CG1 4.37Å; I656-D658 PolarHBondContact O-N 2.85Å; I656-L659 PolarHBondContact N-O 2.94Å; I656-L659 WeakPolarHBondContact O-CB 3.49Å; I656-L659 PolarHBondContact O-N 2.79Å; I656-V661 HydrophobicContact CD1-CG2 4.05Å
657	G	88.1	Confident	86.3	Confident	58 Å²	58	42.4 Å²	42.4	60%	0.598	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.4	-128.7	-167.9	0	0	0	0	0	110.7	L659	G657-L659 PolarHBondContact O-N 2.8Å
658	D	90.7	Very high	84.4	Confident	94 Å²	94	44.3 Å²	44.3	50%	0.503	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	10.6	175.6	-56.4	-61.5	0	0	0	113	I656 E745 S746	I656-D658 PolarHBondContact O-N 2.85Å; D658-E745 CarbonylContact O-C 3.58Å; D658-E745 WeakPolarHBondContact O-CA 3.23Å; D658-S746 CarbonylContact C-O 3.58Å; D658-S746 CarbonylContact O-C 3.54Å; D658-S746 PolarHBondContact O-N 3.46Å
659	L	92.5	Very high	82.4	Confident	23 Å²	23	39.7 Å²	39.7	12%	0.12	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	132	177.3	-55.4	-177	0	0	0	111.7	M582 V606 D655 I656 G657 L744 E745	M582-L659 HydrophobicContact SD-CD2 3.48Å; M582-L659 WeakPolarHBondContact SD-CD2 3.48Å; V606-L659 HydrophobicContact CG1-CD1 3.59Å; V606-L659 HydrophobicContact CG2-CD1 4.32Å; D655-L659 CarbonylContact C-O 3.11Å; D655-L659 WeakPolarHBondContact CA-O 3.46Å; I656-L659 PolarHBondContact N-O 2.94Å; I656-L659 WeakPolarHBondContact O-CB 3.49Å; I656-L659 PolarHBondContact O-N 2.79Å; G657-L659 PolarHBondContact O-N 2.8Å; L659-L744 CarbonylContact C-O 3.54Å; L659-L744 WeakPolarHBondContact CA-O 3.16Å; L659-E745 HydrophobicContact CD2-CB 3.8Å; L659-E745 HydrophobicContact CD2-CG 4.16Å
660	F	93.8	Very high	80.1	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	121.8	169.2	177.5	-104.6	0	0	0	110	L624 I653 L662 L744 A749 I752 A753 V756	L624-F660 HydrophobicContact CD2-CD1 4.31Å; L624-F660 HydrophobicContact CD2-CE1 4.19Å; I653-F660 HydrophobicContact CB-CE2 4.15Å; I653-F660 HydrophobicContact CB-CZ 4.34Å; I653-F660 HydrophobicContact CG2-CE2 4.38Å; I653-F660 HydrophobicContact CG2-CZ 4.06Å; F660-L662 HydrophobicContact CE1-CB 3.97Å; F660-L744 HydrophobicContact CD1-CD1 4.11Å; F660-L744 PolarHBondContact N-O 3.44Å; F660-L744 PolarHBondContact O-N 2.92Å; F660-A749 HydrophobicContact CB-CB 4.05Å; F660-I752 HydrophobicContact CD1-CG2 3.98Å; F660-I752 HydrophobicContact CD2-CB 4.38Å; F660-I752 HydrophobicContact CD2-CG2 3.8Å; F660-I752 HydrophobicContact CE1-CG2 3.96Å; F660-I752 HydrophobicContact CE2-CG2 3.79Å; F660-I752 HydrophobicContact CG-CG2 3.9Å; F660-I752 HydrophobicContact CZ-CG2 3.86Å; F660-A753 HydrophobicContact CD2-CB 4.2Å; F660-A753 HydrophobicContact CE2-CB 4.09Å; F660-V756 HydrophobicContact CZ-CG2 4.2Å
661	V	93.4	Very high	77.8	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	121.8	-179.9	-172.5	0	0	0	0	110.2	A602 V606 I653 A654 I656 M663 H742 V743	A602-V661 HydrophobicContact CB-CG1 4.08Å; V606-V661 HydrophobicContact CG2-CG2 3.55Å; I653-V661 WeakPolarHBondContact CA-O 3.47Å; A654-V661 PolarHBondContact N-O 3.38Å; A654-V661 VanDerWaalsContact N-O 3.11Å; A654-V661 PolarHBondContact O-N 3.3Å; I656-V661 HydrophobicContact CD1-CG2 4.05Å; V661-M663 HydrophobicContact CG1-CG 4.3Å; V661-H742 WeakPolarHBondContact CA-O 3.34Å; V661-V743 HydrophobicContact CG1-CG2 4.47Å; V661-V743 HydrophobicContact CG2-CG2 4.37Å
662	L	93.4	Very high	75.3	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	113.6	178.9	176.3	68.1	0	0	0	110.3	I631 V650 I653 F660 C741 H742	I631-L662 HydrophobicContact CD1-CD1 4.21Å; I631-L662 HydrophobicContact CG2-CD2 3.95Å; V650-L662 HydrophobicContact CB-CD1 4.35Å; V650-L662 HydrophobicContact CG1-CD1 3.47Å; V650-L662 VanDerWaalsContact CG1-CD1 3.47Å; V650-L662 HydrophobicContact CG2-CD1 3.89Å; I653-L662 HydrophobicContact CG2-CD1 3.8Å; F660-L662 HydrophobicContact CE1-CB 3.97Å; L662-C741 CarbonylContact O-C 3.6Å; L662-C741 WeakPolarHBondContact O-CA 3.4Å; L662-H742 HydrophobicContact CB-CB 4.32Å; L662-H742 PolarHBondContact N-O 2.9Å; L662-H742 PolarHBondContact O-N 3.02Å
663	M	90.2	Very high	72.6	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.005	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	118.9	175.7	-49.1	-151.6	-69.5	0	0	111.1	I587 R598 Q601 A602 S651 Y652 V661 M739 I740 C741	I587-M663 HydrophobicContact CD1-SD 3.85Å; R598-M663 HydrophobicContact CB-CE 3.72Å; R598-M663 HydrophobicContact CG-CE 4.17Å; R598-M663 VanDerWaalsContact O-CE 3.26Å; R598-M663 WeakPolarHBondContact O-CE 3.41Å; Q601-M663 HydrophobicContact CB-CE 4.36Å; A602-M663 HydrophobicContact CB-CE 4.49Å; A602-M663 HydrophobicContact CB-SD 4.29Å; S651-M663 PolarHBondContact N-O 3.27Å; Y652-M663 HydrophobicContact CD1-CE 3.58Å; Y652-M663 HydrophobicContact CD1-CG 4.33Å; Y652-M663 HydrophobicContact CE1-CE 4.44Å; Y652-M663 HydrophobicContact CG-CE 3.84Å; Y652-M663 PolarHBondContact N-O 3.39Å; Y652-M663 PolarHBondContact O-N 2.84Å; V661-M663 HydrophobicContact CG1-CG 4.3Å; M663-M739 HydrophobicContact CB-CE 3.97Å; M663-I740 WeakPolarHBondContact CA-O 3.24Å; M663-C741 HydrophobicContact CG-CB 4.17Å; M663-C741 VanDerWaalsContact CG-SG 3.52Å; M663-C741 HydrophobicContact SD-CB 4.44Å; M663-C741 PolarHBondContact SD-SG 2.94Å
664	S	87.9	Confident	69.8	Low	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	145.9	-177.5	-172.7	0	0	0	0	112.6	H645 T649 M739 I740	H645-S664 VanDerWaalsContact CE1-CB 3.46Å; H645-S664 WeakPolarHBondContact CE1-CB 3.43Å; H645-S664 PolarHBondContact CE1-OG 2.88Å; H645-S664 VanDerWaalsContact ND1-CB 3.34Å; H645-S664 WeakPolarHBondContact ND1-CB 3.32Å; H645-S664 PolarHBondContact ND1-OG 3.33Å; T649-S664 PolarHBondContact OG1-OG 2.91Å; T649-S664 VanDerWaalsContact OG1-OG 3.05Å; S664-M739 WeakPolarHBondContact O-CE 3.16Å; S664-I740 PolarHBondContact N-O 2.83Å; S664-I740 PolarHBondContact O-N 3.29Å
665	R	82	Confident	67.2	Low	100 Å²	100	61.3 Å²	61.3	38%	0.377	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	116.4	177.2	-74	176	-67.8	-174.3	1.3	109.8	R648 T649 S651 M737 M739	R648-R665 PolarHBondContact O-NH2 3.44Å; T649-R665 WeakPolarHBondContact O-CB 3.46Å; T649-R665 PolarHBondContact O-N 3.01Å; T649-R665 PolarHBondContact O-NE 2.9Å; S651-R665 PolarHBondContact OG-NE 3.05Å; R665-M737 HydrophobicContact CB-CE 3.83Å; R665-M737 HydrophobicContact CG-CE 3.81Å; R665-M737 HydrophobicContact CG-SD 4.26Å; R665-M739 HydrophobicContact CB-SD 4.23Å; R665-M739 HydrophobicContact CG-CE 4.03Å; R665-M739 HydrophobicContact CG-SD 3.43Å; R665-M739 WeakPolarHBondContact CG-SD 3.5Å
666	R	68.5	Low	64.3	Low	125 Å²	125	65.5 Å²	65.5	47%	0.472	37%	0.365	S	S	.	.			trans	-91	120.5	173.9	-157.5	174.5	-168.8	165.1	4.1	109.6	I740	R666-I740 HydrophobicContact CB-CG2 4.44Å
667	L	56	Low	61.6	Low	110 Å²	110	72.7 Å²	72.7	58%	0.576	40%	0.398	S	S	*	.			trans	-81.7	114.4	160.5	-75.2	84.3	0	0	0	106.7	P669	L667-P669 WeakPolarHBondContact O-CD 3.34Å
668	D	48.3	Very low	59	Low	45 Å²	45	74.7 Å²	74.7	24%	0.241	40%	0.395	C	S	.	.			trans	-63.5	121.9	172.2	-77.6	-23.1	0	0	0	108.6	S670 T671 K738	D668-S670 VanDerWaalsContact C-N 3.34Å; D668-T671 PolarHBondContact O-OG1 2.91Å; D668-K738 IonicContact OD1-NZ 2.64Å; D668-K738 IonicContact OD2-NZ 2.64Å; D668-K738 PolarHBondContact OD2-NZ 2.91Å
669	P	40.2	Very low	56.2	Low	86 Å²	86	74.1 Å²	74.1	56%	0.558	39%	0.386	S	S	*	.			trans	-84	-8.3	179.7	32.8	-34.2	0	0	0	113.1	L667 T671 Q672	L667-P669 WeakPolarHBondContact O-CD 3.34Å; P669-T671 PolarHBondContact O-N 2.93Å; P669-Q672 PolarHBondContact O-N 3.25Å; P669-Q672 VanDerWaalsContact O-N 3.16Å
670	S	35.6	Very low	53.3	Low	104 Å²	104	82.6 Å²	82.6	73%	0.727	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	23.3	-173.5	64.6	0	0	0	0	114.9	D668	D668-S670 VanDerWaalsContact C-N 3.34Å
671	T	37.3	Very low	50.6	Low	21 Å²	21	85.7 Å²	85.7	13%	0.129	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.3	-9.2	176.9	31.9	0	0	0	0	111.6	D668 P669 S673 E674 E675 Y679	D668-T671 PolarHBondContact O-OG1 2.91Å; P669-T671 PolarHBondContact O-N 2.93Å; T671-S673 PolarHBondContact O-N 3.49Å; T671-S673 VanDerWaalsContact O-N 3.12Å; T671-E674 PolarHBondContact O-N 3.39Å; T671-E675 WeakPolarHBondContact CB-OE2 3.27Å; T671-E675 HydrophobicContact CG2-CG 4.16Å; T671-E675 WeakPolarHBondContact CG2-OE1 3.43Å; T671-E675 WeakPolarHBondContact CG2-OE2 3.41Å; T671-E675 VanDerWaalsContact O-CB 3.29Å; T671-E675 WeakPolarHBondContact O-CB 3.4Å; T671-E675 PolarHBondContact O-N 3.1Å; T671-Y679 PolarHBondContact OG1-OH 3.03Å
672	Q	33.8	Very low	47.8	Very low	118 Å²	118	88.5 Å²	88.5	55%	0.551	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	4	-171	-63.9	-177	-1.9	0	0	115.4	P669	P669-Q672 PolarHBondContact O-N 3.25Å; P669-Q672 VanDerWaalsContact O-N 3.16Å
673	S	32	Very low	44.9	Very low	111 Å²	111	93.5 Å²	93.5	78%	0.776	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-10.5	171.6	57.2	0	0	0	0	114.6	T671	T671-S673 PolarHBondContact O-N 3.49Å; T671-S673 VanDerWaalsContact O-N 3.12Å
674	E	32.4	Very low	42.3	Very low	178 Å²	178	103.6 Å²	103.6	83%	0.832	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.2	-12.8	174.5	-66.6	-173.1	168.1	0	0	113.7	T671	T671-E674 PolarHBondContact O-N 3.39Å
675	E	35	Very low	39.9	Very low	62 Å²	62	109.9 Å²	109.9	29%	0.29	56%	0.56	S	S	.	*			trans	-104.3	17.5	-178.6	-58.4	-173	176.6	0	0	114.5	T671 E677 N678 Y679	T671-E675 WeakPolarHBondContact CB-OE2 3.27Å; T671-E675 HydrophobicContact CG2-CG 4.16Å; T671-E675 WeakPolarHBondContact CG2-OE1 3.43Å; T671-E675 WeakPolarHBondContact CG2-OE2 3.41Å; T671-E675 VanDerWaalsContact O-CB 3.29Å; T671-E675 WeakPolarHBondContact O-CB 3.4Å; T671-E675 PolarHBondContact O-N 3.1Å; E675-E677 PolarHBondContact O-N 3.06Å; E675-N678 HydrophobicContact CB-CB 4.4Å; E675-N678 PolarHBondContact O-N 2.96Å; E675-Y679 HydrophobicContact CB-CD2 3.84Å; E675-Y679 HydrophobicContact CB-CE2 3.83Å; E675-Y679 PolarHBondContact O-N 2.8Å; E675-Y679 WeakPolarHBondContact OE2-CE2 3.3Å
676	S	30.3	Very low	37.5	Very low	104 Å²	104	107.1 Å²	107.1	73%	0.727	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	-7.3	180	39.1	0	0	0	0	115.2
677	E	32.7	Very low	35.8	Very low	186 Å²	186	105.5 Å²	105.5	87%	0.869	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.1	-2.4	168.3	-63	-166.6	155.2	0	0	114.2	E675	E675-E677 PolarHBondContact O-N 3.06Å
678	N	33.7	Very low	34.7	Very low	100 Å²	100	108.7 Å²	108.7	54%	0.535	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	-114.8	0.7	-173.8	-84.4	-40.7	0	0	0	115.6	E675 T681	E675-N678 HydrophobicContact CB-CB 4.4Å; E675-N678 PolarHBondContact O-N 2.96Å; N678-T681 PolarHBondContact O-OG1 3.14Å
679	Y	31.9	Very low	34	Very low	81 Å²	81	113.3 Å²	113.3	32%	0.318	59%	0.59	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.3	-10.7	-178.3	-102.5	-88.3	0	0	0	115.8	T671 E675	T671-Y679 PolarHBondContact OG1-OH 3.03Å; E675-Y679 HydrophobicContact CB-CD2 3.84Å; E675-Y679 HydrophobicContact CB-CE2 3.83Å; E675-Y679 PolarHBondContact O-N 2.8Å; E675-Y679 WeakPolarHBondContact OE2-CE2 3.3Å
680	F	31.7	Very low	33.5	Very low	202 Å²	202	118.7 Å²	118.7	89%	0.886	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	-16.2	177	-97.6	-86.3	0	0	0	114.4
681	T	36.9	Very low	33.1	Very low	64 Å²	64	122.7 Å²	122.7	39%	0.393	61%	0.611	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.7	-16.3	-172.1	34.7	0	0	0	0	114.9	N678	N678-T681 PolarHBondContact O-OG1 3.14Å
682	S	33.6	Very low	32.9	Very low	59 Å²	59	129.6 Å²	129.6	41%	0.413	65%	0.646	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.6	-1.3	-170.9	60.2	0	0	0	0	116.2	K591	K591-S682 PolarHBondContact NZ-O 3.06Å
683	N	32.4	Very low	32.5	Very low	106 Å²	106	129.4 Å²	129.4	57%	0.567	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.3	-16	-172.8	-91.1	-33.1	0	0	0	117.9	K591	K591-N683 PolarHBondContact NZ-OD1 3.46Å
684	Y	35.3	Very low	32.4	Very low	214 Å²	214	129.4 Å²	129.4	84%	0.839	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	-31.9	172.2	-77.4	-85.9	0	0	0	113.4	N686	Y684-N686 VanDerWaalsContact C-N 3.26Å; Y684-N686 PolarHBondContact O-N 3.08Å
685	L	38.2	Very low	32.5	Very low	132 Å²	132	128.2 Å²	128.2	69%	0.691	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	25.9	-168.7	-113.5	159.9	0	0	0	116.7
686	N	31.7	Very low	32.3	Very low	42 Å²	42	132 Å²	132	23%	0.225	67%	0.669	C	S	.	*	T	Hydrogen-bonded Turn	trans	-133.6	3.8	-173	-86.5	-58.4	0	0	0	116.4	K591 Y684	K591-N686 HydrophobicContact CD-CB 3.67Å; Y684-N686 VanDerWaalsContact C-N 3.26Å; Y684-N686 PolarHBondContact O-N 3.08Å
687	N	32.2	Very low	32.5	Very low	90 Å²	90	130.7 Å²	130.7	48%	0.481	67%	0.665	S	S	.	*	S	Bend	trans	-109.4	-6.8	-177.6	-78.2	5	0	0	0	115.6
688	E	34.4	Very low	32.7	Very low	177 Å²	177	128.4 Å²	128.4	83%	0.827	66%	0.658	S	S	*	*	S	Bend	trans	-109.8	15.8	-174.5	-91	-166.8	104.9	0	0	116.3
689	L	32.3	Very low	33	Very low	143 Å²	143	128.8 Å²	128.8	75%	0.749	66%	0.661	S	S	*	*			trans	-125.2	74.4	172.7	-74.2	175.4	0	0	0	111.4	K734	L689-K734 PolarHBondContact O-NZ 3.19Å
690	K	30.4	Very low	33.5	Very low	198 Å²	198	130.4 Å²	130.4	86%	0.861	68%	0.675	S	S	*	*			trans	-164.3	39.1	157.3	-123.2	-177.6	-177.9	-169.7	0	118.7
691	E	27.5	Very low	33.9	Very low	189 Å²	189	125.5 Å²	125.5	88%	0.883	66%	0.658	S	S	*	*			trans	-150.4	120.3	157.7	-100.6	168.5	-151.8	0	0	103.8
692	I	32.1	Very low	34	Very low	165 Å²	165	127.7 Å²	127.7	85%	0.846	67%	0.667	S	S	*	*	S	Bend	cis	-147.9	126.9	42.1	-69.2	145	0	0	0	108.9
693	S	26.5	Very low	34.2	Very low	114 Å²	114	130.2 Å²	130.2	80%	0.797	68%	0.68	S	S	*	*			trans	179	93.4	153.1	34.1	0	0	0	0	113.7
694	T	28.9	Very low	34.2	Very low	112 Å²	112	132.1 Å²	132.1	69%	0.687	69%	0.691	S	S	*	*			trans	-174.4	123.3	158.3	23.7	0	0	0	0	103.8
695	H	33.7	Very low	34.1	Very low	153 Å²	153	127.1 Å²	127.1	71%	0.708	69%	0.687	S	S	*	*				-154.5	137.4	50.7	-78.6	-69.2	0	0	0	109.5
696	N	31.9	Very low	34	Very low	140 Å²	140	125.6 Å²	125.6	75%	0.749	69%	0.687	S	S	*	*				66.5	136.6	86.8	-56.4	-6.4	0	0	0	113.4
697	A	34.5	Very low	34.1	Very low	77 Å²	77	131.1 Å²	131.1	64%	0.636	72%	0.716	S	S	*	*			cis	-164.7	179.2	0.3	0	0	0	0	0	112.1
698	D	37.6	Very low	34.2	Very low	138 Å²	138	131.6 Å²	131.6	74%	0.738	72%	0.724	S	S	*	*			trans	73.4	147.9	152	-64.7	-39.4	0	0	0	121.4
699	N	40.2	Very low	34	Very low	108 Å²	108	130.8 Å²	130.8	58%	0.578	72%	0.72	S	S	*	*			cis	-170.3	154.9	-36.1	-130.1	-41.1	0	0	0	112.8
700	N	40.9	Very low	34	Very low	115 Å²	115	131.7 Å²	131.7	62%	0.615	72%	0.72	S	S	*	*			trans	81	109.3	151.2	-69.4	-41	0	0	0	125.3
701	N	40.5	Very low	33.9	Very low	100 Å²	100	129.8 Å²	129.8	54%	0.535	72%	0.715	S	S	.	*				96.2	114.9	113.4	-66.1	-18.3	0	0	0	125.6	R235	R235-N701 PolarHBondContact NH2-O 2.89Å
702	N	38.2	Very low	34.1	Very low	109 Å²	109	128.7 Å²	128.7	58%	0.583	71%	0.709	S	S	*	*				82.8	155.1	122.4	-67.8	-12.8	0	0	0	125.5	R235	R235-N702 VanDerWaalsContact NH2-N 3.12Å
703	T	37.9	Very low	34.1	Very low	113 Å²	113	126.1 Å²	126.1	69%	0.693	71%	0.706	S	S	*	*			trans	73.5	144.3	169.1	72.3	0	0	0	0	118.2
704	N	32.8	Very low	34.2	Very low	146 Å²	146	125.3 Å²	125.3	78%	0.781	71%	0.706	S	S	*	*			cis	-169.5	173.9	-32.7	-107.5	-11	0	0	0	109.2
705	S	34.5	Very low	34.4	Very low	108 Å²	108	127 Å²	127	76%	0.755	72%	0.716	S	S	*	*			trans	77	110	167.4	81.5	0	0	0	0	115.3
706	S	34.6	Very low	34.4	Very low	100 Å²	100	125.1 Å²	125.1	70%	0.699	72%	0.717	S	S	*	*				92.9	137.8	71.5	71.5	0	0	0	0	111.3
707	L	34.2	Very low	34.5	Very low	159 Å²	159	127 Å²	127	83%	0.832	73%	0.726	S	S	*	*			cis	-146.3	178.3	28	-103.2	113.8	0	0	0	111.2
708	P	34.7	Very low	34.1	Very low	100 Å²	100	130.6 Å²	130.6	65%	0.649	74%	0.735	S	S	*	*			trans	-129.2	-147.2	-145.3	36.2	-14.3	0	0	0	115.2
709	E	29.9	Very low	33.9	Very low	159 Å²	159	129.7 Å²	129.7	74%	0.743	74%	0.739	S	S	*	*			trans	80.7	138.2	164.1	-68.1	177.7	132.2	0	0	117.8
710	Q	32.1	Very low	33.5	Very low	162 Å²	162	131.9 Å²	131.9	76%	0.757	75%	0.751	S	S	*	*			cis	-136.4	152.3	-3.3	-89.3	135.4	15	0	0	108.8
711	Q	28.5	Very low	33.3	Very low	159 Å²	159	134.3 Å²	134.3	74%	0.743	76%	0.762	S	S	*	*			cis	96.7	135.2	30.3	-104.5	-171.7	35.6	0	0	117.2
712	H	32.7	Very low	32.9	Very low	166 Å²	166	134.9 Å²	134.9	77%	0.769	77%	0.771	S	S	*	*			trans	84.9	142.7	166	-53.5	174.5	0	0	0	116.9
713	S	30.9	Very low	32.3	Very low	111 Å²	111	137.7 Å²	137.7	78%	0.776	79%	0.786	S	S	*	*			cis	-159	136.6	-2.3	44.6	0	0	0	0	108.4
714	A	29.9	Very low	32.2	Very low	96 Å²	96	136.6 Å²	136.6	79%	0.793	78%	0.779	S	S	*	*			cis	90.6	103.8	36.5	0	0	0	0	0	115.5
715	V	32.6	Very low	32.2	Very low	149 Å²	149	132.6 Å²	132.6	90%	0.903	76%	0.76	S	S	*	*			trans	-146.2	115.1	150.4	-176.5	0	0	0	0	108.7
716	P	32.8	Very low	32.2	Very low	113 Å²	113	136.3 Å²	136.3	73%	0.734	76%	0.763	S	S	*	*			trans	-113.5	164.2	178.4	39.3	-31	0	0	0	113.5
717	L	34.6	Very low	32.2	Very low	179 Å²	179	135 Å²	135	94%	0.937	75%	0.753	S	S	*	*			trans	-142	128.8	161.8	-100.7	164.7	0	0	0	110.4
718	N	26.3	Very low	32.4	Very low	153 Å²	153	129 Å²	129	82%	0.818	73%	0.727	S	S	*	*			trans	-88.7	145.3	-177.8	-93.4	-17.6	0	0	0	112.3
719	S	33.4	Very low	32.4	Very low	119 Å²	119	132 Å²	132	83%	0.832	73%	0.734	S	S	*	*			trans	-159.5	132.8	137.7	53.5	0	0	0	0	112.5
720	N	30.7	Very low	32.8	Very low	154 Å²	154	131.2 Å²	131.2	82%	0.824	73%	0.734	S	S	*	*			trans	-72.5	139.8	-171.7	-51.6	-50.8	0	0	0	113.7
721	I	36.9	Very low	33.2	Very low	165 Å²	165	131.4 Å²	131.4	85%	0.846	74%	0.735	S	S	*	*			trans	-137.9	142.2	152.2	-63.4	-173.9	0	0	0	107.1
722	P	32.1	Very low	33.6	Very low	112 Å²	112	132.7 Å²	132.7	73%	0.727	74%	0.738	S	S	*	*			trans	-75.6	156.2	-156.2	-17	31.7	0	0	0	116	V724	P722-V724 PolarHBondContact O-N 3.04Å
723	N	27.2	Very low	34	Very low	168 Å²	168	132 Å²	132	90%	0.898	74%	0.739	S	S	*	*			trans	-62.4	101.8	165	-79	-28.5	0	0	0	110.6
724	V	34.9	Very low	34.6	Very low	90 Å²	90	132.2 Å²	132.2	55%	0.545	73%	0.726	S	S	.	*			trans	-94.5	117.5	153	-179.5	0	0	0	0	107.2	P722 A728	P722-V724 PolarHBondContact O-N 3.04Å; V724-A728 HydrophobicContact CG1-CB 4.1Å
725	T	33	Very low	35.6	Very low	62 Å²	62	134.9 Å²	134.9	38%	0.38	72%	0.72	S	S	.	*			trans	-55.4	136.8	-169.4	-40.3	0	0	0	0	111.9	N383 S727 A728	N383-T725 VanDerWaalsContact CB-OG1 3.31Å; N383-T725 WeakPolarHBondContact CB-OG1 3.22Å; N383-T725 PolarHBondContact ND2-OG1 3.21Å; T725-S727 PolarHBondContact O-N 3.48Å; T725-A728 PolarHBondContact O-N 2.72Å
726	K	34.7	Very low	36.6	Very low	186 Å²	186	130.7 Å²	130.7	81%	0.809	70%	0.695	S	S	*	*	G	3₁₀ helix	trans	-56.8	-13.5	-178.7	-75.6	-176.8	174.3	-179.1	0	114.7	A728 M729	K726-A728 PolarHBondContact O-N 3.46Å; K726-M729 PolarHBondContact O-N 3.17Å
727	S	34.5	Very low	38.2	Very low	72 Å²	72	128.5 Å²	128.5	50%	0.503	68%	0.676	S	S	.	*	G	3₁₀ helix	trans	-57.3	-33.5	168.4	-50.3	0	0	0	0	113.4	T725 M729 I730	T725-S727 PolarHBondContact O-N 3.48Å; S727-M729 PolarHBondContact O-N 2.82Å; S727-I730 PolarHBondContact O-N 3.2Å
728	A	38.1	Very low	40.2	Very low	33 Å²	33	124 Å²	124	27%	0.273	65%	0.649	S	S	.	*	G	3₁₀ helix	trans	-74.1	-6.1	-174.8	0	0	0	0	0	115	V724 T725 K726	V724-A728 HydrophobicContact CG1-CB 4.1Å; T725-A728 PolarHBondContact O-N 2.72Å; K726-A728 PolarHBondContact O-N 3.46Å
729	M	35.5	Very low	42.8	Very low	163 Å²	163	117 Å²	117	80%	0.803	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-104.2	-12.3	177.3	-69	-174	175	0	0	113.7	K726 S727	K726-M729 PolarHBondContact O-N 3.17Å; S727-M729 PolarHBondContact O-N 2.82Å
730	I	38.3	Very low	45.4	Very low	144 Å²	144	112.1 Å²	112.1	74%	0.738	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	-23.1	176.7	-65.2	175.2	0	0	0	111.4	S727 K732	S727-I730 PolarHBondContact O-N 3.2Å; I730-K732 PolarHBondContact O-N 2.71Å
731	E	39.3	Very low	48.3	Very low	166 Å²	166	104.8 Å²	104.8	78%	0.776	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-4.3	178.2	-70.2	-172.6	127.1	0	0	115
732	K	37.2	Very low	50.9	Low	185 Å²	185	97.1 Å²	97.1	80%	0.804	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	1.2	-174.4	-97.7	-177.6	176.4	179	0	116.8	I730	I730-K732 PolarHBondContact O-N 2.71Å
733	L	40.6	Very low	53.8	Low	153 Å²	153	91.8 Å²	91.8	80%	0.801	46%	0.463	S	S	*	.	S	Bend	trans	-115.2	-9.4	-179.6	-98.9	85.6	0	0	0	117.4	K735	L733-K735 PolarHBondContact O-N 2.77Å
734	K	44.3	Very low	57	Low	115 Å²	115	83.9 Å²	83.9	50%	0.5	42%	0.42	S	S	.	.			trans	-97.2	75.9	167.7	-76.9	-168.3	172.3	177.6	0	110.4	L689 P736	L689-K734 PolarHBondContact O-NZ 3.19Å; K734-P736 WeakPolarHBondContact O-CD 3.22Å
735	K	49.6	Very low	59.8	Low	152 Å²	152	83 Å²	83	66%	0.661	41%	0.41	S	S	*	.			trans	-60.3	108.5	175.2	-161	174.9	-173.8	179.4	0	108.1	L733	L733-K735 PolarHBondContact O-N 2.77Å
736	P	55.4	Low	62.6	Low	60 Å²	60	80.7 Å²	80.7	39%	0.39	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-72.6	146.8	-168.8	29.9	-36.4	0	0	0	110.9	L588 K734 K738	L588-P736 HydrophobicContact CD1-CB 3.6Å; L588-P736 HydrophobicContact CD1-CG 3.4Å; L588-P736 VanDerWaalsContact CD1-CG 3.4Å; L588-P736 HydrophobicContact CD2-CB 4Å; L588-P736 HydrophobicContact CD2-CG 3.99Å; L588-P736 HydrophobicContact CG-CB 3.68Å; L588-P736 HydrophobicContact CG-CG 3.92Å; K734-P736 WeakPolarHBondContact O-CD 3.22Å; P736-K738 PolarHBondContact O-N 2.9Å
737	M	64.7	Low	65.2	Low	67 Å²	67	77.1 Å²	77.1	33%	0.33	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	121.2	-177.9	-166.8	169.9	-160.3	0	0	109.9	C589 R665	C589-M737 PolarHBondContact N-O 2.78Å; C589-M737 PolarHBondContact O-N 2.94Å; R665-M737 HydrophobicContact CB-CE 3.83Å; R665-M737 HydrophobicContact CG-CE 3.81Å; R665-M737 HydrophobicContact CG-SD 4.26Å
738	K	76.8	Confident	67.8	Low	85 Å²	85	75.1 Å²	75.1	37%	0.37	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	126.7	174.9	-61.7	176.7	-168.4	158.5	0	110	D668 P736	D668-K738 IonicContact OD1-NZ 2.64Å; D668-K738 IonicContact OD2-NZ 2.64Å; D668-K738 PolarHBondContact OD2-NZ 2.91Å; P736-K738 PolarHBondContact O-N 2.9Å
739	M	80.9	Confident	70.3	Confident	5 Å²	5	73.6 Å²	73.6	3%	0.025	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	139.6	168.2	-68	-62.8	-60	0	0	108.5	Q586 I587 C589 S651 M663 S664 R665	Q586-M739 WeakPolarHBondContact CA-O 3.44Å; I587-M739 HydrophobicContact CD1-CB 4.3Å; I587-M739 HydrophobicContact CG1-CB 3.66Å; I587-M739 PolarHBondContact N-O 3.32Å; I587-M739 PolarHBondContact O-N 2.86Å; C589-M739 HydrophobicContact CB-CG 3.47Å; C589-M739 VanDerWaalsContact CB-CG 3.47Å; S651-M739 VanDerWaalsContact CB-CE 3.48Å; M663-M739 HydrophobicContact CB-CE 3.97Å; S664-M739 WeakPolarHBondContact O-CE 3.16Å; R665-M739 HydrophobicContact CB-SD 4.23Å; R665-M739 HydrophobicContact CG-CE 4.03Å; R665-M739 HydrophobicContact CG-SD 3.43Å; R665-M739 WeakPolarHBondContact CG-SD 3.5Å
740	I	89	Confident	72.9	Confident	18 Å²	18	69.6 Å²	69.6	9%	0.092	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	131.8	166.8	-170.2	169.4	0	0	0	108.5	Q586 M663 S664 R666	Q586-I740 HydrophobicContact CG-CG1 4.48Å; M663-I740 WeakPolarHBondContact CA-O 3.24Å; S664-I740 PolarHBondContact N-O 2.83Å; S664-I740 PolarHBondContact O-N 3.29Å; R666-I740 HydrophobicContact CB-CG2 4.44Å
741	C	91.1	Very high	75.3	Confident	0 Å²	0	66 Å²	66	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	125.7	-176.5	-55.2	0	0	0	0	109.1	S584 T585 I587 V605 L662 M663	S584-C741 CarbonylContact C-O 3.56Å; S584-C741 VanDerWaalsContact CA-O 3.24Å; S584-C741 WeakPolarHBondContact CA-O 3.4Å; T585-C741 HydrophobicContact CG2-CB 4.47Å; T585-C741 PolarHBondContact N-O 2.75Å; T585-C741 PolarHBondContact O-N 2.82Å; I587-C741 VanDerWaalsContact CD1-SG 3.54Å; V605-C741 HydrophobicContact CB-CB 4.38Å; V605-C741 HydrophobicContact CG1-CB 3.8Å; V605-C741 HydrophobicContact CG2-CB 3.82Å; L662-C741 CarbonylContact O-C 3.6Å; L662-C741 WeakPolarHBondContact O-CA 3.4Å; M663-C741 HydrophobicContact CG-CB 4.17Å; M663-C741 VanDerWaalsContact CG-SG 3.52Å; M663-C741 HydrophobicContact SD-CB 4.44Å; M663-C741 PolarHBondContact SD-SG 2.94Å
742	H	92.2	Very high	77.9	Confident	3 Å²	3	58.1 Å²	58.1	1%	0.014	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	136.2	179.9	-52.3	-76.2	0	0	0	108.9	S584 I643 H645 V661 L662 L744	S584-H742 PolarHBondContact OG-CE1 2.79Å; S584-H742 PolarHBondContact OG-ND1 2.81Å; I643-H742 WeakPolarHBondContact CD1-ND1 3.27Å; H645-H742 AromaticContact CD2-NE2 3.77Å; H645-H742 AromaticContact CE1-NE2 3.75Å; H645-H742 AromaticContact NE2-CD2 3.56Å; H645-H742 AromaticContact NE2-CE1 3.82Å; H645-H742 AromaticContact NE2-NE2 2.84Å; H645-H742 PolarHBondContact NE2-NE2 2.87Å; V661-H742 WeakPolarHBondContact CA-O 3.34Å; L662-H742 HydrophobicContact CB-CB 4.32Å; L662-H742 PolarHBondContact N-O 2.9Å; L662-H742 PolarHBondContact O-N 3.02Å; H742-L744 HydrophobicContact CB-CD1 4.3Å
743	V	93.3	Very high	80.4	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.006	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	126.4	175.9	-177.6	0	0	0	0	109	M582 G583 V605 V606 I609 V661	M582-V743 HydrophobicContact CB-CB 4.45Å; M582-V743 HydrophobicContact CB-CG1 4.33Å; M582-V743 HydrophobicContact CG-CG1 4.46Å; M582-V743 PolarHBondContact N-O 3.12Å; M582-V743 HydrophobicContact SD-CG1 3.85Å; G583-V743 PolarHBondContact N-O 2.99Å; G583-V743 PolarHBondContact O-N 3.03Å; V605-V743 HydrophobicContact CG1-CG2 3.68Å; V606-V743 HydrophobicContact CG2-CG1 4.42Å; V606-V743 HydrophobicContact CG2-CG2 4.24Å; I609-V743 HydrophobicContact CD1-CB 4.28Å; I609-V743 HydrophobicContact CD1-CG2 3.74Å; V661-V743 HydrophobicContact CG1-CG2 4.47Å; V661-V743 HydrophobicContact CG2-CG2 4.37Å
744	L	93.6	Very high	82.7	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	138.4	176.3	-60.9	94.8	0	0	0	109.1	A579 Q580 Y581 V622 I633 L659 F660 H742	A579-L744 HydrophobicContact CB-CB 4.21Å; A579-L744 HydrophobicContact CB-CD2 3.93Å; Q580-L744 CarbonylContact O-C 3.53Å; Q580-L744 WeakPolarHBondContact O-CA 3.33Å; Y581-L744 HydrophobicContact CD2-CG 4.29Å; V622-L744 HydrophobicContact CG2-CD2 3.86Å; I633-L744 HydrophobicContact CD1-CD1 4.03Å; I633-L744 HydrophobicContact CD1-CD2 4.05Å; I633-L744 HydrophobicContact CG1-CD2 4.3Å; L659-L744 CarbonylContact C-O 3.54Å; L659-L744 WeakPolarHBondContact CA-O 3.16Å; F660-L744 HydrophobicContact CD1-CD1 4.11Å; F660-L744 PolarHBondContact N-O 3.44Å; F660-L744 PolarHBondContact O-N 2.92Å; H742-L744 HydrophobicContact CB-CD1 4.3Å
745	E	93	Very high	84.9	Confident	72 Å²	72	41.3 Å²	41.3	34%	0.336	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	129.7	171.5	176.2	-173.8	-141.8	0	0	109.3	Q580 M582 D658 L659	Q580-E745 HydrophobicContact CB-CB 4.15Å; Q580-E745 PolarHBondContact N-O 3.32Å; Q580-E745 PolarHBondContact NE2-OE2 3.26Å; Q580-E745 VanDerWaalsContact NE2-OE2 3.07Å; Q580-E745 PolarHBondContact O-N 3.47Å; M582-E745 HydrophobicContact CG-CB 4.15Å; M582-E745 HydrophobicContact SD-CB 4.11Å; D658-E745 CarbonylContact O-C 3.58Å; D658-E745 WeakPolarHBondContact O-CA 3.23Å; L659-E745 HydrophobicContact CD2-CB 3.8Å; L659-E745 HydrophobicContact CD2-CG 4.16Å
746	S	91.9	Very high	86.8	Confident	13 Å²	13	34 Å²	34	9%	0.091	18%	0.178	C	C	.	.			trans	-160.3	138.3	172.5	-176.4	0	0	0	0	109.4	R578 D658 E748 A749	R578-S746 PolarHBondContact O-OG 2.64Å; D658-S746 CarbonylContact C-O 3.58Å; D658-S746 CarbonylContact O-C 3.54Å; D658-S746 PolarHBondContact O-N 3.46Å; S746-E748 PolarHBondContact O-N 2.94Å; S746-E748 PolarHBondContact OG-N 2.79Å; S746-A749 VanDerWaalsContact O-CB 3.22Å; S746-A749 WeakPolarHBondContact O-CB 3.39Å; S746-A749 PolarHBondContact O-N 3.22Å
747	T	90.2	Very high	88.4	Confident	112 Å²	112	31.6 Å²	31.6	69%	0.687	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-10.3	169.9	56.1	0	0	0	0	113
748	E	88.5	Confident	89.4	Confident	30 Å²	30	33.9 Å²	33.9	14%	0.14	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.1	15.3	177.5	-67.2	173.9	-165.2	0	0	111.4	R556 S746 Q750 L751 I752	R556-E748 WeakPolarHBondContact CD-OE1 3.45Å; R556-E748 IonicContact NH1-OE1 2.73Å; R556-E748 PolarHBondContact NH1-OE1 3.01Å; S746-E748 PolarHBondContact O-N 2.94Å; S746-E748 PolarHBondContact OG-N 2.79Å; E748-Q750 VanDerWaalsContact C-N 3.25Å; E748-Q750 PolarHBondContact O-N 2.79Å; E748-L751 HydrophobicContact CB-CB 4.31Å; E748-L751 WeakPolarHBondContact O-CA 3.35Å; E748-L751 WeakPolarHBondContact O-CB 3.35Å; E748-L751 PolarHBondContact O-N 2.8Å; E748-I752 WeakPolarHBondContact O-CG1 3.31Å; E748-I752 PolarHBondContact O-N 2.81Å
749	A	90.1	Very high	89.8	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.008	16%	0.159	C	C	.	.	H	α-helix	trans	-51.2	-41.6	179.4	0	0	0	0	0	113.2	F660 S746 A753	F660-A749 HydrophobicContact CB-CB 4.05Å; S746-A749 VanDerWaalsContact O-CB 3.22Å; S746-A749 WeakPolarHBondContact O-CB 3.39Å; S746-A749 PolarHBondContact O-N 3.22Å; A749-A753 PolarHBondContact O-N 3.24Å
750	Q	90	Very high	90	Very high	78 Å²	78	32.2 Å²	32.2	36%	0.364	17%	0.167	S	C	.	.	H	α-helix	trans	-60	-50.8	173.5	-169.1	-172.6	21.7	0	0	111.2	H405 E748 I752 A753 Q754	H405-Q750 PolarHBondContact CD2-NE2 2.98Å; H405-Q750 VanDerWaalsContact CG-NE2 3.27Å; E748-Q750 VanDerWaalsContact C-N 3.25Å; E748-Q750 PolarHBondContact O-N 2.79Å; Q750-I752 PolarHBondContact O-N 2.94Å; Q750-A753 WeakPolarHBondContact O-CB 3.43Å; Q750-A753 PolarHBondContact O-N 3.4Å; Q750-A753 VanDerWaalsContact O-N 3.15Å; Q750-Q754 WeakPolarHBondContact O-CG 3.48Å; Q750-Q754 PolarHBondContact O-N 2.81Å
751	L	90.4	Very high	89.5	Confident	69 Å²	69	35.2 Å²	35.2	36%	0.361	18%	0.181	S	C	.	.	H	α-helix	trans	-59.5	-45.2	179.5	179.9	62.3	0	0	0	111.5	V557 F577 E748 A753 Q754 T755	V557-L751 HydrophobicContact CG2-CD2 3.95Å; F577-L751 HydrophobicContact CE1-CD2 4.1Å; F577-L751 HydrophobicContact CE1-CG 4.09Å; E748-L751 HydrophobicContact CB-CB 4.31Å; E748-L751 WeakPolarHBondContact O-CA 3.35Å; E748-L751 WeakPolarHBondContact O-CB 3.35Å; E748-L751 PolarHBondContact O-N 2.8Å; L751-A753 VanDerWaalsContact C-N 3.3Å; L751-A753 PolarHBondContact O-N 3.03Å; L751-Q754 WeakPolarHBondContact O-CB 3.27Å; L751-Q754 PolarHBondContact O-N 2.73Å; L751-Q754 VanDerWaalsContact O-N 3.08Å; L751-T755 PolarHBondContact O-N 3.49Å; L751-T755 PolarHBondContact O-OG1 3.08Å
752	I	92.3	Very high	89	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-55.2	-46.4	174.4	-67.4	166.2	0	0	0	110.4	F577 L624 F660 E748 Q750 Q754 T755 V756	F577-I752 HydrophobicContact CB-CD1 3.93Å; F577-I752 HydrophobicContact CB-CG1 3.86Å; F577-I752 HydrophobicContact CD1-CD1 4.43Å; F577-I752 HydrophobicContact CD1-CG1 3.62Å; F577-I752 HydrophobicContact CD2-CG1 4.19Å; F577-I752 HydrophobicContact CE1-CG1 4.18Å; F577-I752 HydrophobicContact CG-CD1 4.27Å; F577-I752 HydrophobicContact CG-CG1 3.63Å; L624-I752 HydrophobicContact CD2-CD1 4.25Å; L624-I752 HydrophobicContact CD2-CG1 4.49Å; L624-I752 HydrophobicContact CD2-CG2 3.43Å; L624-I752 VanDerWaalsContact CD2-CG2 3.43Å; F660-I752 HydrophobicContact CD1-CG2 3.98Å; F660-I752 HydrophobicContact CD2-CB 4.38Å; F660-I752 HydrophobicContact CD2-CG2 3.8Å; F660-I752 HydrophobicContact CE1-CG2 3.96Å; F660-I752 HydrophobicContact CE2-CG2 3.79Å; F660-I752 HydrophobicContact CG-CG2 3.9Å; F660-I752 HydrophobicContact CZ-CG2 3.86Å; E748-I752 WeakPolarHBondContact O-CG1 3.31Å; E748-I752 PolarHBondContact O-N 2.81Å; Q750-I752 PolarHBondContact O-N 2.94Å; I752-Q754 PolarHBondContact O-N 2.85Å; I752-T755 PolarHBondContact O-N 2.9Å; I752-V756 HydrophobicContact CG2-CG2 4.42Å; I752-V756 WeakPolarHBondContact O-CG2 3.25Å; I752-V756 PolarHBondContact O-N 3.44Å
753	A	91	Very high	88.3	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.008	21%	0.207	C	C	.	.	H	α-helix	trans	-63	-38.4	176.8	0	0	0	0	0	112.6	D655 F660 A749 Q750 L751 G757	D655-A753 HydrophobicContact CB-CB 4.33Å; F660-A753 HydrophobicContact CD2-CB 4.2Å; F660-A753 HydrophobicContact CE2-CB 4.09Å; A749-A753 PolarHBondContact O-N 3.24Å; Q750-A753 WeakPolarHBondContact O-CB 3.43Å; Q750-A753 PolarHBondContact O-N 3.4Å; Q750-A753 VanDerWaalsContact O-N 3.15Å; L751-A753 VanDerWaalsContact C-N 3.3Å; L751-A753 PolarHBondContact O-N 3.03Å; A753-G757 PolarHBondContact O-N 2.7Å
754	Q	88.5	Confident	87.4	Confident	73 Å²	73	45 Å²	45	34%	0.341	23%	0.229	S	C	.	.	H	α-helix	trans	-63	-47.8	173.5	-41.7	-159.6	-20.9	0	0	111.4	W407 Q750 L751 I752 G757 H758	W407-Q754 HydrophobicContact CH2-CB 4.45Å; W407-Q754 HydrophobicContact CZ2-CB 3.53Å; W407-Q754 HydrophobicContact CZ2-CG 3.54Å; Q750-Q754 WeakPolarHBondContact O-CG 3.48Å; Q750-Q754 PolarHBondContact O-N 2.81Å; L751-Q754 WeakPolarHBondContact O-CB 3.27Å; L751-Q754 PolarHBondContact O-N 2.73Å; L751-Q754 VanDerWaalsContact O-N 3.08Å; I752-Q754 PolarHBondContact O-N 2.85Å; Q754-G757 PolarHBondContact O-N 3.18Å; Q754-H758 PolarHBondContact O-N 3.42Å
755	T	91.1	Very high	86.5	Confident	25 Å²	25	47.4 Å²	47.4	15%	0.153	24%	0.241	C	C	.	.	H	α-helix	trans	-64.4	-43.2	-178.4	-62.1	0	0	0	0	112.1	L575 F577 V626 L751 I752 H758 A759	L575-T755 HydrophobicContact CB-CG2 4.41Å; L575-T755 HydrophobicContact CD1-CG2 3.56Å; F577-T755 HydrophobicContact CE2-CG2 3.8Å; F577-T755 HydrophobicContact CZ-CG2 3.77Å; F577-T755 WeakPolarHBondContact CZ-OG1 3.32Å; V626-T755 HydrophobicContact CG1-CG2 4.29Å; L751-T755 PolarHBondContact O-N 3.49Å; L751-T755 PolarHBondContact O-OG1 3.08Å; I752-T755 PolarHBondContact O-N 2.9Å; T755-H758 PolarHBondContact O-N 2.77Å; T755-A759 WeakPolarHBondContact O-CB 3.23Å; T755-A759 PolarHBondContact O-N 3.39Å
756	V	90	Very high	85.6	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64.1	-42.3	174.4	176.3	0	0	0	0	110.7	V626 I631 L647 I653 F660 I752 H758 A759 F760	V626-V756 HydrophobicContact CB-CG2 4.4Å; V626-V756 HydrophobicContact CG1-CB 4.41Å; V626-V756 HydrophobicContact CG1-CG2 3.69Å; V626-V756 HydrophobicContact CG2-CG2 3.74Å; I631-V756 HydrophobicContact CD1-CB 4.49Å; I631-V756 HydrophobicContact CD1-CG1 3.54Å; I631-V756 HydrophobicContact CD1-CG2 4.04Å; L647-V756 HydrophobicContact CD1-CG1 4.46Å; I653-V756 HydrophobicContact CD1-CB 3.98Å; I653-V756 HydrophobicContact CD1-CG1 3.76Å; I653-V756 HydrophobicContact CG2-CG1 4.2Å; F660-V756 HydrophobicContact CZ-CG2 4.2Å; I752-V756 HydrophobicContact CG2-CG2 4.42Å; I752-V756 WeakPolarHBondContact O-CG2 3.25Å; I752-V756 PolarHBondContact O-N 3.44Å; V756-H758 VanDerWaalsContact C-N 3.3Å; V756-H758 PolarHBondContact O-N 3.08Å; V756-A759 PolarHBondContact O-N 2.81Å; V756-F760 HydrophobicContact CG1-CD2 3.99Å; V756-F760 HydrophobicContact CG1-CE2 3.66Å; V756-F760 WeakPolarHBondContact O-CD2 3.46Å; V756-F760 PolarHBondContact O-N 3.35Å
757	G	87.1	Confident	84.8	Confident	9 Å²	9	51.4 Å²	51.4	9%	0.093	26%	0.258	C	S	.	.	H	α-helix	trans	-57.2	-41.1	173.4	0	0	0	0	0	113	A753 Q754 Q761	A753-G757 PolarHBondContact O-N 2.7Å; Q754-G757 PolarHBondContact O-N 3.18Å; G757-Q761 PolarHBondContact O-N 3.38Å
758	H	86	Confident	83.9	Confident	114 Å²	114	47.5 Å²	47.5	53%	0.528	23%	0.233	S	C	.	.	H	α-helix	trans	-69.6	-40.1	175.5	-168.5	65.2	0	0	0	112.6	Q754 T755 V756 F760 Q761 L762	Q754-H758 PolarHBondContact O-N 3.42Å; T755-H758 PolarHBondContact O-N 2.77Å; V756-H758 VanDerWaalsContact C-N 3.3Å; V756-H758 PolarHBondContact O-N 3.08Å; H758-F760 VanDerWaalsContact C-N 3.29Å; H758-F760 PolarHBondContact O-N 3.25Å; H758-Q761 WeakPolarHBondContact O-CB 3.27Å; H758-Q761 PolarHBondContact O-N 2.97Å; H758-L762 PolarHBondContact O-N 3.08Å
759	A	86.3	Confident	83.1	Confident	9 Å²	9	52.5 Å²	52.5	7%	0.074	25%	0.251	C	S	.	.	H	α-helix	trans	-60	-37.8	175.7	0	0	0	0	0	112.3	V626 L647 T755 V756 L762 A763	V626-A759 HydrophobicContact CG1-CB 4.12Å; L647-A759 HydrophobicContact CD2-CB 4.33Å; T755-A759 WeakPolarHBondContact O-CB 3.23Å; T755-A759 PolarHBondContact O-N 3.39Å; V756-A759 PolarHBondContact O-N 2.81Å; A759-L762 PolarHBondContact O-N 3.41Å; A759-A763 VanDerWaalsContact O-CB 3.27Å; A759-A763 WeakPolarHBondContact O-CB 3.3Å; A759-A763 PolarHBondContact O-N 3.49Å
760	F	84.9	Confident	82.1	Confident	47 Å²	47	59.3 Å²	59.3	21%	0.206	28%	0.282	C	S	.	.	H	α-helix	trans	-61	-43	170.5	-80.6	-69.1	0	0	0	112.8	F409 L647 V650 I653 V756 H758 A763 Y764	F409-F760 HydrophobicContact CE1-CB 4.14Å; F409-F760 HydrophobicContact CE1-CD2 4.49Å; F409-F760 HydrophobicContact CE1-CG 4.48Å; F409-F760 HydrophobicContact CZ-CD2 4.19Å; L647-F760 HydrophobicContact CD1-CD1 4.02Å; L647-F760 HydrophobicContact CD1-CD2 4.26Å; L647-F760 HydrophobicContact CD1-CE1 3.72Å; L647-F760 HydrophobicContact CD1-CE2 3.96Å; L647-F760 HydrophobicContact CD1-CG 4.28Å; L647-F760 HydrophobicContact CD1-CZ 3.68Å; L647-F760 HydrophobicContact CD2-CD1 4.03Å; L647-F760 HydrophobicContact CD2-CE1 4.42Å; L647-F760 HydrophobicContact CD2-CG 4.35Å; L647-F760 HydrophobicContact CG-CD1 3.71Å; L647-F760 HydrophobicContact CG-CE1 3.6Å; L647-F760 HydrophobicContact CG-CG 4.32Å; L647-F760 HydrophobicContact CG-CZ 4.11Å; L647-F760 VanDerWaalsContact O-CE1 3.3Å; L647-F760 WeakPolarHBondContact O-CE1 3.37Å; V650-F760 HydrophobicContact CB-CZ 3.91Å; V650-F760 HydrophobicContact CG1-CE2 4.4Å; V650-F760 HydrophobicContact CG1-CZ 3.83Å; I653-F760 HydrophobicContact CD1-CE2 4.5Å; V756-F760 HydrophobicContact CG1-CD2 3.99Å; V756-F760 HydrophobicContact CG1-CE2 3.66Å; V756-F760 WeakPolarHBondContact O-CD2 3.46Å; V756-F760 PolarHBondContact O-N 3.35Å; H758-F760 VanDerWaalsContact C-N 3.29Å; H758-F760 PolarHBondContact O-N 3.25Å; F760-A763 PolarHBondContact O-N 2.67Å; F760-Y764 WeakPolarHBondContact O-CB 3.17Å; F760-Y764 PolarHBondContact O-N 2.95Å
761	Q	78.9	Confident	81.2	Confident	81 Å²	81	60.3 Å²	60.3	38%	0.379	29%	0.29	S	S	.	.	H	α-helix	trans	-65.9	-41.2	-179.8	-170.4	64.7	24.4	0	0	111.5	G757 H758 Y764 L765	G757-Q761 PolarHBondContact O-N 3.38Å; H758-Q761 WeakPolarHBondContact O-CB 3.27Å; H758-Q761 PolarHBondContact O-N 2.97Å; Q761-Y764 PolarHBondContact O-N 3.36Å; Q761-L765 WeakPolarHBondContact O-CG 3.39Å; Q761-L765 PolarHBondContact O-N 2.77Å
762	L	79.2	Confident	79.7	Confident	65 Å²	65	59.9 Å²	59.9	34%	0.34	30%	0.302	S	S	.	.	H	α-helix	trans	-64.8	-48	174.2	-67.6	177.6	0	0	0	111.4	T628 H758 A759 Y764 L765 D766	T628-L762 HydrophobicContact CG2-CB 3.68Å; T628-L762 HydrophobicContact CG2-CD1 4.31Å; H758-L762 PolarHBondContact O-N 3.08Å; A759-L762 PolarHBondContact O-N 3.41Å; L762-Y764 PolarHBondContact O-N 3.25Å; L762-L765 CarbonylContact O-C 3.41Å; L762-L765 WeakPolarHBondContact O-CB 3.5Å; L762-L765 PolarHBondContact O-N 2.91Å; L762-D766 PolarHBondContact O-N 3.43Å
763	A	78.2	Confident	78.2	Confident	27 Å²	27	63.2 Å²	63.2	22%	0.223	32%	0.32	C	S	.	.	H	α-helix	trans	-60	-33.6	177.1	0	0	0	0	0	113.1	T628 L647 A759 F760 F767	T628-A763 VanDerWaalsContact O-CB 3.25Å; T628-A763 WeakPolarHBondContact O-CB 3.45Å; L647-A763 HydrophobicContact CD2-CB 3.88Å; A759-A763 VanDerWaalsContact O-CB 3.27Å; A759-A763 WeakPolarHBondContact O-CB 3.3Å; A759-A763 PolarHBondContact O-N 3.49Å; F760-A763 PolarHBondContact O-N 2.67Å; A763-F767 VanDerWaalsContact O-CB 3.27Å; A763-F767 WeakPolarHBondContact O-CB 3.44Å; A763-F767 PolarHBondContact O-N 2.76Å
764	Y	74.2	Confident	76.7	Confident	116 Å²	116	70.8 Å²	70.8	46%	0.455	36%	0.355	S	S	.	.	H	α-helix	trans	-68.2	-43.3	172.2	176.3	-107.2	0	0	0	112.1	F760 Q761 L762 F767 L768	F760-Y764 WeakPolarHBondContact O-CB 3.17Å; F760-Y764 PolarHBondContact O-N 2.95Å; Q761-Y764 PolarHBondContact O-N 3.36Å; L762-Y764 PolarHBondContact O-N 3.25Å; Y764-F767 PolarHBondContact O-N 3.05Å; Y764-L768 HydrophobicContact CD1-CD1 4.1Å; Y764-L768 HydrophobicContact CE1-CD1 3.54Å; Y764-L768 HydrophobicContact CE1-CG 4.29Å; Y764-L768 HydrophobicContact CE2-CD1 4.45Å; Y764-L768 HydrophobicContact CE2-CG 4.38Å; Y764-L768 WeakPolarHBondContact O-CG 3.04Å; Y764-L768 PolarHBondContact O-N 3.06Å
765	L	74.5	Confident	75	Confident	52 Å²	52	72.3 Å²	72.3	27%	0.272	37%	0.365	S	S	.	.	H	α-helix	trans	-66	-37.2	175.4	-70.6	169.6	0	0	0	112.6	Q761 L762 L768 R769	Q761-L765 WeakPolarHBondContact O-CG 3.39Å; Q761-L765 PolarHBondContact O-N 2.77Å; L762-L765 CarbonylContact O-C 3.41Å; L762-L765 WeakPolarHBondContact O-CB 3.5Å; L762-L765 PolarHBondContact O-N 2.91Å; L765-L768 PolarHBondContact O-N 3.22Å; L765-R769 WeakPolarHBondContact O-CB 3.05Å; L765-R769 PolarHBondContact O-N 3.16Å
766	D	74.5	Confident	73.3	Confident	47 Å²	47	77.1 Å²	77.1	25%	0.251	39%	0.389	S	S	.	.	H	α-helix	trans	-68.4	-42.7	174.9	-66.5	-29.1	0	0	0	110.7	L762 L768 R769 E770	L762-D766 PolarHBondContact O-N 3.43Å; D766-L768 VanDerWaalsContact C-N 3.34Å; D766-L768 PolarHBondContact O-N 2.76Å; D766-R769 WeakPolarHBondContact O-CB 3.09Å; D766-R769 PolarHBondContact O-N 2.87Å; D766-R769 VanDerWaalsContact O-N 3.12Å; D766-R769 IonicContact OD1-CZ 2.83Å; D766-R769 IonicContact OD1-NH1 3.32Å; D766-R769 PolarHBondContact OD1-NH1 2.73Å; D766-R769 IonicContact OD1-NH2 2.77Å; D766-R769 PolarHBondContact OD1-NH2 2.89Å; D766-E770 WeakPolarHBondContact O-CG 3.41Å; D766-E770 PolarHBondContact O-N 3.42Å
767	F	74.3	Confident	71.2	Confident	122 Å²	122	80.2 Å²	80.2	54%	0.535	42%	0.421	S	S	.	.	H	α-helix	trans	-59.4	-40.5	172	176.1	-97	0	0	0	112.5	A763 Y764 N771	A763-F767 VanDerWaalsContact O-CB 3.27Å; A763-F767 WeakPolarHBondContact O-CB 3.44Å; A763-F767 PolarHBondContact O-N 2.76Å; Y764-F767 PolarHBondContact O-N 3.05Å; F767-N771 WeakPolarHBondContact CE2-ND2 3.48Å; F767-N771 WeakPolarHBondContact CZ-ND2 3.41Å; F767-N771 PolarHBondContact O-N 2.94Å; F767-N771 PolarHBondContact O-ND2 3.28Å
768	L	71.3	Confident	69.2	Low	30 Å²	30	83.3 Å²	83.3	16%	0.157	44%	0.435	C	S	.	.	H	α-helix	trans	-63.3	-43.6	173.1	-72	176.9	0	0	0	111.5	Y764 L765 D766 N771 G772 I773	Y764-L768 HydrophobicContact CD1-CD1 4.1Å; Y764-L768 HydrophobicContact CE1-CD1 3.54Å; Y764-L768 HydrophobicContact CE1-CG 4.29Å; Y764-L768 HydrophobicContact CE2-CD1 4.45Å; Y764-L768 HydrophobicContact CE2-CG 4.38Å; Y764-L768 WeakPolarHBondContact O-CG 3.04Å; Y764-L768 PolarHBondContact O-N 3.06Å; L765-L768 PolarHBondContact O-N 3.22Å; D766-L768 VanDerWaalsContact C-N 3.34Å; D766-L768 PolarHBondContact O-N 2.76Å; L768-N771 CarbonylContact O-C 3.54Å; L768-N771 PolarHBondContact O-N 2.75Å; L768-G772 PolarHBondContact O-N 3.3Å; L768-I773 HydrophobicContact CB-CB 4.28Å; L768-I773 HydrophobicContact CD2-CD1 3.83Å; L768-I773 WeakPolarHBondContact O-CB 3.32Å; L768-I773 PolarHBondContact O-N 2.84Å
769	R	71.9	Confident	67.3	Low	135 Å²	135	82.6 Å²	82.6	51%	0.509	43%	0.434	S	S	.	.	H	α-helix	trans	-64.4	-43.9	179.5	-162	-172.7	-50.8	120.1	19.5	112.4	L765 D766 N771 G772	L765-R769 WeakPolarHBondContact O-CB 3.05Å; L765-R769 PolarHBondContact O-N 3.16Å; D766-R769 WeakPolarHBondContact O-CB 3.09Å; D766-R769 PolarHBondContact O-N 2.87Å; D766-R769 VanDerWaalsContact O-N 3.12Å; D766-R769 IonicContact OD1-CZ 2.83Å; D766-R769 IonicContact OD1-NH1 3.32Å; D766-R769 PolarHBondContact OD1-NH1 2.73Å; D766-R769 IonicContact OD1-NH2 2.77Å; D766-R769 PolarHBondContact OD1-NH2 2.89Å; R769-N771 PolarHBondContact O-N 3.41Å; R769-G772 PolarHBondContact O-N 2.94Å
770	E	70.4	Confident	65.3	Low	144 Å²	144	91.3 Å²	91.3	67%	0.673	47%	0.47	S	S	*	.	H	α-helix	trans	-61.5	-31.4	176.2	-75.3	-175.2	167.6	0	0	112.8	D766 G772	D766-E770 WeakPolarHBondContact O-CG 3.41Å; D766-E770 PolarHBondContact O-N 3.42Å; E770-G772 VanDerWaalsContact C-N 3.28Å
771	N	70.7	Confident	63.4	Low	100 Å²	100	95.6 Å²	95.6	54%	0.535	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	7.6	174	-69.7	-70.1	0	0	0	113.4	F767 L768 R769	F767-N771 WeakPolarHBondContact CE2-ND2 3.48Å; F767-N771 WeakPolarHBondContact CZ-ND2 3.41Å; F767-N771 PolarHBondContact O-N 2.94Å; F767-N771 PolarHBondContact O-ND2 3.28Å; L768-N771 CarbonylContact O-C 3.54Å; L768-N771 PolarHBondContact O-N 2.75Å; R769-N771 PolarHBondContact O-N 3.41Å
772	G	59.1	Low	61.7	Low	59 Å²	59	94.3 Å²	94.3	61%	0.608	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.1	17.8	174.6	0	0	0	0	0	115.6	L768 R769 E770	L768-G772 PolarHBondContact O-N 3.3Å; R769-G772 PolarHBondContact O-N 2.94Å; E770-G772 VanDerWaalsContact C-N 3.28Å
773	I	61.4	Low	60.5	Low	72 Å²	72	95.6 Å²	95.6	37%	0.369	49%	0.493	S	S	.	.			trans	-99.7	84	-179.3	-52.8	171.2	0	0	0	108.8	L768	L768-I773 HydrophobicContact CB-CB 4.28Å; L768-I773 HydrophobicContact CD2-CD1 3.83Å; L768-I773 WeakPolarHBondContact O-CB 3.32Å; L768-I773 PolarHBondContact O-N 2.84Å
774	E	58	Low	59.2	Low	159 Å²	159	98 Å²	98	74%	0.743	50%	0.497	S	S	*	.			trans	-88.9	-18.7	-174.7	-63.4	-169.7	156.9	0	0	114.6
775	D	53.4	Low	58.5	Low	106 Å²	106	96.3 Å²	96.3	57%	0.567	50%	0.496	S	S	*	.			trans	-99.9	110	-176.4	-93.1	-42.8	0	0	0	113.1	G777 I778	D775-G777 PolarHBondContact O-N 3.12Å; D775-G777 VanDerWaalsContact O-N 3.08Å; D775-I778 HydrophobicContact CB-CB 4.24Å; D775-I778 HydrophobicContact CB-CD1 3.65Å; D775-I778 HydrophobicContact CB-CG1 3.65Å; D775-I778 WeakPolarHBondContact O-CB 3.46Å; D775-I778 PolarHBondContact O-N 3.48Å
776	L	55.4	Low	57.8	Low	125 Å²	125	94.8 Å²	94.8	65%	0.654	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-62.5	-13.3	168.6	-77.6	78.9	0	0	0	112.8	I779	L776-I779 HydrophobicContact CB-CD1 4.36Å; L776-I779 WeakPolarHBondContact O-CB 3.33Å; L776-I779 WeakPolarHBondContact O-CD1 3.49Å; L776-I779 VanDerWaalsContact O-CG1 3.31Å; L776-I779 WeakPolarHBondContact O-CG1 3.08Å
777	G	46.7	Very low	56.9	Low	65 Å²	65	93 Å²	93	67%	0.67	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-73.5	-23.3	170.7	0	0	0	0	0	114.2	D775 I779	D775-G777 PolarHBondContact O-N 3.12Å; D775-G777 VanDerWaalsContact O-N 3.08Å; G777-I779 PolarHBondContact O-N 3.11Å
778	I	44.2	Very low	56.1	Low	74 Å²	74	88 Å²	88	38%	0.379	46%	0.457	S	S	.	.	G	3₁₀ helix	trans	-78.3	1.9	179.2	-63.6	178.8	0	0	0	111.3	D775 K780 Q781	D775-I778 HydrophobicContact CB-CB 4.24Å; D775-I778 HydrophobicContact CB-CD1 3.65Å; D775-I778 HydrophobicContact CB-CG1 3.65Å; D775-I778 WeakPolarHBondContact O-CB 3.46Å; D775-I778 PolarHBondContact O-N 3.48Å; I778-K780 PolarHBondContact O-N 2.87Å; I778-Q781 HydrophobicContact CG2-CB 3.67Å; I778-Q781 WeakPolarHBondContact O-CA 3.49Å; I778-Q781 WeakPolarHBondContact O-CB 3.39Å; I778-Q781 PolarHBondContact O-N 2.86Å
779	I	46.9	Very low	55.4	Low	99 Å²	99	92.8 Å²	92.8	51%	0.508	48%	0.477	S	S	.	.	G	3₁₀ helix	trans	-58	-17.7	170.3	-70.6	177.8	0	0	0	112.7	L776 G777 L782	L776-I779 HydrophobicContact CB-CD1 4.36Å; L776-I779 WeakPolarHBondContact O-CB 3.33Å; L776-I779 WeakPolarHBondContact O-CD1 3.49Å; L776-I779 VanDerWaalsContact O-CG1 3.31Å; L776-I779 WeakPolarHBondContact O-CG1 3.08Å; G777-I779 PolarHBondContact O-N 3.11Å; I779-L782 HydrophobicContact CB-CD1 4.21Å; I779-L782 HydrophobicContact CG1-CD1 4.4Å; I779-L782 HydrophobicContact CG2-CD1 3.77Å; I779-L782 WeakPolarHBondContact O-CB 3.39Å; I779-L782 WeakPolarHBondContact O-CD1 3.49Å; I779-L782 WeakPolarHBondContact O-CG 3.33Å
780	K	43.6	Very low	54.9	Low	192 Å²	192	90.3 Å²	90.3	84%	0.835	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-86	-0.1	169.2	-69	-170.2	175.9	-174.4	0	115.3	I778	I778-K780 PolarHBondContact O-N 2.87Å
781	Q	44.5	Very low	54.3	Low	137 Å²	137	83.9 Å²	83.9	64%	0.64	44%	0.441	S	S	*	.	S	Bend	trans	-106.9	-0.5	174.5	-147.2	163.6	-17.7	0	0	111.4	I778 D783 Y784	I778-Q781 HydrophobicContact CG2-CB 3.67Å; I778-Q781 WeakPolarHBondContact O-CA 3.49Å; I778-Q781 WeakPolarHBondContact O-CB 3.39Å; I778-Q781 PolarHBondContact O-N 2.86Å; Q781-D783 PolarHBondContact O-N 2.94Å; Q781-Y784 PolarHBondContact O-N 2.87Å
782	L	44.7	Very low	53.5	Low	54 Å²	54	84.3 Å²	84.3	28%	0.283	44%	0.44	S	S	.	.	H	α-helix	trans	-53.2	-30.5	173	-80.1	173.9	0	0	0	113.1	I779 Y784 D785 D786	I779-L782 HydrophobicContact CB-CD1 4.21Å; I779-L782 HydrophobicContact CG1-CD1 4.4Å; I779-L782 HydrophobicContact CG2-CD1 3.77Å; I779-L782 WeakPolarHBondContact O-CB 3.39Å; I779-L782 WeakPolarHBondContact O-CD1 3.49Å; I779-L782 WeakPolarHBondContact O-CG 3.33Å; L782-Y784 PolarHBondContact O-N 3.21Å; L782-Y784 VanDerWaalsContact O-N 3.08Å; L782-D785 PolarHBondContact O-N 2.9Å; L782-D785 VanDerWaalsContact O-N 3.08Å; L782-D786 PolarHBondContact O-N 3.19Å
783	D	53.6	Low	53.3	Low	92 Å²	92	87.4 Å²	87.4	49%	0.492	44%	0.441	S	S	.	.	H	α-helix	trans	-48.2	-39.3	179.9	-70	-4.1	0	0	0	112.7	Q781 D786 I787 Y910	Q781-D783 PolarHBondContact O-N 2.94Å; D783-D786 PolarHBondContact O-N 3.32Å; D783-I787 WeakPolarHBondContact O-CB 3.39Å; D783-I787 WeakPolarHBondContact O-CD1 3.18Å; D783-I787 WeakPolarHBondContact O-CG1 3.49Å; D783-I787 PolarHBondContact O-N 2.65Å; D783-Y910 WeakPolarHBondContact CB-OH 3.41Å
784	Y	50.6	Low	52.9	Low	79 Å²	79	89.7 Å²	89.7	31%	0.31	45%	0.448	S	S	.	.	H	α-helix	trans	-66.9	-46.9	180	-158.9	-76.8	0	0	0	112.4	Q781 L782 D786 I787 L788 Y910 I929	Q781-Y784 PolarHBondContact O-N 2.87Å; L782-Y784 PolarHBondContact O-N 3.21Å; L782-Y784 VanDerWaalsContact O-N 3.08Å; Y784-D786 VanDerWaalsContact C-N 3.32Å; Y784-I787 PolarHBondContact O-N 2.83Å; Y784-L788 HydrophobicContact CD1-CD1 3.67Å; Y784-L788 HydrophobicContact CD1-CD2 4.45Å; Y784-L788 HydrophobicContact CD1-CG 3.75Å; Y784-L788 HydrophobicContact CE1-CD1 3.63Å; Y784-L788 HydrophobicContact CE1-CD2 3.86Å; Y784-L788 HydrophobicContact CE1-CG 3.66Å; Y784-L788 WeakPolarHBondContact O-CB 3.44Å; Y784-L788 VanDerWaalsContact O-CG 3.29Å; Y784-L788 WeakPolarHBondContact O-CG 3.46Å; Y784-L788 PolarHBondContact O-N 3.06Å; Y784-Y910 AromaticContact CD2-CD1 3.28Å; Y784-Y910 HydrophobicContact CD2-CD1 3.28Å; Y784-Y910 AromaticContact CD2-CE1 3.38Å; Y784-Y910 HydrophobicContact CD2-CE1 3.38Å; Y784-Y910 AromaticContact CE2-CD1 3.61Å; Y784-Y910 HydrophobicContact CE2-CD1 3.61Å; Y784-Y910 HydrophobicContact CE2-CE1 4.2Å; Y784-Y910 HydrophobicContact CG-CD1 4.18Å; Y784-Y910 AromaticContact CG-CE1 3.98Å; Y784-Y910 HydrophobicContact CG-CE1 3.98Å; Y784-I929 HydrophobicContact CE2-CD1 4.22Å
785	D	58.7	Low	52.7	Low	80 Å²	80	83.9 Å²	83.9	43%	0.428	43%	0.425	S	S	.	.	H	α-helix	trans	-71.1	-30.2	178.7	-86.4	-31.3	0	0	0	112.2	L782 L788 K789	L782-D785 PolarHBondContact O-N 2.9Å; L782-D785 VanDerWaalsContact O-N 3.08Å; D785-L788 PolarHBondContact O-N 2.96Å; D785-K789 WeakPolarHBondContact O-CB 3.49Å; D785-K789 WeakPolarHBondContact O-CD 3.47Å; D785-K789 WeakPolarHBondContact O-CE 3.29Å; D785-K789 WeakPolarHBondContact O-CG 3.28Å; D785-K789 PolarHBondContact O-N 2.97Å
786	D	59.7	Low	52.7	Low	20 Å²	20	84.4 Å²	84.4	11%	0.107	43%	0.428	C	S	.	.	H	α-helix	trans	-72.6	-38.6	174.3	-69.4	-26	0	0	0	111.5	Q412 L782 D783 Y784 K789 Q790	Q412-D786 PolarHBondContact NE2-OD1 3.21Å; Q412-D786 PolarHBondContact NE2-OD2 2.84Å; L782-D786 PolarHBondContact O-N 3.19Å; D783-D786 PolarHBondContact O-N 3.32Å; Y784-D786 VanDerWaalsContact C-N 3.32Å; D786-K789 PolarHBondContact O-N 3.49Å; D786-K789 IonicContact OD1-NZ 3.27Å; D786-K789 PolarHBondContact OD1-NZ 3.27Å; D786-Q790 VanDerWaalsContact O-CB 3.3Å; D786-Q790 WeakPolarHBondContact O-CB 3.44Å; D786-Q790 WeakPolarHBondContact O-CG 3.29Å; D786-Q790 PolarHBondContact O-N 2.82Å
787	I	56	Low	52.8	Low	10 Å²	10	80 Å²	80	5%	0.051	40%	0.404	C	S	.	.	H	α-helix	trans	-59.5	-46.7	167.2	-66.9	153.6	0	0	0	110.2	D783 Y784 K789 Q790 Q791 P906 Y910 I929	D783-I787 WeakPolarHBondContact O-CB 3.39Å; D783-I787 WeakPolarHBondContact O-CD1 3.18Å; D783-I787 WeakPolarHBondContact O-CG1 3.49Å; D783-I787 PolarHBondContact O-N 2.65Å; Y784-I787 PolarHBondContact O-N 2.83Å; I787-K789 VanDerWaalsContact C-N 3.26Å; I787-K789 PolarHBondContact O-N 2.82Å; I787-Q790 CarbonylContact O-C 3.5Å; I787-Q790 PolarHBondContact O-N 3.34Å; I787-Q791 WeakPolarHBondContact O-CB 3.46Å; I787-Q791 PolarHBondContact O-N 3.37Å; I787-P906 HydrophobicContact CD1-CG 3.2Å; I787-P906 HydrophobicContact CG1-CG 3.64Å; I787-Y910 HydrophobicContact CD1-CD1 3.52Å; I787-Y910 HydrophobicContact CD1-CD2 4.17Å; I787-Y910 HydrophobicContact CD1-CE1 3.22Å; I787-Y910 HydrophobicContact CD1-CE2 3.88Å; I787-Y910 HydrophobicContact CD1-CG 4.04Å; I787-Y910 VanDerWaalsContact CD1-CZ 3.44Å; I787-I929 HydrophobicContact CG2-CD1 4.24Å
788	L	57.1	Low	53.2	Low	15 Å²	15	80.8 Å²	80.8	8%	0.079	39%	0.392	C	S	.	.	H	α-helix	trans	-60.2	-34.4	178	-75.6	-177.8	0	0	0	112.7	Y784 D785 G927 I929 R932	Y784-L788 HydrophobicContact CD1-CD1 3.67Å; Y784-L788 HydrophobicContact CD1-CD2 4.45Å; Y784-L788 HydrophobicContact CD1-CG 3.75Å; Y784-L788 HydrophobicContact CE1-CD1 3.63Å; Y784-L788 HydrophobicContact CE1-CD2 3.86Å; Y784-L788 HydrophobicContact CE1-CG 3.66Å; Y784-L788 WeakPolarHBondContact O-CB 3.44Å; Y784-L788 VanDerWaalsContact O-CG 3.29Å; Y784-L788 WeakPolarHBondContact O-CG 3.46Å; Y784-L788 PolarHBondContact O-N 3.06Å; D785-L788 PolarHBondContact O-N 2.96Å; L788-G927 WeakPolarHBondContact CD2-O 3.48Å; L788-I929 HydrophobicContact CD2-CG1 4.18Å; L788-R932 PolarHBondContact O-NH1 3.36Å
789	K	57.9	Low	53.7	Low	131 Å²	131	78.2 Å²	78.2	57%	0.57	38%	0.381	S	S	*	.	H	α-helix	trans	-77.1	-37	175.2	-69.4	164.1	-147.5	153.6	0	112.7	D785 D786 I787	D785-K789 WeakPolarHBondContact O-CB 3.49Å; D785-K789 WeakPolarHBondContact O-CD 3.47Å; D785-K789 WeakPolarHBondContact O-CE 3.29Å; D785-K789 WeakPolarHBondContact O-CG 3.28Å; D785-K789 PolarHBondContact O-N 2.97Å; D786-K789 PolarHBondContact O-N 3.49Å; D786-K789 IonicContact OD1-NZ 3.27Å; D786-K789 PolarHBondContact OD1-NZ 3.27Å; I787-K789 VanDerWaalsContact C-N 3.26Å; I787-K789 PolarHBondContact O-N 2.82Å
790	Q	60.6	Low	54.3	Low	84 Å²	84	76 Å²	76	39%	0.393	37%	0.37	S	S	.	.	H	α-helix	trans	-72.6	-18.2	173.3	-70.9	167.6	4.4	0	0	112.4	H414 D786 I787 E792	H414-Q790 PolarHBondContact CE1-NE2 2.98Å; H414-Q790 PolarHBondContact NE2-NE2 2.74Å; D786-Q790 VanDerWaalsContact O-CB 3.3Å; D786-Q790 WeakPolarHBondContact O-CB 3.44Å; D786-Q790 WeakPolarHBondContact O-CG 3.29Å; D786-Q790 PolarHBondContact O-N 2.82Å; I787-Q790 CarbonylContact O-C 3.5Å; I787-Q790 PolarHBondContact O-N 3.34Å; Q790-E792 PolarHBondContact O-N 3.14Å
791	Q	57.3	Low	55	Low	8 Å²	8	67.9 Å²	67.9	4%	0.037	34%	0.335	C	S	.	.	S	Bend	trans	-73.4	81.7	168.7	-152.1	95.7	3.6	0	0	108.8	I787 I793 R904 I929 R932	I787-Q791 WeakPolarHBondContact O-CB 3.46Å; I787-Q791 PolarHBondContact O-N 3.37Å; Q791-I793 PolarHBondContact O-N 2.87Å; Q791-R904 PolarHBondContact OE1-O 2.81Å; Q791-I929 VanDerWaalsContact NE2-CG2 3.33Å; Q791-I929 PolarHBondContact NE2-O 2.96Å; Q791-I929 VanDerWaalsContact NE2-O 3.15Å; Q791-R932 HydrophobicContact CB-CB 4.19Å; Q791-R932 HydrophobicContact CG-CB 3.65Å
792	E	54.7	Low	55.5	Low	109 Å²	109	65 Å²	65	51%	0.509	33%	0.329	S	S	.	.			trans	-50.6	134	166.5	-71	170.5	146.7	0	0	109.1	Q790 F794 R904	Q790-E792 PolarHBondContact O-N 3.14Å; E792-F794 VanDerWaalsContact C-N 3.3Å; E792-F794 PolarHBondContact O-N 3.15Å; E792-R904 IonicContact OE2-NH1 3.54Å
793	I	55.5	Low	56.3	Low	125 Å²	125	66.3 Å²	66.3	64%	0.641	34%	0.336	S	S	*	.			trans	-72.7	93.6	178.2	-59.2	174.4	0	0	0	106.4	Q791 C795	Q791-I793 PolarHBondContact O-N 2.87Å; I793-C795 HydrophobicContact CG2-CB 4.09Å; I793-C795 PolarHBondContact O-N 3.28Å
794	F	52.1	Low	56.5	Low	119 Å²	119	70.7 Å²	70.7	52%	0.522	35%	0.351	S	S	.	.			trans	-76.2	67.3	-176.1	-132.5	-85.7	0	0	0	110.2	E792 R932	E792-F794 VanDerWaalsContact C-N 3.3Å; E792-F794 PolarHBondContact O-N 3.15Å; F794-R932 PolarHBondContact N-O 3.16Å
795	C	52.8	Low	57	Low	37 Å²	37	74.6 Å²	74.6	25%	0.25	38%	0.377	C	S	.	.			trans	-142.6	77.6	-177.9	-70.6	0	0	0	0	110.6	I793 E797 R936	I793-C795 HydrophobicContact CG2-CB 4.09Å; I793-C795 PolarHBondContact O-N 3.28Å; C795-E797 PolarHBondContact O-N 3.12Å; C795-R936 PolarHBondContact SG-NH2 2.9Å
796	D	53.8	Low	57.4	Low	118 Å²	118	74 Å²	74	63%	0.631	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	15.8	164.8	-100.8	-34.6	0	0	0	113.7	L798 S799 L800	D796-L798 PolarHBondContact O-N 3.29Å; D796-S799 WeakPolarHBondContact CA-OG 3.37Å; D796-S799 WeakPolarHBondContact CB-OG 3.1Å; D796-S799 PolarHBondContact O-N 3.25Å; D796-S799 PolarHBondContact O-OG 2.84Å; D796-S799 PolarHBondContact OD1-OG 2.96Å; D796-L800 WeakPolarHBondContact O-CB 3.17Å; D796-L800 WeakPolarHBondContact O-CD1 3.29Å; D796-L800 VanDerWaalsContact O-CG 3.24Å; D796-L800 WeakPolarHBondContact O-CG 3.36Å; D796-L800 PolarHBondContact O-N 3.03Å
797	E	58.7	Low	58.1	Low	33 Å²	33	75.3 Å²	75.3	15%	0.154	38%	0.379	C	S	.	.	H	α-helix	trans	-57	-37.4	173.7	-67	-168.4	153.8	0	0	111.1	C795 L800 F801 S831 L832	C795-E797 PolarHBondContact O-N 3.12Å; E797-L800 PolarHBondContact O-N 2.92Å; E797-F801 HydrophobicContact CB-CE2 4.2Å; E797-F801 WeakPolarHBondContact O-CD2 3.26Å; E797-F801 PolarHBondContact O-N 2.78Å; E797-F801 VanDerWaalsContact O-N 3.11Å; E797-S831 PolarHBondContact OE1-OG 3.04Å; E797-S831 WeakPolarHBondContact OE2-CA 3.44Å; E797-L832 PolarHBondContact OE2-N 2.91Å
798	L	54.6	Low	59.4	Low	80 Å²	80	78.6 Å²	78.6	42%	0.419	39%	0.393	S	S	.	.	H	α-helix	trans	-64.4	-46	177.3	-92.5	167.7	0	0	0	113.8	D796 L800 F801 C802 L832	D796-L798 PolarHBondContact O-N 3.29Å; L798-L800 VanDerWaalsContact C-N 3.34Å; L798-F801 PolarHBondContact O-N 3.43Å; L798-C802 VanDerWaalsContact O-CB 3.3Å; L798-C802 WeakPolarHBondContact O-CB 3.19Å; L798-C802 PolarHBondContact O-N 3.39Å; L798-C802 PolarHBondContact O-SG 2.77Å; L798-C802 VanDerWaalsContact O-SG 3.35Å; L798-L832 HydrophobicContact CD1-CD2 3.57Å; L798-L832 HydrophobicContact CD2-CD2 3.45Å; L798-L832 VanDerWaalsContact CD2-CD2 3.45Å; L798-L832 HydrophobicContact CG-CD2 3.3Å
799	S	55.5	Low	60.8	Low	20 Å²	20	82.9 Å²	82.9	14%	0.14	41%	0.413	C	S	.	.	H	α-helix	trans	-65	-41.1	177.8	49.1	0	0	0	0	110.3	D796 F801 C802 D803	D796-S799 WeakPolarHBondContact CA-OG 3.37Å; D796-S799 WeakPolarHBondContact CB-OG 3.1Å; D796-S799 PolarHBondContact O-N 3.25Å; D796-S799 PolarHBondContact O-OG 2.84Å; D796-S799 PolarHBondContact OD1-OG 2.96Å; S799-F801 PolarHBondContact O-N 2.6Å; S799-C802 PolarHBondContact O-N 2.83Å; S799-D803 WeakPolarHBondContact O-CB 3.29Å; S799-D803 PolarHBondContact O-N 2.72Å
800	L	58.3	Low	62.4	Low	53 Å²	53	76.6 Å²	76.6	28%	0.277	39%	0.386	S	S	.	.	H	α-helix	trans	-56.3	-32.9	172.4	-71.8	166.6	0	0	0	113.7	D796 E797 L798 I893	D796-L800 WeakPolarHBondContact O-CB 3.17Å; D796-L800 WeakPolarHBondContact O-CD1 3.29Å; D796-L800 VanDerWaalsContact O-CG 3.24Å; D796-L800 WeakPolarHBondContact O-CG 3.36Å; D796-L800 PolarHBondContact O-N 3.03Å; E797-L800 PolarHBondContact O-N 2.92Å; L798-L800 VanDerWaalsContact C-N 3.34Å; L800-I893 HydrophobicContact CB-CG2 4.42Å
801	F	58.7	Low	63.8	Low	21 Å²	21	75.7 Å²	75.7	9%	0.092	39%	0.386	C	S	.	.	H	α-helix	trans	-87.8	-35.1	174.6	-65.7	-63.2	0	0	0	114.2	E797 L798 S799 H807 L833 T835 I893	E797-F801 HydrophobicContact CB-CE2 4.2Å; E797-F801 WeakPolarHBondContact O-CD2 3.26Å; E797-F801 PolarHBondContact O-N 2.78Å; E797-F801 VanDerWaalsContact O-N 3.11Å; L798-F801 PolarHBondContact O-N 3.43Å; S799-F801 PolarHBondContact O-N 2.6Å; F801-H807 PolarHBondContact O-NE2 3.38Å; F801-L833 HydrophobicContact CB-CD1 3.8Å; F801-L833 HydrophobicContact CD1-CD1 3.67Å; F801-L833 HydrophobicContact CD1-CG 4.44Å; F801-L833 HydrophobicContact CD2-CB 4.13Å; F801-L833 HydrophobicContact CD2-CD1 3.63Å; F801-L833 HydrophobicContact CD2-CG 3.71Å; F801-L833 HydrophobicContact CE1-CB 4.23Å; F801-L833 HydrophobicContact CE1-CD1 4.16Å; F801-L833 HydrophobicContact CE2-CB 3.78Å; F801-L833 HydrophobicContact CE2-CD1 4.13Å; F801-L833 HydrophobicContact CE2-CG 3.88Å; F801-L833 HydrophobicContact CG-CD1 3.43Å; F801-L833 VanDerWaalsContact CG-CD1 3.43Å; F801-L833 HydrophobicContact CG-CG 4.06Å; F801-L833 HydrophobicContact CZ-CB 3.84Å; F801-L833 HydrophobicContact CZ-CD1 4.38Å; F801-L833 HydrophobicContact CZ-CG 4.33Å; F801-T835 HydrophobicContact CE1-CG2 3.84Å; F801-T835 HydrophobicContact CZ-CG2 4.12Å; F801-I893 HydrophobicContact CD1-CD1 3.25Å; F801-I893 HydrophobicContact CE1-CD1 3.73Å; F801-I893 HydrophobicContact CG-CD1 4.24Å
802	C	55.6	Low	65.4	Low	78 Å²	78	75.3 Å²	75.3	53%	0.527	38%	0.384	S	S	.	.	H	α-helix	trans	-80.3	-33.9	-175.1	-73.7	0	0	0	0	113.6	L798 S799 K804	L798-C802 VanDerWaalsContact O-CB 3.3Å; L798-C802 WeakPolarHBondContact O-CB 3.19Å; L798-C802 PolarHBondContact O-N 3.39Å; L798-C802 PolarHBondContact O-SG 2.77Å; L798-C802 VanDerWaalsContact O-SG 3.35Å; S799-C802 PolarHBondContact O-N 2.83Å; C802-K804 PolarHBondContact O-N 3.4Å
803	D	61.3	Low	67	Low	81 Å²	81	73.8 Å²	73.8	43%	0.433	38%	0.384	S	S	.	.			trans	-75.9	107.7	-177.7	-71.7	-25.4	0	0	0	110.9	S799 D805 N806 H807	S799-D803 WeakPolarHBondContact O-CB 3.29Å; S799-D803 PolarHBondContact O-N 2.72Å; D803-D805 PolarHBondContact O-N 3Å; D803-N806 PolarHBondContact O-N 3.28Å; D803-H807 PolarHBondContact O-CD2 2.78Å; D803-H807 VanDerWaalsContact O-CD2 3.26Å
804	K	58	Low	68.7	Low	184 Å²	184	68.5 Å²	68.5	80%	0.8	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-54.6	-26.4	179.4	-72	-174.8	177	179.3	0	113.5	C802 N806 H807	C802-K804 PolarHBondContact O-N 3.4Å; K804-N806 VanDerWaalsContact C-N 3.29Å; K804-N806 PolarHBondContact O-N 2.85Å; K804-H807 PolarHBondContact O-N 3.34Å
805	D	60.2	Low	70.4	Confident	161 Å²	161	69.4 Å²	69.4	86%	0.861	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-72.1	-19.9	179.4	-60.5	-37.1	0	0	0	113.2	D803	D803-D805 PolarHBondContact O-N 3Å
806	N	66.1	Low	71.9	Confident	67 Å²	67	75.8 Å²	75.8	36%	0.358	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-83.8	-10.1	174	-71.9	-37	0	0	0	113.4	D803 K804 K808	D803-N806 PolarHBondContact O-N 3.28Å; K804-N806 VanDerWaalsContact C-N 3.29Å; K804-N806 PolarHBondContact O-N 2.85Å; N806-K808 PolarHBondContact O-N 3.43Å
807	H	75.1	Confident	73.3	Confident	48 Å²	48	71.8 Å²	71.8	22%	0.222	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	109.6	177.3	-66.3	-105.5	0	0	0	110.4	F801 D803 K804 M891	F801-H807 PolarHBondContact O-NE2 3.38Å; D803-H807 PolarHBondContact O-CD2 2.78Å; D803-H807 VanDerWaalsContact O-CD2 3.26Å; K804-H807 PolarHBondContact O-N 3.34Å; H807-M891 HydrophobicContact CB-CE 4.47Å
808	K	83.7	Confident	74.7	Confident	78 Å²	78	72.6 Å²	72.6	34%	0.339	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	113.8	175.5	-176.8	-174.8	-179.4	-173.3	0	109.7	N806 V810 Q852 I892	N806-K808 PolarHBondContact O-N 3.43Å; K808-V810 HydrophobicContact CD-CG2 4.02Å; K808-V810 HydrophobicContact CG-CG2 3.9Å; K808-V810 PolarHBondContact O-N 3.28Å; K808-Q852 PolarHBondContact NZ-O 2.84Å; K808-I892 HydrophobicContact CB-CG1 4.09Å; K808-I892 HydrophobicContact CD-CD1 4.24Å; K808-I892 PolarHBondContact N-O 2.85Å; K808-I892 VanDerWaalsContact O-CG1 3.28Å; K808-I892 WeakPolarHBondContact O-CG1 3.15Å; K808-I892 PolarHBondContact O-N 3Å
809	E	87	Confident	76.3	Confident	105 Å²	105	71.3 Å²	71.3	49%	0.491	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	114	169.4	-166.9	-174.6	-176.9	0	0	110	K889 L890	E809-K889 VanDerWaalsContact OE1-CD 3.29Å; E809-K889 WeakPolarHBondContact OE1-CD 3.34Å; E809-K889 WeakPolarHBondContact OE1-CE 3.47Å; E809-K889 WeakPolarHBondContact OE1-CG 3.37Å; E809-K889 IonicContact OE1-NZ 3.25Å; E809-K889 PolarHBondContact OE1-NZ 3.49Å; E809-K889 IonicContact OE2-NZ 3.91Å; E809-L890 CarbonylContact C-O 3.59Å; E809-L890 WeakPolarHBondContact CA-O 3.27Å
810	V	90	Very high	77.9	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	119.4	179.2	179.4	0	0	0	0	109.7	K808 I812 C850 Q852 L853 L890 I892	K808-V810 HydrophobicContact CD-CG2 4.02Å; K808-V810 HydrophobicContact CG-CG2 3.9Å; K808-V810 PolarHBondContact O-N 3.28Å; V810-I812 HydrophobicContact CG1-CD1 4.43Å; V810-I812 HydrophobicContact CG1-CG1 3.92Å; V810-C850 VanDerWaalsContact CG1-SG 3.55Å; V810-Q852 HydrophobicContact CG1-CB 3.77Å; V810-Q852 HydrophobicContact CG2-CB 4.05Å; V810-L853 HydrophobicContact CB-CD2 4.24Å; V810-L853 HydrophobicContact CG1-CD2 4.13Å; V810-L853 HydrophobicContact CG1-CG 4.35Å; V810-L853 HydrophobicContact CG2-CD2 4.17Å; V810-L890 PolarHBondContact N-O 3.17Å; V810-L890 PolarHBondContact O-N 3.32Å; V810-I892 HydrophobicContact CG2-CD1 3.92Å; V810-I892 HydrophobicContact CG2-CG1 3.9Å
811	T	90.7	Very high	79.4	Confident	64 Å²	64	68 Å²	68	39%	0.393	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	113.3	176.2	-62.3	0	0	0	0	110.4	I887	T811-I887 HydrophobicContact CG2-CG2 3.47Å; T811-I887 VanDerWaalsContact CG2-CG2 3.47Å
812	I	90.6	Very high	80.9	Confident	0 Å²	0	67 Å²	67	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	114.3	-175.4	-56	174.2	0	0	0	109.9	V810 L820 P846 C850 L853 I887 V888 L890	V810-I812 HydrophobicContact CG1-CD1 4.43Å; V810-I812 HydrophobicContact CG1-CG1 3.92Å; I812-L820 HydrophobicContact CB-CD1 4.43Å; I812-L820 HydrophobicContact CD1-CD1 3.97Å; I812-L820 HydrophobicContact CG2-CD1 3.91Å; I812-P846 HydrophobicContact CG2-CB 3.89Å; I812-C850 HydrophobicContact CG1-CB 4.17Å; I812-C850 HydrophobicContact CG2-CB 4.4Å; I812-L853 HydrophobicContact CD1-CD1 3.64Å; I812-L853 HydrophobicContact CD1-CG 4.35Å; I812-I887 WeakPolarHBondContact O-CA 3.4Å; I812-V888 PolarHBondContact N-O 2.87Å; I812-V888 PolarHBondContact O-N 2.77Å; I812-L890 HydrophobicContact CD1-CD1 3.51Å; I812-L890 HydrophobicContact CD1-CG 4.05Å
813	P	89.5	Confident	82.6	Confident	78 Å²	78	64 Å²	64	51%	0.506	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	136.1	172.7	31.7	-33	0	0	0	110.8
814	K	89.7	Confident	84	Confident	14 Å²	14	60.4 Å²	60.4	6%	0.061	31%	0.311	C	S	.	.			trans	-144.2	153.4	-174.4	-171	170	74	168.1	0	112.7	E818 P846 C882 S885 T886	K814-E818 HydrophobicContact CD-CB 4.04Å; K814-E818 WeakPolarHBondContact CD-O 3.37Å; K814-E818 WeakPolarHBondContact CE-O 3.47Å; K814-E818 HydrophobicContact CG-CB 3.78Å; K814-E818 HydrophobicContact CG-CG 4.27Å; K814-E818 WeakPolarHBondContact CG-OE2 3.33Å; K814-E818 PolarHBondContact NZ-O 3.15Å; K814-P846 HydrophobicContact CB-CB 4.23Å; K814-P846 HydrophobicContact CB-CG 4.29Å; K814-P846 HydrophobicContact CD-CB 4.16Å; K814-P846 HydrophobicContact CD-CG 3.73Å; K814-P846 HydrophobicContact CG-CB 4.04Å; K814-P846 HydrophobicContact CG-CG 3.59Å; K814-C882 WeakPolarHBondContact CE-O 3.35Å; K814-C882 PolarHBondContact NZ-O 2.84Å; K814-S885 WeakPolarHBondContact CE-O 3.43Å; K814-T886 PolarHBondContact N-O 3Å; K814-T886 CarbonylContact O-C 3.54Å; K814-T886 VanDerWaalsContact O-CA 3.29Å; K814-T886 WeakPolarHBondContact O-CA 3.29Å; K814-T886 VanDerWaalsContact O-O 3.06Å
815	Q	87.8	Confident	85.4	Confident	137 Å²	137	52.6 Å²	52.6	64%	0.64	28%	0.279	S	S	*	.			trans	-81.1	146.3	170.9	-57.5	-173.6	6.9	0	0	111.9	G817 E818	Q815-G817 PolarHBondContact O-N 2.88Å; Q815-G817 VanDerWaalsContact O-N 3.16Å; Q815-E818 HydrophobicContact CB-CB 4.27Å; Q815-E818 WeakPolarHBondContact CB-OE2 3.01Å; Q815-E818 PolarHBondContact N-OE2 3.13Å; Q815-E818 WeakPolarHBondContact O-CB 3.23Å; Q815-E818 PolarHBondContact O-N 2.88Å; Q815-E818 VanDerWaalsContact O-N 3.11Å
816	K	85.8	Confident	86.5	Confident	171 Å²	171	50.3 Å²	50.3	74%	0.743	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	120.5	176.1	-64.2	-172.3	178.4	-177.9	0	109.8	T886	K816-T886 HydrophobicContact CD-CG2 4.17Å; K816-T886 HydrophobicContact CG-CG2 3.44Å; K816-T886 VanDerWaalsContact CG-CG2 3.44Å
817	G	82.6	Confident	86.8	Confident	35 Å²	35	47.5 Å²	47.5	36%	0.361	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.7	-6.5	-179.8	0	0	0	0	0	115.5	Q815 R883	Q815-G817 PolarHBondContact O-N 2.88Å; Q815-G817 VanDerWaalsContact O-N 3.16Å; G817-R883 WeakPolarHBondContact CA-O 3.23Å; G817-R883 PolarHBondContact N-O 3.08Å; G817-R883 PolarHBondContact O-NE 3.23Å; G817-R883 PolarHBondContact O-NH2 2.9Å
818	E	88.8	Confident	86.3	Confident	50 Å²	50	47 Å²	47	23%	0.234	26%	0.255	C	S	.	.			trans	-77.6	142.2	173.5	-163.4	179.4	-173.3	0	0	110.2	K814 Q815 P846 R849	K814-E818 HydrophobicContact CD-CB 4.04Å; K814-E818 WeakPolarHBondContact CD-O 3.37Å; K814-E818 WeakPolarHBondContact CE-O 3.47Å; K814-E818 HydrophobicContact CG-CB 3.78Å; K814-E818 HydrophobicContact CG-CG 4.27Å; K814-E818 WeakPolarHBondContact CG-OE2 3.33Å; K814-E818 PolarHBondContact NZ-O 3.15Å; Q815-E818 HydrophobicContact CB-CB 4.27Å; Q815-E818 WeakPolarHBondContact CB-OE2 3.01Å; Q815-E818 PolarHBondContact N-OE2 3.13Å; Q815-E818 WeakPolarHBondContact O-CB 3.23Å; Q815-E818 PolarHBondContact O-N 2.88Å; Q815-E818 VanDerWaalsContact O-N 3.11Å; E818-P846 HydrophobicContact CG-CG 3.85Å; E818-P846 WeakPolarHBondContact OE1-CD 3.45Å; E818-P846 WeakPolarHBondContact OE1-CG 2.85Å; E818-R849 IonicContact OE1-NH1 2.79Å
819	S	87.4	Confident	85	Confident	53 Å²	53	53.3 Å²	53.3	37%	0.371	28%	0.277	S	S	.	.			trans	-71.3	158.9	168.7	37.7	0	0	0	0	110.3	G821 P846 I990	S819-G821 PolarHBondContact O-N 3.16Å; S819-P846 WeakPolarHBondContact O-CD 3.5Å; S819-P846 WeakPolarHBondContact O-CG 3.46Å; S819-I990 WeakPolarHBondContact CB-OXT 3.41Å
820	L	89	Confident	83.6	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.005	27%	0.274	C	S	.	.			trans	-70.6	-28.4	178.2	-174.6	59	0	0	0	111.3	I812 V822 P846 A847 I879 L890 I990	I812-L820 HydrophobicContact CB-CD1 4.43Å; I812-L820 HydrophobicContact CD1-CD1 3.97Å; I812-L820 HydrophobicContact CG2-CD1 3.91Å; L820-V822 HydrophobicContact CB-CG2 4.28Å; L820-V822 HydrophobicContact CD2-CG1 4.28Å; L820-V822 HydrophobicContact CD2-CG2 3.94Å; L820-V822 HydrophobicContact CG-CG1 4.11Å; L820-V822 HydrophobicContact CG-CG2 4.2Å; L820-P846 HydrophobicContact CD1-CB 4.44Å; L820-P846 WeakPolarHBondContact O-CD 3.49Å; L820-A847 HydrophobicContact CD1-CB 4.46Å; L820-A847 HydrophobicContact CG-CB 4.33Å; L820-A847 VanDerWaalsContact O-CB 3.3Å; L820-A847 WeakPolarHBondContact O-CB 3.49Å; L820-A847 PolarHBondContact O-N 3.24Å; L820-A847 VanDerWaalsContact O-N 3.09Å; L820-I879 HydrophobicContact CB-CG2 4.19Å; L820-I879 HydrophobicContact CD2-CG2 3.93Å; L820-L890 HydrophobicContact CD2-CD1 4.43Å; L820-I990 CarbonylContact C-O 3.53Å; L820-I990 PolarHBondContact N-O 3.41Å; L820-I990 PolarHBondContact N-OXT 2.87Å
821	G	89.4	Confident	82.3	Confident	2 Å²	2	51.2 Å²	51.2	2%	0.021	28%	0.281	C	S	.	.			trans	84.6	33.7	178.5	0	0	0	0	0	112.3	S819 M841 H842 I990	S819-G821 PolarHBondContact O-N 3.16Å; G821-M841 CarbonylContact O-C 3.55Å; G821-M841 WeakPolarHBondContact O-CA 3.4Å; G821-H842 PolarHBondContact O-N 3.3Å; G821-I990 PolarHBondContact N-O 2.78Å
822	V	91.3	Very high	80.9	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.006	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	160.1	-178.9	-64.8	0	0	0	0	111.7	L820 L838 A847 I879 Y989 I990	L820-V822 HydrophobicContact CB-CG2 4.28Å; L820-V822 HydrophobicContact CD2-CG1 4.28Å; L820-V822 HydrophobicContact CD2-CG2 3.94Å; L820-V822 HydrophobicContact CG-CG1 4.11Å; L820-V822 HydrophobicContact CG-CG2 4.2Å; V822-L838 HydrophobicContact CB-CD1 3.64Å; V822-L838 HydrophobicContact CG1-CD1 3.74Å; V822-A847 HydrophobicContact CG1-CB 3.46Å; V822-A847 VanDerWaalsContact CG1-CB 3.46Å; V822-I879 HydrophobicContact CG2-CG2 4.16Å; V822-Y989 WeakPolarHBondContact O-CA 3.31Å; V822-I990 HydrophobicContact CG2-CD1 4.35Å; V822-I990 HydrophobicContact CG2-CG1 3.81Å; V822-I990 PolarHBondContact N-O 3.1Å; V822-I990 WeakPolarHBondContact O-CG1 3.43Å; V822-I990 PolarHBondContact O-N 2.59Å
823	V	90.8	Very high	79.8	Confident	15 Å²	15	55.8 Å²	55.8	9%	0.091	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	115.4	167.3	-175.6	0	0	0	0	107.4	A839 N840 L980 P987 Y989	V823-A839 PolarHBondContact O-N 3.19Å; V823-N840 HydrophobicContact CB-CB 4Å; V823-N840 HydrophobicContact CG2-CB 4.02Å; V823-N840 PolarHBondContact N-O 3.46Å; V823-N840 PolarHBondContact O-N 2.92Å; V823-L980 HydrophobicContact CG1-CD1 4.09Å; V823-P987 HydrophobicContact CG2-CB 3.84Å; V823-Y989 HydrophobicContact CG2-CD1 3.6Å; V823-Y989 HydrophobicContact CG2-CE1 3.86Å; V823-Y989 HydrophobicContact CG2-CG 4.3Å
824	I	90.3	Very high	79	Confident	5 Å²	5	55.8 Å²	55.8	3%	0.026	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	143.9	175.3	60.1	161.4	0	0	0	111.3	A836 L837 I859 L872 C875 Q876 I879 I990	I824-A836 HydrophobicContact CB-CB 4.35Å; I824-A836 HydrophobicContact CD1-CB 4.06Å; I824-L837 WeakPolarHBondContact CA-O 3.36Å; I824-I859 HydrophobicContact CG2-CD1 3.87Å; I824-L872 HydrophobicContact CB-CD1 4.46Å; I824-L872 HydrophobicContact CD1-CD1 3.82Å; I824-L872 HydrophobicContact CG1-CD1 3.89Å; I824-C875 HydrophobicContact CD1-CB 3.66Å; I824-Q876 HydrophobicContact CD1-CG 3.8Å; I824-Q876 HydrophobicContact CG1-CG 3.83Å; I824-I879 HydrophobicContact CD1-CD1 3.85Å; I824-I879 HydrophobicContact CG1-CD1 4.42Å; I824-I879 HydrophobicContact CG2-CD1 4.02Å; I824-I990 HydrophobicContact CD1-CD1 4.41Å; I824-I990 HydrophobicContact CG1-CD1 4Å
825	V	87.3	Confident	78.3	Confident	20 Å²	20	55.5 Å²	55.5	12%	0.121	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	163.3	171.3	-59.4	0	0	0	0	109	A836 L837 A839 V977 L980	V825-A836 CarbonylContact O-C 3.55Å; V825-L837 HydrophobicContact CG2-CB 4.07Å; V825-L837 HydrophobicContact CG2-CD2 3.78Å; V825-L837 PolarHBondContact N-O 3.44Å; V825-L837 PolarHBondContact O-N 3.26Å; V825-A839 HydrophobicContact CB-CB 4.4Å; V825-A839 HydrophobicContact CG1-CB 3.69Å; V825-A839 HydrophobicContact CG2-CB 3.88Å; V825-V977 HydrophobicContact CG2-CG2 4.25Å; V825-L980 HydrophobicContact CG1-CD1 4.35Å
826	E	83.1	Confident	78.3	Confident	113 Å²	113	49.1 Å²	49.1	53%	0.528	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	143.6	168.5	-62.1	176.5	152.3	0	0	108.5	G828 L872	E826-G828 PolarHBondContact O-N 3.41Å; E826-L872 HydrophobicContact CG-CB 3.6Å; E826-L872 HydrophobicContact CG-CD1 4.17Å; E826-L872 HydrophobicContact CG-CD2 4.18Å; E826-L872 HydrophobicContact CG-CG 4.19Å; E826-L872 VanDerWaalsContact OE1-CB 3.24Å; E826-L872 WeakPolarHBondContact OE1-CB 3.32Å; E826-L872 PolarHBondContact OE1-N 3.12Å; E826-L872 VanDerWaalsContact OE1-N 3.12Å
827	S	72.9	Confident	78.4	Confident	8 Å²	8	41.5 Å²	41.5	6%	0.056	24%	0.239	C	C	.	.			trans	-67.6	16.2	-176.8	-59	0	0	0	0	115.5	S831 T835	S827-S831 PolarHBondContact O-OG 3.35Å; S827-T835 PolarHBondContact N-O 2.93Å; S827-T835 PolarHBondContact OG-O 3.3Å; S827-T835 VanDerWaalsContact OG-O 3.08Å; S827-T835 PolarHBondContact OG-OG1 2.8Å
828	G	65.3	Low	78.7	Confident	36 Å²	36	39.9 Å²	39.9	37%	0.371	22%	0.222	S	C	.	.			trans	77.4	169.2	-177.9	0	0	0	0	0	113.5	E826	E826-G828 PolarHBondContact O-N 3.41Å
829	W	56.6	Low	78.6	Confident	211 Å²	211	37.5 Å²	37.5	80%	0.799	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.1	129	175	-78.3	90.3	0	0	0	110.4	R936	W829-R936 WeakPolarHBondContact O-CD 3.49Å
830	G	55.8	Low	78.7	Confident	40 Å²	40	36 Å²	36	41%	0.412	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	92.3	5.4	179.1	0	0	0	0	0	115.1	R936	G830-R936 VanDerWaalsContact C-NE 3.32Å; G830-R936 PolarHBondContact O-NE 3.36Å; G830-R936 PolarHBondContact O-NH2 3.2Å; G830-R936 VanDerWaalsContact O-NH2 3.14Å
831	S	63.5	Low	78.7	Confident	21 Å²	21	37.6 Å²	37.6	15%	0.147	21%	0.207	C	C	.	.			trans	-66.9	131.1	148.9	-81.3	0	0	0	0	108.6	E797 S827 L833	E797-S831 PolarHBondContact OE1-OG 3.04Å; E797-S831 WeakPolarHBondContact OE2-CA 3.44Å; S827-S831 PolarHBondContact O-OG 3.35Å; S831-L833 VanDerWaalsContact C-N 3.29Å; S831-L833 PolarHBondContact O-N 2.89Å
832	L	60.8	Low	78.8	Confident	104 Å²	104	40.7 Å²	40.7	55%	0.545	22%	0.221	S	C	.	.	S	Bend	trans	-65.4	-34	-171.3	-163.9	78.5	0	0	0	112.7	E797 L798	E797-L832 PolarHBondContact OE2-N 2.91Å; L798-L832 HydrophobicContact CD1-CD2 3.57Å; L798-L832 HydrophobicContact CD2-CD2 3.45Å; L798-L832 VanDerWaalsContact CD2-CD2 3.45Å; L798-L832 HydrophobicContact CG-CD2 3.3Å
833	L	67.5	Low	78.6	Confident	56 Å²	56	45.4 Å²	45.4	29%	0.293	25%	0.251	S	S	.	.	S	Bend	trans	-104.8	125.8	170.8	-62.2	-170.6	0	0	0	110.5	F801 S831 T835 V868	F801-L833 HydrophobicContact CB-CD1 3.8Å; F801-L833 HydrophobicContact CD1-CD1 3.67Å; F801-L833 HydrophobicContact CD1-CG 4.44Å; F801-L833 HydrophobicContact CD2-CB 4.13Å; F801-L833 HydrophobicContact CD2-CD1 3.63Å; F801-L833 HydrophobicContact CD2-CG 3.71Å; F801-L833 HydrophobicContact CE1-CB 4.23Å; F801-L833 HydrophobicContact CE1-CD1 4.16Å; F801-L833 HydrophobicContact CE2-CB 3.78Å; F801-L833 HydrophobicContact CE2-CD1 4.13Å; F801-L833 HydrophobicContact CE2-CG 3.88Å; F801-L833 HydrophobicContact CG-CD1 3.43Å; F801-L833 VanDerWaalsContact CG-CD1 3.43Å; F801-L833 HydrophobicContact CG-CG 4.06Å; F801-L833 HydrophobicContact CZ-CB 3.84Å; F801-L833 HydrophobicContact CZ-CD1 4.38Å; F801-L833 HydrophobicContact CZ-CG 4.33Å; S831-L833 VanDerWaalsContact C-N 3.29Å; S831-L833 PolarHBondContact O-N 2.89Å; L833-T835 HydrophobicContact CB-CG2 3.92Å; L833-T835 PolarHBondContact O-N 3.03Å; L833-V868 HydrophobicContact CB-CG1 4.06Å; L833-V868 HydrophobicContact CD1-CG1 4.22Å; L833-V868 HydrophobicContact CD2-CG1 4.45Å; L833-V868 HydrophobicContact CG-CG1 4.49Å
834	P	72.9	Confident	78.5	Confident	79 Å²	79	49.4 Å²	49.4	51%	0.513	28%	0.276	S	S	.	.			trans	-70.5	94.9	171.2	28	-33.8	0	0	0	109.7	V868 G869	P834-V868 WeakPolarHBondContact O-CA 3.14Å; P834-G869 PolarHBondContact O-N 3.21Å
835	T	76.6	Confident	78.4	Confident	8 Å²	8	49.4 Å²	49.4	5%	0.049	28%	0.277	C	S	.	.			trans	-112.7	173	-179.7	60.8	0	0	0	0	111.8	F801 S827 L833 Q858 V868	F801-T835 HydrophobicContact CE1-CG2 3.84Å; F801-T835 HydrophobicContact CZ-CG2 4.12Å; S827-T835 PolarHBondContact N-O 2.93Å; S827-T835 PolarHBondContact OG-O 3.3Å; S827-T835 VanDerWaalsContact OG-O 3.08Å; S827-T835 PolarHBondContact OG-OG1 2.8Å; L833-T835 HydrophobicContact CB-CG2 3.92Å; L833-T835 PolarHBondContact O-N 3.03Å; T835-Q858 PolarHBondContact OG1-OE1 3.27Å; T835-V868 HydrophobicContact CG2-CG1 4.47Å; T835-V868 HydrophobicContact CG2-CG2 4.19Å
836	A	86.4	Confident	78.6	Confident	2 Å²	2	48.6 Å²	48.6	2%	0.017	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	115.1	173.6	0	0	0	0	0	110.4	I824 V825 I859 L867 C875	I824-A836 HydrophobicContact CB-CB 4.35Å; I824-A836 HydrophobicContact CD1-CB 4.06Å; V825-A836 CarbonylContact O-C 3.55Å; A836-I859 PolarHBondContact O-N 3.25Å; A836-L867 HydrophobicContact CB-CD1 3.96Å; A836-C875 HydrophobicContact CB-CB 4.44Å
837	L	87.5	Confident	78.9	Confident	12 Å²	12	43.2 Å²	43.2	6%	0.063	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	133.3	-179.8	-177.1	140.4	0	0	0	111.5	I824 V825 A839 Q858 V977	I824-L837 WeakPolarHBondContact CA-O 3.36Å; V825-L837 HydrophobicContact CG2-CB 4.07Å; V825-L837 HydrophobicContact CG2-CD2 3.78Å; V825-L837 PolarHBondContact N-O 3.44Å; V825-L837 PolarHBondContact O-N 3.26Å; L837-A839 HydrophobicContact CD2-CB 4.45Å; L837-A839 PolarHBondContact O-N 3.04Å; L837-A839 VanDerWaalsContact O-N 3.17Å; L837-Q858 HydrophobicContact CD1-CG 4.3Å; L837-V977 HydrophobicContact CD2-CG2 3.49Å; L837-V977 VanDerWaalsContact CD2-CG2 3.49Å
838	L	89.5	Confident	79.7	Confident	0 Å²	0	44 Å²	44	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	96.5	177.9	-179.5	57.9	0	0	0	110.6	V822 N840 L853 G856 N857	V822-L838 HydrophobicContact CB-CD1 3.64Å; V822-L838 HydrophobicContact CG1-CD1 3.74Å; L838-N840 WeakPolarHBondContact CD1-O 3.3Å; L838-L853 HydrophobicContact CD2-CB 4.07Å; L838-L853 HydrophobicContact CD2-CD1 4.3Å; L838-G856 PolarHBondContact O-N 2.85Å; L838-N857 VanDerWaalsContact CB-O 3.27Å; L838-N857 WeakPolarHBondContact CB-O 3.38Å; L838-N857 PolarHBondContact N-O 2.93Å
839	A	87.5	Confident	80.9	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	-29.7	-174.1	0	0	0	0	0	114.4	V823 V825 L837 I855 V977 L980	V823-A839 PolarHBondContact O-N 3.19Å; V825-A839 HydrophobicContact CB-CB 4.4Å; V825-A839 HydrophobicContact CG1-CB 3.69Å; V825-A839 HydrophobicContact CG2-CB 3.88Å; L837-A839 HydrophobicContact CD2-CB 4.45Å; L837-A839 PolarHBondContact O-N 3.04Å; L837-A839 VanDerWaalsContact O-N 3.17Å; A839-I855 WeakPolarHBondContact O-CG2 3.27Å; A839-V977 HydrophobicContact CB-CB 4.46Å; A839-V977 HydrophobicContact CB-CG1 4.32Å; A839-V977 HydrophobicContact CB-CG2 3.91Å; A839-L980 HydrophobicContact CB-CD1 3.6Å
840	N	88.9	Confident	82.4	Confident	23 Å²	23	40.4 Å²	40.4	12%	0.123	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	160.7	177	-156.6	-17.8	0	0	0	110.5	V823 L838 P987	V823-N840 HydrophobicContact CB-CB 4Å; V823-N840 HydrophobicContact CG2-CB 4.02Å; V823-N840 PolarHBondContact N-O 3.46Å; V823-N840 PolarHBondContact O-N 2.92Å; L838-N840 WeakPolarHBondContact CD1-O 3.3Å; N840-P987 HydrophobicContact CB-CB 4.44Å
841	M	89.6	Confident	83.8	Confident	34 Å²	34	41.4 Å²	41.4	17%	0.167	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	135.9	-176.1	-171.8	168	59.8	0	0	110.3	G821 A847 A848 L853	G821-M841 CarbonylContact O-C 3.55Å; G821-M841 WeakPolarHBondContact O-CA 3.4Å; M841-A847 HydrophobicContact CG-CB 3.8Å; M841-A847 HydrophobicContact SD-CB 3.5Å; M841-A847 WeakPolarHBondContact SD-CB 3.24Å; M841-A848 HydrophobicContact CE-CB 3.95Å; M841-A848 HydrophobicContact CG-CB 4.09Å; M841-A848 HydrophobicContact SD-CB 4.16Å; M841-A848 PolarHBondContact SD-N 2.84Å; M841-L853 HydrophobicContact SD-CB 4.11Å; M841-L853 HydrophobicContact SD-CD1 4.37Å
842	H	90.1	Very high	84.9	Confident	66 Å²	66	44.5 Å²	44.5	31%	0.306	26%	0.255	S	S	.	.			trans	-72.7	125	-179	-168.4	-102.1	0	0	0	109.4	G821 T844 G845 A848 Y989	G821-H842 PolarHBondContact O-N 3.3Å; H842-T844 PolarHBondContact CE1-OG1 2.94Å; H842-T844 PolarHBondContact ND1-OG1 3.26Å; H842-T844 VanDerWaalsContact ND1-OG1 3.08Å; H842-T844 PolarHBondContact O-N 3.46Å; H842-T844 VanDerWaalsContact O-N 3.12Å; H842-G845 PolarHBondContact O-N 2.96Å; H842-A848 WeakPolarHBondContact O-CB 3.28Å; H842-Y989 HydrophobicContact CB-CD1 3.7Å; H842-Y989 HydrophobicContact CB-CD2 4.36Å; H842-Y989 HydrophobicContact CB-CE1 3.77Å; H842-Y989 HydrophobicContact CB-CE2 4.43Å; H842-Y989 HydrophobicContact CB-CG 4Å; H842-Y989 AromaticContact CD2-CD2 3.76Å; H842-Y989 AromaticContact CD2-CE2 3.53Å; H842-Y989 AromaticContact CD2-CZ 3.82Å; H842-Y989 VanDerWaalsContact N-CE1 3.28Å
843	P	87.4	Confident	86.2	Confident	100 Å²	100	39.8 Å²	39.8	65%	0.649	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-25.8	-171	22.9	-33.9	0	0	0	113.9	A848	P843-A848 WeakPolarHBondContact O-CB 3.41Å
844	T	88.8	Confident	87.2	Confident	99 Å²	99	41.8 Å²	41.8	61%	0.607	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.2	0.4	174.4	79.9	0	0	0	0	113.6	H842	H842-T844 PolarHBondContact CE1-OG1 2.94Å; H842-T844 PolarHBondContact ND1-OG1 3.26Å; H842-T844 VanDerWaalsContact ND1-OG1 3.08Å; H842-T844 PolarHBondContact O-N 3.46Å; H842-T844 VanDerWaalsContact O-N 3.12Å
845	G	89.2	Confident	87.8	Confident	5 Å²	5	40.8 Å²	40.8	5%	0.052	23%	0.231	C	C	.	.	S	Bend	trans	-75.4	159	-174.7	0	0	0	0	0	113.1	H842 A847 A848 R849	H842-G845 PolarHBondContact O-N 2.96Å; G845-A847 PolarHBondContact O-N 2.84Å; G845-A848 PolarHBondContact O-N 3.22Å; G845-R849 WeakPolarHBondContact O-CG 3.46Å; G845-R849 PolarHBondContact O-N 3.35Å
846	P	91	Very high	88.2	Confident	3 Å²	3	40.4 Å²	40.4	2%	0.019	23%	0.229	C	C	.	.	H	α-helix	trans	-50.9	-39.7	175.1	-29.6	35.8	0	0	0	114.1	I812 K814 E818 S819 L820 R849 C850	I812-P846 HydrophobicContact CG2-CB 3.89Å; K814-P846 HydrophobicContact CB-CB 4.23Å; K814-P846 HydrophobicContact CB-CG 4.29Å; K814-P846 HydrophobicContact CD-CB 4.16Å; K814-P846 HydrophobicContact CD-CG 3.73Å; K814-P846 HydrophobicContact CG-CB 4.04Å; K814-P846 HydrophobicContact CG-CG 3.59Å; E818-P846 HydrophobicContact CG-CG 3.85Å; E818-P846 WeakPolarHBondContact OE1-CD 3.45Å; E818-P846 WeakPolarHBondContact OE1-CG 2.85Å; S819-P846 WeakPolarHBondContact O-CD 3.5Å; S819-P846 WeakPolarHBondContact O-CG 3.46Å; L820-P846 HydrophobicContact CD1-CB 4.44Å; L820-P846 WeakPolarHBondContact O-CD 3.49Å; P846-R849 PolarHBondContact O-N 3.21Å; P846-C850 PolarHBondContact O-N 3.11Å
847	A	90	Very high	88.2	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-59.5	-47.1	175.9	0	0	0	0	0	112.5	L820 V822 M841 G845 C850 L853	L820-A847 HydrophobicContact CD1-CB 4.46Å; L820-A847 HydrophobicContact CG-CB 4.33Å; L820-A847 VanDerWaalsContact O-CB 3.3Å; L820-A847 WeakPolarHBondContact O-CB 3.49Å; L820-A847 PolarHBondContact O-N 3.24Å; L820-A847 VanDerWaalsContact O-N 3.09Å; V822-A847 HydrophobicContact CG1-CB 3.46Å; V822-A847 VanDerWaalsContact CG1-CB 3.46Å; M841-A847 HydrophobicContact CG-CB 3.8Å; M841-A847 HydrophobicContact SD-CB 3.5Å; M841-A847 WeakPolarHBondContact SD-CB 3.24Å; G845-A847 PolarHBondContact O-N 2.84Å; A847-C850 WeakPolarHBondContact O-CB 3.39Å; A847-C850 PolarHBondContact O-N 3.46Å; A847-L853 HydrophobicContact CB-CD1 3.83Å
848	A	89.7	Confident	88.2	Confident	26 Å²	26	40.4 Å²	40.4	22%	0.215	23%	0.229	C	C	.	.	H	α-helix	trans	-69.1	-40	177	0	0	0	0	0	112	M841 H842 P843 G845 C850 G851	M841-A848 HydrophobicContact CE-CB 3.95Å; M841-A848 HydrophobicContact CG-CB 4.09Å; M841-A848 HydrophobicContact SD-CB 4.16Å; M841-A848 PolarHBondContact SD-N 2.84Å; H842-A848 WeakPolarHBondContact O-CB 3.28Å; P843-A848 WeakPolarHBondContact O-CB 3.41Å; G845-A848 PolarHBondContact O-N 3.22Å; A848-C850 PolarHBondContact O-N 3Å; A848-G851 PolarHBondContact O-N 3.3Å
849	R	89.9	Confident	88.2	Confident	148 Å²	148	40.6 Å²	40.6	56%	0.558	23%	0.229	S	C	*	.	H	α-helix	trans	-61.9	-22.3	176.2	-71.4	172.6	56.5	-139.1	-11.8	113.6	E818 G845 P846	E818-R849 IonicContact OE1-NH1 2.79Å; G845-R849 WeakPolarHBondContact O-CG 3.46Å; G845-R849 PolarHBondContact O-N 3.35Å; P846-R849 PolarHBondContact O-N 3.21Å
850	C	86.8	Confident	88.2	Confident	23 Å²	23	41.5 Å²	41.5	16%	0.155	24%	0.235	C	C	.	.	H	α-helix	trans	-72.5	-29.7	174	-173.2	0	0	0	0	112.3	V810 I812 P846 A847 A848 Q852	V810-C850 VanDerWaalsContact CG1-SG 3.55Å; I812-C850 HydrophobicContact CG1-CB 4.17Å; I812-C850 HydrophobicContact CG2-CB 4.4Å; P846-C850 PolarHBondContact O-N 3.11Å; A847-C850 WeakPolarHBondContact O-CB 3.39Å; A847-C850 PolarHBondContact O-N 3.46Å; A848-C850 PolarHBondContact O-N 3Å; C850-Q852 PolarHBondContact O-N 3.25Å
851	G	86.5	Confident	88.2	Confident	61 Å²	61	40.7 Å²	40.7	63%	0.629	23%	0.232	S	C	*	.			trans	66.3	-3.5	179.8	0	0	0	0	0	115.8	A848	A848-G851 PolarHBondContact O-N 3.3Å
852	Q	86.5	Confident	88.3	Confident	85 Å²	85	39.1 Å²	39.1	40%	0.397	22%	0.224	S	C	.	.			trans	-97.4	-7.1	-176.4	-65.7	-177.3	35	0	0	114.2	K808 V810 C850	K808-Q852 PolarHBondContact NZ-O 2.84Å; V810-Q852 HydrophobicContact CG1-CB 3.77Å; V810-Q852 HydrophobicContact CG2-CB 4.05Å; C850-Q852 PolarHBondContact O-N 3.25Å
853	L	88.8	Confident	88.2	Confident	5 Å²	5	39.2 Å²	39.2	3%	0.026	23%	0.226	C	C	.	.			trans	-103.7	132.8	178.9	-65	-177.6	0	0	0	111	V810 I812 L838 M841 A847 L890 I892	V810-L853 HydrophobicContact CB-CD2 4.24Å; V810-L853 HydrophobicContact CG1-CD2 4.13Å; V810-L853 HydrophobicContact CG1-CG 4.35Å; V810-L853 HydrophobicContact CG2-CD2 4.17Å; I812-L853 HydrophobicContact CD1-CD1 3.64Å; I812-L853 HydrophobicContact CD1-CG 4.35Å; L838-L853 HydrophobicContact CD2-CB 4.07Å; L838-L853 HydrophobicContact CD2-CD1 4.3Å; M841-L853 HydrophobicContact SD-CB 4.11Å; M841-L853 HydrophobicContact SD-CD1 4.37Å; A847-L853 HydrophobicContact CB-CD1 3.83Å; L853-L890 HydrophobicContact CD1-CD1 4.1Å; L853-L890 HydrophobicContact CD2-CD1 4.29Å; L853-I892 HydrophobicContact CD2-CD1 3.73Å; L853-I892 HydrophobicContact CD2-CG1 4.36Å; L853-I892 HydrophobicContact CD2-CG2 4.05Å
854	N	87.1	Confident	88	Confident	98 Å²	98	37.9 Å²	37.9	52%	0.524	23%	0.231	S	C	.	.			trans	-115.6	151.3	175.8	-66	-27.1	0	0	0	111.2	G856 N857	N854-G856 PolarHBondContact O-N 3.11Å; N854-N857 PolarHBondContact N-OD1 3.48Å; N854-N857 VanDerWaalsContact O-CB 3.3Å; N854-N857 WeakPolarHBondContact O-CB 3.42Å; N854-N857 PolarHBondContact O-N 3.14Å; N854-N857 PolarHBondContact O-OD1 3.21Å
855	I	87	Confident	88	Confident	58 Å²	58	38.5 Å²	38.5	30%	0.297	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	134.2	173.3	-60.8	175.3	0	0	0	108.9	A839 V977 L981	A839-I855 WeakPolarHBondContact O-CG2 3.27Å; I855-V977 HydrophobicContact CG2-CG1 4.22Å; I855-L981 HydrophobicContact CD1-CD2 4Å; I855-L981 HydrophobicContact CG2-CD2 4.49Å
856	G	83.1	Confident	87.9	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	98.5	-16.1	-171.8	0	0	0	0	0	114.5	L838 N854 Q858 C895	L838-G856 PolarHBondContact O-N 2.85Å; N854-G856 PolarHBondContact O-N 3.11Å; G856-Q858 PolarHBondContact O-N 3.26Å; G856-C895 CarbonylContact C-O 3.54Å
857	N	88.2	Confident	87.7	Confident	4 Å²	4	41 Å²	41	2%	0.021	24%	0.244	C	C	.	.			trans	-62.1	136.6	177.5	-67.2	173.5	0	0	0	111.5	L838 N854 I892 I893	L838-N857 VanDerWaalsContact CB-O 3.27Å; L838-N857 WeakPolarHBondContact CB-O 3.38Å; L838-N857 PolarHBondContact N-O 2.93Å; N854-N857 PolarHBondContact N-OD1 3.48Å; N854-N857 VanDerWaalsContact O-CB 3.3Å; N854-N857 WeakPolarHBondContact O-CB 3.42Å; N854-N857 PolarHBondContact O-N 3.14Å; N854-N857 PolarHBondContact O-OD1 3.21Å; N857-I892 HydrophobicContact CB-CD1 4.21Å; N857-I892 VanDerWaalsContact OD1-CD1 3.32Å; N857-I892 WeakPolarHBondContact OD1-CD1 3.39Å; N857-I893 WeakPolarHBondContact CA-O 3.47Å
858	Q	86.6	Confident	87.5	Confident	11 Å²	11	43.2 Å²	43.2	5%	0.051	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	129.2	177.1	-60.3	-167.9	20.9	0	0	110	T835 L837 G856 I892 I893 C895	T835-Q858 PolarHBondContact OG1-OE1 3.27Å; L837-Q858 HydrophobicContact CD1-CG 4.3Å; G856-Q858 PolarHBondContact O-N 3.26Å; Q858-I892 CarbonylContact O-C 3.54Å; Q858-I892 VanDerWaalsContact O-CA 3.23Å; Q858-I892 WeakPolarHBondContact O-CA 3.49Å; Q858-I893 PolarHBondContact N-O 2.8Å; Q858-I893 PolarHBondContact O-N 2.92Å; Q858-C895 HydrophobicContact CG-CB 4.46Å
859	I	88.8	Confident	87.2	Confident	3 Å²	3	44.4 Å²	44.4	2%	0.015	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	111.9	179.3	-50.2	178.2	0	0	0	108.4	I824 A836 V862 L867 L890 I892	I824-I859 HydrophobicContact CG2-CD1 3.87Å; A836-I859 PolarHBondContact O-N 3.25Å; I859-V862 HydrophobicContact CG2-CG2 3.98Å; I859-L867 HydrophobicContact CB-CD1 4.09Å; I859-L867 HydrophobicContact CG2-CD1 3.72Å; I859-L890 HydrophobicContact CG2-CD2 4.42Å; I859-I892 HydrophobicContact CG1-CG2 4.16Å
860	V	88	Confident	87	Confident	19 Å²	19	40.6 Å²	40.6	12%	0.115	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	-42.3	179.6	-177.3	0	0	0	0	110.6	L867 V868 M891 I893	V860-L867 PolarHBondContact O-N 2.73Å; V860-V868 HydrophobicContact CG1-CG2 3.82Å; V860-M891 HydrophobicContact CB-CB 4.39Å; V860-M891 PolarHBondContact N-O 3.22Å; V860-I893 HydrophobicContact CG2-CD1 3.45Å; V860-I893 VanDerWaalsContact CG2-CD1 3.45Å; V860-I893 HydrophobicContact CG2-CG1 3.76Å
861	A	88.6	Confident	87	Confident	7 Å²	7	43 Å²	43	6%	0.058	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	153.8	-179.4	0	0	0	0	0	113.5	Q865 L890 M891	A861-Q865 CarbonylContact C-O 3.55Å; A861-Q865 WeakPolarHBondContact CA-O 3.08Å; A861-Q865 WeakPolarHBondContact CB-O 3.48Å; A861-L890 WeakPolarHBondContact O-CA 3.3Å; A861-M891 HydrophobicContact CB-CB 4.09Å; A861-M891 HydrophobicContact CB-CG 4.29Å; A861-M891 HydrophobicContact CB-SD 4.14Å; A861-M891 PolarHBondContact N-O 2.62Å; A861-M891 PolarHBondContact O-N 2.67Å
862	V	91.1	Very high	87	Confident	1 Å²	1	42 Å²	42	1%	0.006	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	117.6	177.6	-176.2	0	0	0	0	108.8	I859 G864 Q865 L867 I878 I879 V888 L890	I859-V862 HydrophobicContact CG2-CG2 3.98Å; V862-G864 PolarHBondContact O-N 3.46Å; V862-G864 VanDerWaalsContact O-N 3.16Å; V862-Q865 PolarHBondContact N-O 2.75Å; V862-Q865 WeakPolarHBondContact O-CB 3.42Å; V862-Q865 PolarHBondContact O-N 3.35Å; V862-L867 HydrophobicContact CG2-CD1 3.72Å; V862-L867 HydrophobicContact CG2-CD2 4.08Å; V862-L867 HydrophobicContact CG2-CG 3.96Å; V862-I878 HydrophobicContact CB-CG2 3.98Å; V862-I878 HydrophobicContact CG1-CG2 4.17Å; V862-I878 HydrophobicContact CG2-CG2 4.47Å; V862-I879 HydrophobicContact CG2-CG1 4.13Å; V862-V888 HydrophobicContact CG1-CG1 4.05Å; V862-L890 HydrophobicContact CB-CD2 4.17Å; V862-L890 HydrophobicContact CG1-CD2 3.91Å; V862-L890 HydrophobicContact CG2-CD2 3.79Å
863	N	88.3	Confident	87.2	Confident	67 Å²	67	43.3 Å²	43.3	36%	0.358	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.4	36	-177.4	-65.2	-36	0	0	0	113.8	Q865 C882 V888 K889	N863-Q865 VanDerWaalsContact C-N 3.31Å; N863-Q865 PolarHBondContact O-N 2.9Å; N863-C882 PolarHBondContact ND2-SG 3.15Å; N863-V888 WeakPolarHBondContact OD1-CA 3.23Å; N863-K889 PolarHBondContact N-O 3.12Å; N863-K889 PolarHBondContact OD1-N 3.06Å
864	G	83.9	Confident	87.3	Confident	72 Å²	72	45.3 Å²	45.3	74%	0.742	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.9	-7.5	-176.1	0	0	0	0	0	115.3	V862	V862-G864 PolarHBondContact O-N 3.46Å; V862-G864 VanDerWaalsContact O-N 3.16Å
865	Q	89.3	Confident	87.5	Confident	112 Å²	112	40.7 Å²	40.7	52%	0.523	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	115.6	170.9	-61.9	-172.1	-24	0	0	109.8	A861 V862 N863	A861-Q865 CarbonylContact C-O 3.55Å; A861-Q865 WeakPolarHBondContact CA-O 3.08Å; A861-Q865 WeakPolarHBondContact CB-O 3.48Å; V862-Q865 PolarHBondContact N-O 2.75Å; V862-Q865 WeakPolarHBondContact O-CB 3.42Å; V862-Q865 PolarHBondContact O-N 3.35Å; N863-Q865 VanDerWaalsContact C-N 3.31Å; N863-Q865 PolarHBondContact O-N 2.9Å
866	S	87.8	Confident	87.7	Confident	62 Å²	62	40.3 Å²	40.3	43%	0.434	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	135.5	173.4	-174	0	0	0	0	110.9	V868 L870	S866-V868 PolarHBondContact OG-N 2.81Å; S866-L870 VanDerWaalsContact O-CD1 3.25Å; S866-L870 WeakPolarHBondContact O-CD1 3.25Å
867	L	86.7	Confident	88.1	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	27%	0.272	C	S	.	.			trans	-93.7	-11.6	170.2	-60.6	-168.7	0	0	0	112.4	A836 I859 V860 V862 G869 L870 C875 I878	A836-L867 HydrophobicContact CB-CD1 3.96Å; I859-L867 HydrophobicContact CB-CD1 4.09Å; I859-L867 HydrophobicContact CG2-CD1 3.72Å; V860-L867 PolarHBondContact O-N 2.73Å; V862-L867 HydrophobicContact CG2-CD1 3.72Å; V862-L867 HydrophobicContact CG2-CD2 4.08Å; V862-L867 HydrophobicContact CG2-CG 3.96Å; L867-G869 PolarHBondContact O-N 2.87Å; L867-L870 PolarHBondContact O-N 3.48Å; L867-L870 VanDerWaalsContact O-N 3.14Å; L867-C875 HydrophobicContact CD1-CB 4.29Å; L867-C875 HydrophobicContact CD2-CB 4.23Å; L867-I878 HydrophobicContact CD2-CB 4.38Å; L867-I878 HydrophobicContact CD2-CD1 3.78Å; L867-I878 HydrophobicContact CD2-CG2 4.25Å
868	V	84.6	Confident	88.2	Confident	45 Å²	45	45.3 Å²	45.3	27%	0.273	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	124.8	-177.8	-169.9	0	0	0	0	109.8	L833 P834 T835 V860 S866 L870	L833-V868 HydrophobicContact CB-CG1 4.06Å; L833-V868 HydrophobicContact CD1-CG1 4.22Å; L833-V868 HydrophobicContact CD2-CG1 4.45Å; L833-V868 HydrophobicContact CG-CG1 4.49Å; P834-V868 WeakPolarHBondContact O-CA 3.14Å; T835-V868 HydrophobicContact CG2-CG1 4.47Å; T835-V868 HydrophobicContact CG2-CG2 4.19Å; V860-V868 HydrophobicContact CG1-CG2 3.82Å; S866-V868 PolarHBondContact OG-N 2.81Å; V868-L870 VanDerWaalsContact C-N 3.28Å; V868-L870 PolarHBondContact O-N 2.89Å
869	G	82.7	Confident	88.4	Confident	52 Å²	52	44.8 Å²	44.8	54%	0.536	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.6	-5.2	-178.2	0	0	0	0	0	115.3	P834 L867	P834-G869 PolarHBondContact O-N 3.21Å; L867-G869 PolarHBondContact O-N 2.87Å
870	L	86.5	Confident	88.5	Confident	68 Å²	68	49.1 Å²	49.1	36%	0.356	29%	0.292	S	S	.	.			trans	-86.7	139.7	175.6	-60.8	-173.8	0	0	0	110.8	S866 L867 V868 T874 C875 I878	S866-L870 VanDerWaalsContact O-CD1 3.25Å; S866-L870 WeakPolarHBondContact O-CD1 3.25Å; L867-L870 PolarHBondContact O-N 3.48Å; L867-L870 VanDerWaalsContact O-N 3.14Å; V868-L870 VanDerWaalsContact C-N 3.28Å; V868-L870 PolarHBondContact O-N 2.89Å; L870-T874 HydrophobicContact CB-CG2 4.47Å; L870-T874 HydrophobicContact CD1-CG2 4.11Å; L870-C875 PolarHBondContact O-SG 2.78Å; L870-I878 HydrophobicContact CD1-CD1 3.64Å
871	P	87	Confident	88.5	Confident	74 Å²	74	53.9 Å²	53.9	48%	0.481	32%	0.317	S	S	.	.			trans	-68.3	151.3	177.6	29.6	-35.1	0	0	0	110.8	L873 T874 C875	P871-L873 PolarHBondContact O-N 3.47Å; P871-T874 WeakPolarHBondContact O-CB 3.49Å; P871-T874 PolarHBondContact O-N 3.06Å; P871-C875 PolarHBondContact O-N 3.32Å; P871-C875 VanDerWaalsContact O-N 3.15Å
872	L	87.3	Confident	88.3	Confident	40 Å²	40	54.1 Å²	54.1	21%	0.209	32%	0.318	C	S	.	.	H	α-helix	trans	-49.5	-38.8	-175.4	-172.9	62.6	0	0	0	114.2	I824 E826 T874 C875 Q876	I824-L872 HydrophobicContact CB-CD1 4.46Å; I824-L872 HydrophobicContact CD1-CD1 3.82Å; I824-L872 HydrophobicContact CG1-CD1 3.89Å; E826-L872 HydrophobicContact CG-CB 3.6Å; E826-L872 HydrophobicContact CG-CD1 4.17Å; E826-L872 HydrophobicContact CG-CD2 4.18Å; E826-L872 HydrophobicContact CG-CG 4.19Å; E826-L872 VanDerWaalsContact OE1-CB 3.24Å; E826-L872 WeakPolarHBondContact OE1-CB 3.32Å; E826-L872 PolarHBondContact OE1-N 3.12Å; E826-L872 VanDerWaalsContact OE1-N 3.12Å; L872-T874 VanDerWaalsContact C-N 3.31Å; L872-T874 PolarHBondContact O-N 3.24Å; L872-C875 PolarHBondContact O-N 3.46Å; L872-Q876 HydrophobicContact CD1-CG 4.38Å; L872-Q876 HydrophobicContact CG-CG 4.29Å; L872-Q876 WeakPolarHBondContact O-CB 3.28Å; L872-Q876 VanDerWaalsContact O-CG 3.27Å; L872-Q876 WeakPolarHBondContact O-CG 3.44Å; L872-Q876 PolarHBondContact O-N 2.88Å
873	L	90.2	Very high	88	Confident	111 Å²	111	60.9 Å²	60.9	58%	0.581	34%	0.343	S	S	*	.	H	α-helix	trans	-59.6	-41.9	179.5	-177	61.7	0	0	0	111.9	P871 Q877	P871-L873 PolarHBondContact O-N 3.47Å; L873-Q877 VanDerWaalsContact O-CG 3.26Å; L873-Q877 WeakPolarHBondContact O-CG 3.35Å; L873-Q877 PolarHBondContact O-N 2.81Å
874	T	91.5	Very high	87.9	Confident	47 Å²	47	65.5 Å²	65.5	29%	0.288	36%	0.363	S	S	.	.	H	α-helix	trans	-71.4	-42.3	177.2	-57.8	0	0	0	0	110.8	L870 P871 L872 Q876 Q877 I878	L870-T874 HydrophobicContact CB-CG2 4.47Å; L870-T874 HydrophobicContact CD1-CG2 4.11Å; P871-T874 WeakPolarHBondContact O-CB 3.49Å; P871-T874 PolarHBondContact O-N 3.06Å; L872-T874 VanDerWaalsContact C-N 3.31Å; L872-T874 PolarHBondContact O-N 3.24Å; T874-Q876 VanDerWaalsContact C-N 3.31Å; T874-Q876 PolarHBondContact O-N 3.38Å; T874-Q877 WeakPolarHBondContact O-CB 3.22Å; T874-Q877 PolarHBondContact O-N 2.89Å; T874-I878 HydrophobicContact CG2-CD1 4.16Å; T874-I878 WeakPolarHBondContact O-CG1 3.46Å; T874-I878 PolarHBondContact O-N 3.02Å
875	C	89.8	Confident	88	Confident	2 Å²	2	64 Å²	64	1%	0.014	34%	0.341	C	S	.	.	H	α-helix	trans	-58.3	-43.3	173.9	-60.7	0	0	0	0	111.9	I824 A836 L867 L870 P871 L872 Q877 I878 I879	I824-C875 HydrophobicContact CD1-CB 3.66Å; A836-C875 HydrophobicContact CB-CB 4.44Å; L867-C875 HydrophobicContact CD1-CB 4.29Å; L867-C875 HydrophobicContact CD2-CB 4.23Å; L870-C875 PolarHBondContact O-SG 2.78Å; P871-C875 PolarHBondContact O-N 3.32Å; P871-C875 VanDerWaalsContact O-N 3.15Å; L872-C875 PolarHBondContact O-N 3.46Å; C875-Q877 VanDerWaalsContact C-N 3.35Å; C875-Q877 PolarHBondContact O-N 2.83Å; C875-I878 PolarHBondContact O-N 3.27Å; C875-I879 WeakPolarHBondContact O-CG1 3.48Å; C875-I879 PolarHBondContact O-N 2.87Å; C875-I879 VanDerWaalsContact O-N 3.15Å
876	Q	91.6	Very high	87.9	Confident	49 Å²	49	62 Å²	62	23%	0.229	34%	0.336	C	S	.	.	H	α-helix	trans	-65.3	-35.8	174.6	-71.8	-178.4	7.7	0	0	112.2	I824 L872 T874 K880 I990	I824-Q876 HydrophobicContact CD1-CG 3.8Å; I824-Q876 HydrophobicContact CG1-CG 3.83Å; L872-Q876 HydrophobicContact CD1-CG 4.38Å; L872-Q876 HydrophobicContact CG-CG 4.29Å; L872-Q876 WeakPolarHBondContact O-CB 3.28Å; L872-Q876 VanDerWaalsContact O-CG 3.27Å; L872-Q876 WeakPolarHBondContact O-CG 3.44Å; L872-Q876 PolarHBondContact O-N 2.88Å; T874-Q876 VanDerWaalsContact C-N 3.31Å; T874-Q876 PolarHBondContact O-N 3.38Å; Q876-K880 WeakPolarHBondContact O-CB 3.34Å; Q876-K880 WeakPolarHBondContact O-CD 3.5Å; Q876-K880 WeakPolarHBondContact O-CG 3.27Å; Q876-K880 PolarHBondContact O-N 3Å; Q876-I990 HydrophobicContact CB-CD1 4.33Å; Q876-I990 HydrophobicContact CG-CD1 4.14Å
877	Q	90.9	Very high	88	Confident	92 Å²	92	63.6 Å²	63.6	43%	0.43	34%	0.339	S	S	.	.	H	α-helix	trans	-66.5	-44.1	174.8	-75.9	166.6	-14.4	0	0	111.8	L873 T874 C875 I879 K880 N881	L873-Q877 VanDerWaalsContact O-CG 3.26Å; L873-Q877 WeakPolarHBondContact O-CG 3.35Å; L873-Q877 PolarHBondContact O-N 2.81Å; T874-Q877 WeakPolarHBondContact O-CB 3.22Å; T874-Q877 PolarHBondContact O-N 2.89Å; C875-Q877 VanDerWaalsContact C-N 3.35Å; C875-Q877 PolarHBondContact O-N 2.83Å; Q877-I879 PolarHBondContact O-N 3.08Å; Q877-K880 PolarHBondContact O-N 3.33Å; Q877-N881 WeakPolarHBondContact O-CB 3.47Å; Q877-N881 PolarHBondContact O-N 2.7Å; Q877-N881 PolarHBondContact O-ND2 3.32Å; Q877-N881 PolarHBondContact O-OD1 2.86Å
878	I	91.4	Very high	88.2	Confident	17 Å²	17	63.6 Å²	63.6	9%	0.087	34%	0.339	C	S	.	.	H	α-helix	trans	-58.2	-47.6	177.1	-68.9	165.8	0	0	0	110.7	V862 L867 L870 T874 C875 N881 C882	V862-I878 HydrophobicContact CB-CG2 3.98Å; V862-I878 HydrophobicContact CG1-CG2 4.17Å; V862-I878 HydrophobicContact CG2-CG2 4.47Å; L867-I878 HydrophobicContact CD2-CB 4.38Å; L867-I878 HydrophobicContact CD2-CD1 3.78Å; L867-I878 HydrophobicContact CD2-CG2 4.25Å; L870-I878 HydrophobicContact CD1-CD1 3.64Å; T874-I878 HydrophobicContact CG2-CD1 4.16Å; T874-I878 WeakPolarHBondContact O-CG1 3.46Å; T874-I878 PolarHBondContact O-N 3.02Å; C875-I878 PolarHBondContact O-N 3.27Å; I878-N881 PolarHBondContact O-N 3.17Å; I878-C882 PolarHBondContact O-N 2.8Å; I878-C882 PolarHBondContact O-SG 2.8Å
879	I	90.3	Very high	88.6	Confident	1 Å²	1	65.9 Å²	65.9	1%	0.005	35%	0.346	C	S	.	.	H	α-helix	trans	-65.9	-39.7	177.8	-64.3	170.6	0	0	0	111.5	L820 V822 I824 V862 C875 Q877 N881 C882 I990	L820-I879 HydrophobicContact CB-CG2 4.19Å; L820-I879 HydrophobicContact CD2-CG2 3.93Å; V822-I879 HydrophobicContact CG2-CG2 4.16Å; I824-I879 HydrophobicContact CD1-CD1 3.85Å; I824-I879 HydrophobicContact CG1-CD1 4.42Å; I824-I879 HydrophobicContact CG2-CD1 4.02Å; V862-I879 HydrophobicContact CG2-CG1 4.13Å; C875-I879 WeakPolarHBondContact O-CG1 3.48Å; C875-I879 PolarHBondContact O-N 2.87Å; C875-I879 VanDerWaalsContact O-N 3.15Å; Q877-I879 PolarHBondContact O-N 3.08Å; I879-N881 PolarHBondContact O-N 3.17Å; I879-C882 WeakPolarHBondContact O-CB 3.49Å; I879-C882 PolarHBondContact O-N 3.27Å; I879-I990 HydrophobicContact CB-CD1 3.82Å; I879-I990 HydrophobicContact CD1-CD1 4.01Å; I879-I990 HydrophobicContact CG2-CD1 3.65Å; I879-I990 HydrophobicContact CG2-CG1 3.83Å
880	K	90.1	Very high	89	Confident	93 Å²	93	63.4 Å²	63.4	40%	0.404	32%	0.32	S	S	.	.	H	α-helix	trans	-64.4	-36.1	174.3	-75.4	166.6	-172.7	167.9	0	112.6	Q876 Q877 C882 R883 I990	Q876-K880 WeakPolarHBondContact O-CB 3.34Å; Q876-K880 WeakPolarHBondContact O-CD 3.5Å; Q876-K880 WeakPolarHBondContact O-CG 3.27Å; Q876-K880 PolarHBondContact O-N 3Å; Q877-K880 PolarHBondContact O-N 3.33Å; K880-C882 VanDerWaalsContact C-N 3.27Å; K880-C882 PolarHBondContact O-N 2.78Å; K880-R883 WeakPolarHBondContact O-CB 3.36Å; K880-R883 PolarHBondContact O-N 2.86Å; K880-I990 VanDerWaalsContact CE-CG2 3.44Å; K880-I990 HydrophobicContact CG-CB 4.21Å; K880-I990 HydrophobicContact CG-CG2 4.41Å
881	N	88.7	Confident	89.1	Confident	120 Å²	120	63.8 Å²	63.8	64%	0.642	32%	0.321	S	S	*	.	H	α-helix	trans	-66.4	-32.2	176.4	-68.9	-11.7	0	0	0	111.3	Q877 I878 I879 R883	Q877-N881 WeakPolarHBondContact O-CB 3.47Å; Q877-N881 PolarHBondContact O-N 2.7Å; Q877-N881 PolarHBondContact O-ND2 3.32Å; Q877-N881 PolarHBondContact O-OD1 2.86Å; I878-N881 PolarHBondContact O-N 3.17Å; I879-N881 PolarHBondContact O-N 3.17Å; N881-R883 PolarHBondContact O-N 2.81Å
882	C	85.1	Confident	89.2	Confident	11 Å²	11	60.3 Å²	60.3	7%	0.074	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	4.2	170.7	-60	0	0	0	0	114.1	K814 N863 I878 I879 K880 Q884 S885 V888	K814-C882 WeakPolarHBondContact CE-O 3.35Å; K814-C882 PolarHBondContact NZ-O 2.84Å; N863-C882 PolarHBondContact ND2-SG 3.15Å; I878-C882 PolarHBondContact O-N 2.8Å; I878-C882 PolarHBondContact O-SG 2.8Å; I879-C882 WeakPolarHBondContact O-CB 3.49Å; I879-C882 PolarHBondContact O-N 3.27Å; K880-C882 VanDerWaalsContact C-N 3.27Å; K880-C882 PolarHBondContact O-N 2.78Å; C882-Q884 PolarHBondContact O-N 3.03Å; C882-S885 PolarHBondContact O-N 3.1Å; C882-V888 HydrophobicContact CB-CG2 4.03Å
883	R	85.3	Confident	89.1	Confident	143 Å²	143	58.4 Å²	58.4	54%	0.54	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-28	170.7	-174.3	168.4	-173.3	-166.8	-1.7	113.7	G817 K880 N881	G817-R883 WeakPolarHBondContact CA-O 3.23Å; G817-R883 PolarHBondContact N-O 3.08Å; G817-R883 PolarHBondContact O-NE 3.23Å; G817-R883 PolarHBondContact O-NH2 2.9Å; K880-R883 WeakPolarHBondContact O-CB 3.36Å; K880-R883 PolarHBondContact O-N 2.86Å; N881-R883 PolarHBondContact O-N 2.81Å
884	Q	84.5	Confident	88.6	Confident	164 Å²	164	56.1 Å²	56.1	77%	0.766	28%	0.282	S	S	*	.	S	Bend	trans	-86.4	-21.4	-179.9	-58	-176.5	17.7	0	0	113.1	C882	C882-Q884 PolarHBondContact O-N 3.03Å
885	S	86.6	Confident	87.7	Confident	42 Å²	42	54.6 Å²	54.6	29%	0.294	27%	0.273	S	S	.	.			trans	-74.6	136.4	-178.3	-51.1	0	0	0	0	112.4	K814 C882 I887	K814-S885 WeakPolarHBondContact CE-O 3.43Å; C882-S885 PolarHBondContact O-N 3.1Å; S885-I887 WeakPolarHBondContact CB-O 3.4Å
886	T	88	Confident	87	Confident	69 Å²	69	59 Å²	59	42%	0.423	30%	0.301	S	S	.	.	S	Bend	trans	-83	-17.3	174.4	47.5	0	0	0	0	113.8	K814 K816	K814-T886 PolarHBondContact N-O 3Å; K814-T886 CarbonylContact O-C 3.54Å; K814-T886 VanDerWaalsContact O-CA 3.29Å; K814-T886 WeakPolarHBondContact O-CA 3.29Å; K814-T886 VanDerWaalsContact O-O 3.06Å; K816-T886 HydrophobicContact CD-CG2 4.17Å; K816-T886 HydrophobicContact CG-CG2 3.44Å; K816-T886 VanDerWaalsContact CG-CG2 3.44Å
887	I	89.8	Confident	86.2	Confident	96 Å²	96	58.4 Å²	58.4	49%	0.492	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	134.2	177.8	-58.8	177.6	0	0	0	106.5	T811 I812 S885	T811-I887 HydrophobicContact CG2-CG2 3.47Å; T811-I887 VanDerWaalsContact CG2-CG2 3.47Å; I812-I887 WeakPolarHBondContact O-CA 3.4Å; S885-I887 WeakPolarHBondContact CB-O 3.4Å
888	V	91.2	Very high	85.8	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	118.2	173.5	-177.2	0	0	0	0	108.3	I812 V862 N863 C882 L890	I812-V888 PolarHBondContact N-O 2.87Å; I812-V888 PolarHBondContact O-N 2.77Å; V862-V888 HydrophobicContact CG1-CG1 4.05Å; N863-V888 WeakPolarHBondContact OD1-CA 3.23Å; C882-V888 HydrophobicContact CB-CG2 4.03Å; V888-L890 HydrophobicContact CG1-CD2 3.8Å; V888-L890 HydrophobicContact CG1-CG 4.29Å
889	K	91.5	Very high	85.3	Confident	93 Å²	93	58.3 Å²	58.3	40%	0.404	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	123	170.5	-77.5	168.6	158.5	-99.5	0	108.5	E809 N863	E809-K889 VanDerWaalsContact OE1-CD 3.29Å; E809-K889 WeakPolarHBondContact OE1-CD 3.34Å; E809-K889 WeakPolarHBondContact OE1-CE 3.47Å; E809-K889 WeakPolarHBondContact OE1-CG 3.37Å; E809-K889 IonicContact OE1-NZ 3.25Å; E809-K889 PolarHBondContact OE1-NZ 3.49Å; E809-K889 IonicContact OE2-NZ 3.91Å; N863-K889 PolarHBondContact N-O 3.12Å; N863-K889 PolarHBondContact OD1-N 3.06Å
890	L	91.2	Very high	85	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	134.4	171.8	-59.8	-175.5	0	0	0	109.2	E809 V810 I812 L820 L853 I859 A861 V862 V888 I892	E809-L890 CarbonylContact C-O 3.59Å; E809-L890 WeakPolarHBondContact CA-O 3.27Å; V810-L890 PolarHBondContact N-O 3.17Å; V810-L890 PolarHBondContact O-N 3.32Å; I812-L890 HydrophobicContact CD1-CD1 3.51Å; I812-L890 HydrophobicContact CD1-CG 4.05Å; L820-L890 HydrophobicContact CD2-CD1 4.43Å; L853-L890 HydrophobicContact CD1-CD1 4.1Å; L853-L890 HydrophobicContact CD2-CD1 4.29Å; I859-L890 HydrophobicContact CG2-CD2 4.42Å; A861-L890 WeakPolarHBondContact O-CA 3.3Å; V862-L890 HydrophobicContact CB-CD2 4.17Å; V862-L890 HydrophobicContact CG1-CD2 3.91Å; V862-L890 HydrophobicContact CG2-CD2 3.79Å; V888-L890 HydrophobicContact CG1-CD2 3.8Å; V888-L890 HydrophobicContact CG1-CG 4.29Å; L890-I892 HydrophobicContact CB-CG2 4.14Å
891	M	88.8	Confident	84.8	Confident	76 Å²	76	58.8 Å²	58.8	37%	0.374	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	119	161.4	-65.4	-179.6	66.5	0	0	107.7	H807 V860 A861	H807-M891 HydrophobicContact CB-CE 4.47Å; V860-M891 HydrophobicContact CB-CB 4.39Å; V860-M891 PolarHBondContact N-O 3.22Å; A861-M891 HydrophobicContact CB-CB 4.09Å; A861-M891 HydrophobicContact CB-CG 4.29Å; A861-M891 HydrophobicContact CB-SD 4.14Å; A861-M891 PolarHBondContact N-O 2.62Å; A861-M891 PolarHBondContact O-N 2.67Å
892	I	88.9	Confident	84.7	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	150.8	179.9	59.7	149.7	0	0	0	111.9	K808 V810 L853 N857 Q858 I859 L890	K808-I892 HydrophobicContact CB-CG1 4.09Å; K808-I892 HydrophobicContact CD-CD1 4.24Å; K808-I892 PolarHBondContact N-O 2.85Å; K808-I892 VanDerWaalsContact O-CG1 3.28Å; K808-I892 WeakPolarHBondContact O-CG1 3.15Å; K808-I892 PolarHBondContact O-N 3Å; V810-I892 HydrophobicContact CG2-CD1 3.92Å; V810-I892 HydrophobicContact CG2-CG1 3.9Å; L853-I892 HydrophobicContact CD2-CD1 3.73Å; L853-I892 HydrophobicContact CD2-CG1 4.36Å; L853-I892 HydrophobicContact CD2-CG2 4.05Å; N857-I892 HydrophobicContact CB-CD1 4.21Å; N857-I892 VanDerWaalsContact OD1-CD1 3.32Å; N857-I892 WeakPolarHBondContact OD1-CD1 3.39Å; Q858-I892 CarbonylContact O-C 3.54Å; Q858-I892 VanDerWaalsContact O-CA 3.23Å; Q858-I892 WeakPolarHBondContact O-CA 3.49Å; I859-I892 HydrophobicContact CG1-CG2 4.16Å; L890-I892 HydrophobicContact CB-CG2 4.14Å
893	I	84.8	Confident	84.7	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	132.3	167.8	-62.8	164.9	0	0	0	107.9	L800 F801 N857 Q858 V860 C895	L800-I893 HydrophobicContact CB-CG2 4.42Å; F801-I893 HydrophobicContact CD1-CD1 3.25Å; F801-I893 HydrophobicContact CE1-CD1 3.73Å; F801-I893 HydrophobicContact CG-CD1 4.24Å; N857-I893 WeakPolarHBondContact CA-O 3.47Å; Q858-I893 PolarHBondContact N-O 2.8Å; Q858-I893 PolarHBondContact O-N 2.92Å; V860-I893 HydrophobicContact CG2-CD1 3.45Å; V860-I893 VanDerWaalsContact CG2-CD1 3.45Å; V860-I893 HydrophobicContact CG2-CG1 3.76Å; I893-C895 VanDerWaalsContact C-N 3.32Å; I893-C895 PolarHBondContact O-N 3.43Å; I893-C895 VanDerWaalsContact O-N 3.08Å
894	S	81	Confident	84.5	Confident	64 Å²	64	51.8 Å²	51.8	45%	0.448	28%	0.277	S	S	.	.			trans	-86.8	67	-173.9	-63.2	0	0	0	0	112.2
895	C	72	Confident	84.4	Confident	15 Å²	15	44.9 Å²	44.9	10%	0.101	24%	0.244	C	C	.	.			trans	-78.2	138.8	171.4	-54.2	0	0	0	0	110.8	G856 Q858 I893	G856-C895 CarbonylContact C-O 3.54Å; Q858-C895 HydrophobicContact CG-CB 4.46Å; I893-C895 VanDerWaalsContact C-N 3.32Å; I893-C895 PolarHBondContact O-N 3.43Å; I893-C895 VanDerWaalsContact O-N 3.08Å
896	P	74.2	Confident	83.8	Confident	94 Å²	94	46.7 Å²	46.7	61%	0.61	25%	0.254	S	S	*	.			trans	-66.7	146.7	165.6	28.8	-33.1	0	0	0	110.3	V898	P896-V898 PolarHBondContact O-N 2.99Å
897	P	76.2	Confident	83.3	Confident	36 Å²	36	45.2 Å²	45.2	23%	0.234	25%	0.247	C	C	.	.	S	Bend	trans	-75.1	-9.5	-179.9	30.3	-35.5	0	0	0	114	M973	P897-M973 HydrophobicContact CB-CE 4.14Å
898	V	82.1	Confident	82.9	Confident	53 Å²	53	45.5 Å²	45.5	32%	0.321	25%	0.249	S	C	.	.	S	Bend	trans	-106.2	122.8	176.6	-179.4	0	0	0	0	107.8	P896 R971 T972	P896-V898 PolarHBondContact O-N 2.99Å; V898-R971 HydrophobicContact CG1-CB 3.75Å; V898-R971 HydrophobicContact CG1-CG 4.22Å; V898-T972 WeakPolarHBondContact CA-O 3.43Å
899	V	81.5	Confident	82.1	Confident	54 Å²	54	52.6 Å²	52.6	33%	0.327	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	120.1	176.5	-177.6	0	0	0	0	108.1	V901 R971 T972	V899-V901 HydrophobicContact CG1-CG2 4.21Å; V899-R971 WeakPolarHBondContact O-CA 3.45Å; V899-T972 PolarHBondContact N-O 3.02Å; V899-T972 PolarHBondContact O-N 3.16Å
900	E	84.4	Confident	81.3	Confident	103 Å²	103	49.8 Å²	49.8	48%	0.481	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	133.8	171.9	-168.8	153.2	-118.3	0	0	109.4	R971	E900-R971 HydrophobicContact CB-CG 4.42Å; E900-R971 HydrophobicContact CG-CG 4.27Å; E900-R971 IonicContact OE1-CZ 3.87Å; E900-R971 IonicContact OE1-NE 2.77Å; E900-R971 PolarHBondContact OE1-NE 3.45Å; E900-R971 IonicContact OE1-NH2 2.71Å; E900-R971 PolarHBondContact OE1-NH2 3.11Å; E900-R971 IonicContact OE2-NH2 2.75Å
901	V	85.7	Confident	80.9	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.006	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	125.2	-170.2	169.3	0	0	0	0	107.3	V899 I903 G933 G934 I935 I970 T972	V899-V901 HydrophobicContact CG1-CG2 4.21Å; V901-I903 HydrophobicContact CG1-CD1 4.14Å; V901-I903 HydrophobicContact CG1-CG1 3.73Å; V901-G933 WeakPolarHBondContact CG1-O 3.45Å; V901-G934 WeakPolarHBondContact CG2-O 3.47Å; V901-I935 HydrophobicContact CB-CD1 4.17Å; V901-I935 HydrophobicContact CG1-CD1 3.55Å; V901-I935 HydrophobicContact CG1-CG1 3.65Å; V901-I935 HydrophobicContact CG2-CD1 4.19Å; V901-I970 HydrophobicContact CB-CB 4.29Å; V901-I970 WeakPolarHBondContact CB-O 3.33Å; V901-I970 PolarHBondContact N-O 2.99Å; V901-I970 PolarHBondContact O-N 3.36Å; V901-T972 HydrophobicContact CG2-CG2 4.35Å
902	L	85	Confident	80.6	Confident	31 Å²	31	53 Å²	53	16%	0.162	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	119.2	175.4	-176.2	62.3	0	0	0	109.5	G933 E967	L902-G933 PolarHBondContact N-O 2.88Å; L902-G933 VanDerWaalsContact O-CA 3.23Å; L902-G933 WeakPolarHBondContact O-CA 3.33Å; L902-E967 HydrophobicContact CD1-CB 4.02Å
903	I	86.3	Confident	80.3	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	111.5	177.5	-48.3	-174.7	0	0	0	109.5	V901 L912 F914 I929 A930 I935 I968 I970	V901-I903 HydrophobicContact CG1-CD1 4.14Å; V901-I903 HydrophobicContact CG1-CG1 3.73Å; I903-L912 HydrophobicContact CG2-CD2 3.96Å; I903-F914 HydrophobicContact CD1-CE1 4.11Å; I903-I929 HydrophobicContact CG2-CG2 3.51Å; I903-A930 HydrophobicContact CD1-CB 4.17Å; I903-I935 HydrophobicContact CD1-CD1 4.22Å; I903-I935 HydrophobicContact CD1-CG1 3.76Å; I903-I968 HydrophobicContact CB-CB 4.27Å; I903-I968 PolarHBondContact N-O 3.49Å; I903-I968 PolarHBondContact O-N 3.38Å; I903-I970 HydrophobicContact CD1-CD1 3.64Å; I903-I970 HydrophobicContact CG1-CD1 4.4Å
904	R	81.7	Confident	80.6	Confident	97 Å²	97	54.6 Å²	54.6	37%	0.366	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	120.9	172.3	-67.1	-176.3	166.4	144.1	1.5	110.5	Q791 E792 I929 G966 E967	Q791-R904 PolarHBondContact OE1-O 2.81Å; E792-R904 IonicContact OE2-NH1 3.54Å; R904-I929 VanDerWaalsContact O-CG2 3.28Å; R904-I929 WeakPolarHBondContact O-CG2 3.49Å; R904-G966 WeakPolarHBondContact CA-O 3.24Å; R904-E967 HydrophobicContact CG-CG 4.3Å; R904-E967 IonicContact CZ-OE1 3.95Å; R904-E967 VanDerWaalsContact CZ-OE1 3.25Å; R904-E967 IonicContact NE-OE1 3.21Å; R904-E967 PolarHBondContact NE-OE1 2.75Å; R904-E967 IonicContact NH2-OE1 3.57Å; R904-E967 PolarHBondContact NH2-OE1 2.84Å
905	R	81.2	Confident	80.9	Confident	19 Å²	19	54.8 Å²	54.8	7%	0.072	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	95.8	-179.4	-173.3	-152.7	-170.7	-172.9	0.5	110	S907 L908 Y910 L912 L961 A962 S964 V965 G966 I968	R905-S907 PolarHBondContact NE-O 3.2Å; R905-S907 PolarHBondContact O-N 2.93Å; R905-L908 PolarHBondContact NH2-O 3.08Å; R905-Y910 PolarHBondContact NE-O 3.49Å; R905-Y910 PolarHBondContact NH2-O 2.82Å; R905-L912 HydrophobicContact CB-CD2 4.31Å; R905-L912 HydrophobicContact CG-CD2 4.27Å; R905-L961 PolarHBondContact NH1-O 3.46Å; R905-A962 PolarHBondContact NH1-O 2.86Å; R905-S964 VanDerWaalsContact CD-O 3.29Å; R905-S964 WeakPolarHBondContact CD-O 3.27Å; R905-S964 PolarHBondContact NH1-O 3.44Å; R905-V965 CarbonylContact O-C 3.54Å; R905-V965 WeakPolarHBondContact O-CA 3.24Å; R905-G966 PolarHBondContact N-O 2.76Å; R905-G966 PolarHBondContact O-N 3.31Å; R905-I968 HydrophobicContact CB-CD1 4.08Å
906	P	74.1	Confident	81.8	Confident	80 Å²	80	55.1 Å²	55.1	52%	0.519	30%	0.3	S	S	.	.			trans	-72.4	-22.8	-170.4	27	-34.1	0	0	0	114.5	I787 Y910	I787-P906 HydrophobicContact CD1-CG 3.2Å; I787-P906 HydrophobicContact CG1-CG 3.64Å; P906-Y910 HydrophobicContact CG-CD2 4.07Å; P906-Y910 HydrophobicContact CG-CE2 4.12Å
907	S	77.6	Confident	82.5	Confident	38 Å²	38	55.6 Å²	55.6	27%	0.266	29%	0.294	S	S	.	.	S	Bend	trans	-149.1	164.2	173.2	87.7	0	0	0	0	113.4	R905 N909 Y910	R905-S907 PolarHBondContact NE-O 3.2Å; R905-S907 PolarHBondContact O-N 2.93Å; S907-N909 PolarHBondContact O-N 2.71Å; S907-N909 VanDerWaalsContact O-N 3.15Å; S907-N909 PolarHBondContact OG-N 2.87Å; S907-Y910 PolarHBondContact O-N 2.95Å; S907-Y910 VanDerWaalsContact O-N 3.14Å; S907-Y910 VanDerWaalsContact OG-CD2 3.26Å; S907-Y910 WeakPolarHBondContact OG-CD2 3.45Å; S907-Y910 WeakPolarHBondContact OG-CE2 3.39Å
908	L	81.1	Confident	82.9	Confident	102 Å²	102	58.6 Å²	58.6	53%	0.534	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-20.9	179.6	-64.4	175	0	0	0	113.4	R905 Y910 A962 V965	R905-L908 PolarHBondContact NH2-O 3.08Å; L908-Y910 PolarHBondContact O-N 3.29Å; L908-A962 WeakPolarHBondContact CD2-O 3.14Å; L908-V965 HydrophobicContact CD2-CG1 3.51Å; L908-V965 HydrophobicContact CG-CG1 3.83Å
909	N	74.9	Confident	83	Confident	148 Å²	148	56.3 Å²	56.3	79%	0.791	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-21.6	178.7	-60.1	-13.8	0	0	0	112.4	S907	S907-N909 PolarHBondContact O-N 2.71Å; S907-N909 VanDerWaalsContact O-N 3.15Å; S907-N909 PolarHBondContact OG-N 2.87Å
910	Y	75	Confident	83.4	Confident	35 Å²	35	54.7 Å²	54.7	14%	0.137	29%	0.285	C	S	.	.	S	Bend	trans	-80.8	121.4	177	-66.4	-85.8	0	0	0	110.1	D783 Y784 I787 R905 P906 S907 L908 I929	D783-Y910 WeakPolarHBondContact CB-OH 3.41Å; Y784-Y910 AromaticContact CD2-CD1 3.28Å; Y784-Y910 HydrophobicContact CD2-CD1 3.28Å; Y784-Y910 AromaticContact CD2-CE1 3.38Å; Y784-Y910 HydrophobicContact CD2-CE1 3.38Å; Y784-Y910 AromaticContact CE2-CD1 3.61Å; Y784-Y910 HydrophobicContact CE2-CD1 3.61Å; Y784-Y910 HydrophobicContact CE2-CE1 4.2Å; Y784-Y910 HydrophobicContact CG-CD1 4.18Å; Y784-Y910 AromaticContact CG-CE1 3.98Å; Y784-Y910 HydrophobicContact CG-CE1 3.98Å; I787-Y910 HydrophobicContact CD1-CD1 3.52Å; I787-Y910 HydrophobicContact CD1-CD2 4.17Å; I787-Y910 HydrophobicContact CD1-CE1 3.22Å; I787-Y910 HydrophobicContact CD1-CE2 3.88Å; I787-Y910 HydrophobicContact CD1-CG 4.04Å; I787-Y910 VanDerWaalsContact CD1-CZ 3.44Å; R905-Y910 PolarHBondContact NE-O 3.49Å; R905-Y910 PolarHBondContact NH2-O 2.82Å; P906-Y910 HydrophobicContact CG-CD2 4.07Å; P906-Y910 HydrophobicContact CG-CE2 4.12Å; S907-Y910 PolarHBondContact O-N 2.95Å; S907-Y910 VanDerWaalsContact O-N 3.14Å; S907-Y910 VanDerWaalsContact OG-CD2 3.26Å; S907-Y910 WeakPolarHBondContact OG-CD2 3.45Å; S907-Y910 WeakPolarHBondContact OG-CE2 3.39Å; L908-Y910 PolarHBondContact O-N 3.29Å; Y910-I929 HydrophobicContact CD1-CD1 4.39Å
911	Q	81.6	Confident	83.7	Confident	125 Å²	125	49.8 Å²	49.8	58%	0.584	26%	0.262	S	S	*	.			trans	-76.9	132.6	171.3	-60.6	-175.1	17.1	0	0	109.7	G913	Q911-G913 PolarHBondContact O-N 2.85Å
912	L	83.8	Confident	83.7	Confident	19 Å²	19	52.8 Å²	52.8	10%	0.099	28%	0.283	C	S	.	.			trans	-60.2	-33.3	176	-61.2	170	0	0	0	111.8	I903 R905 F914 A930 L961 I968	I903-L912 HydrophobicContact CG2-CD2 3.96Å; R905-L912 HydrophobicContact CB-CD2 4.31Å; R905-L912 HydrophobicContact CG-CD2 4.27Å; L912-F914 HydrophobicContact CB-CD1 3.87Å; L912-F914 HydrophobicContact CB-CE1 3.87Å; L912-F914 HydrophobicContact CD1-CE1 3.95Å; L912-F914 HydrophobicContact CG-CE1 4.48Å; L912-A930 WeakPolarHBondContact O-CB 3.18Å; L912-A930 PolarHBondContact O-N 2.77Å; L912-L961 HydrophobicContact CD1-CB 3.89Å; L912-L961 HydrophobicContact CD1-CD2 4.19Å; L912-I968 HydrophobicContact CD2-CD1 3.69Å
913	G	82.3	Confident	83.8	Confident	6 Å²	6	54.1 Å²	54.1	6%	0.062	30%	0.295	C	S	.	.			trans	83.4	31.1	178	0	0	0	0	0	114.6	Q911 L925	Q911-G913 PolarHBondContact O-N 2.85Å; G913-L925 WeakPolarHBondContact O-CB 3.38Å; G913-L925 PolarHBondContact O-N 2.95Å
914	F	90.2	Very high	83.8	Confident	26 Å²	26	56 Å²	56	11%	0.114	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	158.8	167.2	75.7	-79.7	0	0	0	111.2	I903 L912 V916 I921 S923 L924 A930 I935 I941 L961 I970	I903-F914 HydrophobicContact CD1-CE1 4.11Å; L912-F914 HydrophobicContact CB-CD1 3.87Å; L912-F914 HydrophobicContact CB-CE1 3.87Å; L912-F914 HydrophobicContact CD1-CE1 3.95Å; L912-F914 HydrophobicContact CG-CE1 4.48Å; F914-V916 HydrophobicContact CE2-CB 4.4Å; F914-I921 HydrophobicContact CB-CG2 4.45Å; F914-I921 HydrophobicContact CD2-CG1 3.98Å; F914-I921 HydrophobicContact CD2-CG2 4.16Å; F914-I921 HydrophobicContact CE2-CG1 4.14Å; F914-S923 CarbonylContact C-O 3.58Å; F914-S923 VanDerWaalsContact CA-O 3.25Å; F914-S923 WeakPolarHBondContact CA-O 3.4Å; F914-S923 WeakPolarHBondContact CB-O 3.19Å; F914-L924 HydrophobicContact CB-CD1 3.76Å; F914-A930 HydrophobicContact CB-CB 4.15Å; F914-A930 HydrophobicContact CD1-CB 3.41Å; F914-A930 VanDerWaalsContact CD1-CB 3.41Å; F914-A930 HydrophobicContact CE1-CB 4.13Å; F914-A930 HydrophobicContact CG-CB 4.14Å; F914-I935 HydrophobicContact CB-CG2 4.28Å; F914-I935 HydrophobicContact CD2-CG2 4.28Å; F914-I935 HydrophobicContact CE1-CG1 4.48Å; F914-I935 HydrophobicContact CG-CG2 4.16Å; F914-I941 HydrophobicContact CE2-CD1 4.07Å; F914-L961 HydrophobicContact CE2-CD1 4.06Å; F914-L961 HydrophobicContact CZ-CD1 3.69Å; F914-L961 HydrophobicContact CZ-CD2 4.06Å; F914-I970 HydrophobicContact CZ-CD1 4.22Å
915	S	88.8	Confident	83.8	Confident	69 Å²	69	55.7 Å²	55.7	48%	0.483	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	131.3	177.4	-57.6	0	0	0	0	110.7	C922 S923	S915-C922 PolarHBondContact O-N 3.44Å; S915-S923 PolarHBondContact N-O 3.36Å
916	V	90.5	Very high	83.6	Confident	22 Å²	22	64.9 Å²	64.9	13%	0.133	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	135.4	176.4	63	0	0	0	0	110.9	F914 V920 I941 I957 V958 L961	F914-V916 HydrophobicContact CE2-CB 4.4Å; V916-V920 CarbonylContact C-O 3.6Å; V916-V920 WeakPolarHBondContact CA-O 3.25Å; V916-I941 HydrophobicContact CB-CD1 4.41Å; V916-I941 HydrophobicContact CG2-CD1 3.93Å; V916-I957 HydrophobicContact CG1-CG2 4.15Å; V916-I957 HydrophobicContact CG2-CG2 4.3Å; V916-V958 HydrophobicContact CG1-CG2 3.78Å; V916-L961 HydrophobicContact CG1-CD1 4.01Å
917	Q	87.9	Confident	83.5	Confident	104 Å²	104	62.3 Å²	62.3	49%	0.486	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	120.5	175	-176	177.8	-7.3	0	0	108.3	G919 V920	Q917-G919 PolarHBondContact O-N 2.94Å; Q917-G919 VanDerWaalsContact O-N 3.1Å; Q917-V920 PolarHBondContact N-O 3.34Å; Q917-V920 PolarHBondContact O-N 3.11Å
918	D	84.6	Confident	83.5	Confident	99 Å²	99	60.7 Å²	60.7	53%	0.529	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.7	39.8	-177.8	-55.1	-43.8	0	0	0	113.9	V920 R940	D918-V920 VanDerWaalsContact C-N 3.26Å; D918-V920 PolarHBondContact O-N 2.73Å; D918-R940 PolarHBondContact O-NH2 2.84Å
919	G	85.2	Confident	83.6	Confident	4 Å²	4	55.9 Å²	55.9	4%	0.041	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.5	-0	-177.2	0	0	0	0	0	115.4	Q917 R940 I941	Q917-G919 PolarHBondContact O-N 2.94Å; Q917-G919 VanDerWaalsContact O-N 3.1Å; G919-R940 CarbonylContact O-C 3.5Å; G919-R940 VanDerWaalsContact O-CA 3.27Å; G919-R940 WeakPolarHBondContact O-CA 3.39Å; G919-I941 PolarHBondContact O-N 3.26Å
920	V	90.1	Very high	84	Confident	20 Å²	20	48.8 Å²	48.8	12%	0.121	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	139.4	176.1	-175.4	0	0	0	0	110.4	V916 Q917 D918 C922 H939 R940 T975	V916-V920 CarbonylContact C-O 3.6Å; V916-V920 WeakPolarHBondContact CA-O 3.25Å; Q917-V920 PolarHBondContact N-O 3.34Å; Q917-V920 PolarHBondContact O-N 3.11Å; D918-V920 VanDerWaalsContact C-N 3.26Å; D918-V920 PolarHBondContact O-N 2.73Å; V920-C922 PolarHBondContact O-N 3.07Å; V920-H939 WeakPolarHBondContact CA-O 3.48Å; V920-R940 HydrophobicContact CG2-CB 4.35Å; V920-T975 HydrophobicContact CG2-CG2 4.48Å
921	I	89.8	Confident	84.4	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	109.5	177.4	-63.8	140.3	0	0	0	109.2	F914 I935 R936 D938 H939 I941 T972	F914-I921 HydrophobicContact CB-CG2 4.45Å; F914-I921 HydrophobicContact CD2-CG1 3.98Å; F914-I921 HydrophobicContact CD2-CG2 4.16Å; F914-I921 HydrophobicContact CE2-CG1 4.14Å; I921-I935 HydrophobicContact CD1-CD1 4.43Å; I921-I935 HydrophobicContact CD1-CG2 3.85Å; I921-I935 HydrophobicContact CG1-CG2 4.21Å; I921-I935 HydrophobicContact CG2-CG2 3.91Å; I921-R936 WeakPolarHBondContact CB-O 3.38Å; I921-R936 WeakPolarHBondContact CG2-O 3.27Å; I921-D938 PolarHBondContact O-N 3.39Å; I921-H939 HydrophobicContact CD1-CB 3.98Å; I921-H939 WeakPolarHBondContact CD1-O 3.48Å; I921-H939 PolarHBondContact N-O 3.09Å; I921-I941 HydrophobicContact CD1-CG1 4.01Å; I921-I941 HydrophobicContact CG1-CD1 4.42Å; I921-I941 HydrophobicContact CG1-CG1 4.24Å; I921-T972 HydrophobicContact CD1-CG2 4.16Å
922	C	86.7	Confident	84.1	Confident	65 Å²	65	46.8 Å²	46.8	44%	0.439	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	-24.9	-175.6	-67	0	0	0	0	113.9	S915 V920	S915-C922 PolarHBondContact O-N 3.44Å; V920-C922 PolarHBondContact O-N 3.07Å
923	S	86.9	Confident	83.8	Confident	59 Å²	59	46 Å²	46	41%	0.413	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	147	179.4	-173.4	0	0	0	0	110.6	F914 S915	F914-S923 CarbonylContact C-O 3.58Å; F914-S923 VanDerWaalsContact CA-O 3.25Å; F914-S923 WeakPolarHBondContact CA-O 3.4Å; F914-S923 WeakPolarHBondContact CB-O 3.19Å; S915-S923 PolarHBondContact N-O 3.36Å
924	L	85.7	Confident	83.7	Confident	38 Å²	38	45.8 Å²	45.8	20%	0.199	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	129	-177.8	-176	64.6	0	0	0	108.2	F914 A930 E931 I935 V937	F914-L924 HydrophobicContact CB-CD1 3.76Å; L924-A930 HydrophobicContact CD1-CB 3.97Å; L924-E931 HydrophobicContact CD1-CB 4.15Å; L924-E931 HydrophobicContact CD2-CB 3.98Å; L924-E931 HydrophobicContact CD2-CG 4Å; L924-E931 HydrophobicContact CG-CB 4.09Å; L924-I935 HydrophobicContact CD1-CB 4.24Å; L924-I935 HydrophobicContact CD1-CG2 3.91Å; L924-I935 WeakPolarHBondContact CD2-O 3.5Å; L924-V937 HydrophobicContact CB-CG2 3.7Å; L924-V937 HydrophobicContact CD2-CG2 4.31Å
925	L	82.1	Confident	83.5	Confident	92 Å²	92	44.6 Å²	44.6	48%	0.482	24%	0.236	S	C	.	.			trans	-78.7	119.6	175.1	-63.9	-174.5	0	0	0	109.5	G913 G927 G928	G913-L925 WeakPolarHBondContact O-CB 3.38Å; G913-L925 PolarHBondContact O-N 2.95Å; L925-G927 PolarHBondContact O-N 3.12Å; L925-G928 PolarHBondContact O-N 3.02Å
926	R	77	Confident	83.3	Confident	212 Å²	212	42.7 Å²	42.7	80%	0.8	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	128.1	175.5	-169.4	72.4	-179	93.1	0	110.1	G928 E931	R926-G928 VanDerWaalsContact C-N 3.27Å; R926-G928 PolarHBondContact O-N 3.1Å; R926-E931 WeakPolarHBondContact CA-OE2 3.44Å; R926-E931 WeakPolarHBondContact CD-OE1 3.3Å; R926-E931 WeakPolarHBondContact CD-OE2 3.34Å; R926-E931 IonicContact CZ-OE1 2.62Å; R926-E931 IonicContact CZ-OE2 3.57Å; R926-E931 IonicContact NE-OE1 3.78Å; R926-E931 IonicContact NE-OE2 3.6Å; R926-E931 IonicContact NH1-OE1 3.78Å; R926-E931 PolarHBondContact NH1-OE1 3.04Å; R926-E931 IonicContact NH1-OE2 3.41Å; R926-E931 PolarHBondContact NH1-OE2 2.83Å
927	G	71.6	Confident	83.2	Confident	25 Å²	25	43.6 Å²	43.6	26%	0.258	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.4	-8.5	-177.2	0	0	0	0	0	114.9	L788 L925 E931 R932	L788-G927 WeakPolarHBondContact CD2-O 3.48Å; L925-G927 PolarHBondContact O-N 3.12Å; G927-E931 PolarHBondContact N-OE2 3.45Å; G927-R932 PolarHBondContact O-NE 3.43Å; G927-R932 PolarHBondContact O-NH2 3.49Å
928	G	77.6	Confident	83.1	Confident	5 Å²	5	43.3 Å²	43.3	5%	0.052	23%	0.226	C	C	.	.	S	Bend	trans	-72.4	167.2	-175.7	0	0	0	0	0	114.7	L925 R926 A930 E931 R932	L925-G928 PolarHBondContact O-N 3.02Å; R926-G928 VanDerWaalsContact C-N 3.27Å; R926-G928 PolarHBondContact O-N 3.1Å; G928-A930 VanDerWaalsContact C-N 3.27Å; G928-A930 PolarHBondContact O-N 3.34Å; G928-E931 PolarHBondContact O-N 2.67Å; G928-E931 VanDerWaalsContact O-N 3.16Å; G928-R932 PolarHBondContact O-N 2.83Å
929	I	82.3	Confident	83.2	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-52.7	-43.6	-176.4	-54.4	-178.1	0	0	0	111.4	Y784 I787 L788 Q791 I903 R904 Y910 G933	Y784-I929 HydrophobicContact CE2-CD1 4.22Å; I787-I929 HydrophobicContact CG2-CD1 4.24Å; L788-I929 HydrophobicContact CD2-CG1 4.18Å; Q791-I929 VanDerWaalsContact NE2-CG2 3.33Å; Q791-I929 PolarHBondContact NE2-O 2.96Å; Q791-I929 VanDerWaalsContact NE2-O 3.15Å; I903-I929 HydrophobicContact CG2-CG2 3.51Å; R904-I929 VanDerWaalsContact O-CG2 3.28Å; R904-I929 WeakPolarHBondContact O-CG2 3.49Å; Y910-I929 HydrophobicContact CD1-CD1 4.39Å; I929-G933 PolarHBondContact O-N 2.81Å
930	A	85.1	Confident	83.5	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-69.1	-39	179.4	0	0	0	0	0	114.9	I903 L912 F914 L924 G928 R932 G933 G934 I935	I903-A930 HydrophobicContact CD1-CB 4.17Å; L912-A930 WeakPolarHBondContact O-CB 3.18Å; L912-A930 PolarHBondContact O-N 2.77Å; F914-A930 HydrophobicContact CB-CB 4.15Å; F914-A930 HydrophobicContact CD1-CB 3.41Å; F914-A930 VanDerWaalsContact CD1-CB 3.41Å; F914-A930 HydrophobicContact CE1-CB 4.13Å; F914-A930 HydrophobicContact CG-CB 4.14Å; L924-A930 HydrophobicContact CD1-CB 3.97Å; G928-A930 VanDerWaalsContact C-N 3.27Å; G928-A930 PolarHBondContact O-N 3.34Å; A930-R932 VanDerWaalsContact C-N 3.35Å; A930-G933 PolarHBondContact O-N 2.95Å; A930-G934 PolarHBondContact O-N 2.77Å; A930-I935 HydrophobicContact CB-CB 4.03Å; A930-I935 HydrophobicContact CB-CG1 3.9Å; A930-I935 VanDerWaalsContact O-CB 3.28Å; A930-I935 WeakPolarHBondContact O-CB 3.5Å; A930-I935 PolarHBondContact O-N 2.89Å
931	E	82	Confident	83.5	Confident	43 Å²	43	40.1 Å²	40.1	20%	0.201	20%	0.203	C	C	.	.	H	α-helix	trans	-64.5	-44.5	178.7	-175.4	-175.8	-156.3	0	0	110.4	L924 R926 G927 G928 G934 R936	L924-E931 HydrophobicContact CD1-CB 4.15Å; L924-E931 HydrophobicContact CD2-CB 3.98Å; L924-E931 HydrophobicContact CD2-CG 4Å; L924-E931 HydrophobicContact CG-CB 4.09Å; R926-E931 WeakPolarHBondContact CA-OE2 3.44Å; R926-E931 WeakPolarHBondContact CD-OE1 3.3Å; R926-E931 WeakPolarHBondContact CD-OE2 3.34Å; R926-E931 IonicContact CZ-OE1 2.62Å; R926-E931 IonicContact CZ-OE2 3.57Å; R926-E931 IonicContact NE-OE1 3.78Å; R926-E931 IonicContact NE-OE2 3.6Å; R926-E931 IonicContact NH1-OE1 3.78Å; R926-E931 PolarHBondContact NH1-OE1 3.04Å; R926-E931 IonicContact NH1-OE2 3.41Å; R926-E931 PolarHBondContact NH1-OE2 2.83Å; G927-E931 PolarHBondContact N-OE2 3.45Å; G928-E931 PolarHBondContact O-N 2.67Å; G928-E931 VanDerWaalsContact O-N 3.16Å; E931-G934 PolarHBondContact O-N 2.85Å; E931-R936 PolarHBondContact O-NH1 3.05Å
932	R	76.7	Confident	83.6	Confident	75 Å²	75	41.2 Å²	41.2	28%	0.283	21%	0.209	S	C	.	.	H	α-helix	trans	-63.8	-38.2	175.9	-67.6	-174.9	-163	-139.2	2.3	112.4	L788 Q791 F794 G927 G928 A930 G934	L788-R932 PolarHBondContact O-NH1 3.36Å; Q791-R932 HydrophobicContact CB-CB 4.19Å; Q791-R932 HydrophobicContact CG-CB 3.65Å; F794-R932 PolarHBondContact N-O 3.16Å; G927-R932 PolarHBondContact O-NE 3.43Å; G927-R932 PolarHBondContact O-NH2 3.49Å; G928-R932 PolarHBondContact O-N 2.83Å; A930-R932 VanDerWaalsContact C-N 3.35Å; R932-G934 PolarHBondContact O-N 3.36Å
933	G	76.8	Confident	83.8	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.01	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-9.5	175.3	0	0	0	0	0	115.4	V901 L902 I929 A930	V901-G933 WeakPolarHBondContact CG1-O 3.45Å; L902-G933 PolarHBondContact N-O 2.88Å; L902-G933 VanDerWaalsContact O-CA 3.23Å; L902-G933 WeakPolarHBondContact O-CA 3.33Å; I929-G933 PolarHBondContact O-N 2.81Å; A930-G933 PolarHBondContact O-N 2.95Å
934	G	79.8	Confident	84.1	Confident	3 Å²	3	38 Å²	38	3%	0.031	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	107.7	4	177.4	0	0	0	0	0	115.9	V901 A930 E931 R932 R936	V901-G934 WeakPolarHBondContact CG2-O 3.47Å; A930-G934 PolarHBondContact O-N 2.77Å; E931-G934 PolarHBondContact O-N 2.85Å; R932-G934 PolarHBondContact O-N 3.36Å; G934-R936 PolarHBondContact O-NH1 3.16Å
935	I	87	Confident	84.2	Confident	0 Å²	0	40 Å²	40	0%	0	19%	0.192	C	C	.	.			trans	-64.9	142.5	175.3	-64.4	-64.9	0	0	0	110	V901 I903 F914 I921 L924 A930 I970 T972	V901-I935 HydrophobicContact CB-CD1 4.17Å; V901-I935 HydrophobicContact CG1-CD1 3.55Å; V901-I935 HydrophobicContact CG1-CG1 3.65Å; V901-I935 HydrophobicContact CG2-CD1 4.19Å; I903-I935 HydrophobicContact CD1-CD1 4.22Å; I903-I935 HydrophobicContact CD1-CG1 3.76Å; F914-I935 HydrophobicContact CB-CG2 4.28Å; F914-I935 HydrophobicContact CD2-CG2 4.28Å; F914-I935 HydrophobicContact CE1-CG1 4.48Å; F914-I935 HydrophobicContact CG-CG2 4.16Å; I921-I935 HydrophobicContact CD1-CD1 4.43Å; I921-I935 HydrophobicContact CD1-CG2 3.85Å; I921-I935 HydrophobicContact CG1-CG2 4.21Å; I921-I935 HydrophobicContact CG2-CG2 3.91Å; L924-I935 HydrophobicContact CD1-CB 4.24Å; L924-I935 HydrophobicContact CD1-CG2 3.91Å; L924-I935 WeakPolarHBondContact CD2-O 3.5Å; A930-I935 HydrophobicContact CB-CB 4.03Å; A930-I935 HydrophobicContact CB-CG1 3.9Å; A930-I935 VanDerWaalsContact O-CB 3.28Å; A930-I935 WeakPolarHBondContact O-CB 3.5Å; A930-I935 PolarHBondContact O-N 2.89Å; I935-I970 HydrophobicContact CD1-CD1 4.35Å; I935-I970 HydrophobicContact CD1-CG2 4.21Å; I935-T972 HydrophobicContact CD1-CG2 3.94Å
936	R	85	Confident	84.5	Confident	30 Å²	30	38.8 Å²	38.8	11%	0.113	20%	0.201	C	C	.	.			trans	-131.9	148	179.2	-60	-59.7	-177.6	-103.8	4.1	111.3	C795 W829 G830 I921 E931 G934	C795-R936 PolarHBondContact SG-NH2 2.9Å; W829-R936 WeakPolarHBondContact O-CD 3.49Å; G830-R936 VanDerWaalsContact C-NE 3.32Å; G830-R936 PolarHBondContact O-NE 3.36Å; G830-R936 PolarHBondContact O-NH2 3.2Å; G830-R936 VanDerWaalsContact O-NH2 3.14Å; I921-R936 WeakPolarHBondContact CB-O 3.38Å; I921-R936 WeakPolarHBondContact CG2-O 3.27Å; E931-R936 PolarHBondContact O-NH1 3.05Å; G934-R936 PolarHBondContact O-NH1 3.16Å
937	V	86.5	Confident	85.1	Confident	41 Å²	41	32.3 Å²	32.3	25%	0.248	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	151.6	175.5	-176.5	0	0	0	0	109.7	L924 H939	L924-V937 HydrophobicContact CB-CG2 3.7Å; L924-V937 HydrophobicContact CD2-CG2 4.31Å; V937-H939 PolarHBondContact O-N 3.21Å; V937-H939 VanDerWaalsContact O-N 3.1Å
938	D	86.2	Confident	86	Confident	97 Å²	97	34.3 Å²	34.3	52%	0.519	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	62	7.7	-174.1	-69.4	-41.6	0	0	0	115.5	I921 T975	I921-D938 PolarHBondContact O-N 3.39Å; D938-T975 WeakPolarHBondContact O-CB 3.5Å; D938-T975 PolarHBondContact O-N 3.46Å; D938-T975 PolarHBondContact O-OG1 2.93Å
939	H	88.2	Confident	86.6	Confident	9 Å²	9	34.2 Å²	34.2	4%	0.042	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	143.6	167	-74.3	-149.2	0	0	0	110.5	V920 I921 V937 T972	V920-H939 WeakPolarHBondContact CA-O 3.48Å; I921-H939 HydrophobicContact CD1-CB 3.98Å; I921-H939 WeakPolarHBondContact CD1-O 3.48Å; I921-H939 PolarHBondContact N-O 3.09Å; V937-H939 PolarHBondContact O-N 3.21Å; V937-H939 VanDerWaalsContact O-N 3.1Å; H939-T972 PolarHBondContact ND1-OG1 2.99Å; H939-T972 VanDerWaalsContact ND1-OG1 3.15Å
940	R	89.7	Confident	86.8	Confident	46 Å²	46	37.1 Å²	37.1	17%	0.174	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	132.7	169.5	169.8	163.1	-88.3	-162.1	-10.9	109.5	D918 G919 V920 I942 T972 M973	D918-R940 PolarHBondContact O-NH2 2.84Å; G919-R940 CarbonylContact O-C 3.5Å; G919-R940 VanDerWaalsContact O-CA 3.27Å; G919-R940 WeakPolarHBondContact O-CA 3.39Å; V920-R940 HydrophobicContact CG2-CB 4.35Å; R940-I942 HydrophobicContact CG-CD1 4.17Å; R940-T972 CarbonylContact O-C 3.56Å; R940-T972 WeakPolarHBondContact O-CA 3.5Å; R940-M973 PolarHBondContact N-O 3.38Å; R940-M973 PolarHBondContact O-N 3.38Å
941	I	91.5	Very high	86.8	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.005	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	133.8	173.4	-48.4	177.8	0	0	0	108.9	F914 V916 G919 I921 I944 V949 L961 I970	F914-I941 HydrophobicContact CE2-CD1 4.07Å; V916-I941 HydrophobicContact CB-CD1 4.41Å; V916-I941 HydrophobicContact CG2-CD1 3.93Å; G919-I941 PolarHBondContact O-N 3.26Å; I921-I941 HydrophobicContact CD1-CG1 4.01Å; I921-I941 HydrophobicContact CG1-CD1 4.42Å; I921-I941 HydrophobicContact CG1-CG1 4.24Å; I941-I944 HydrophobicContact CG2-CD1 4.04Å; I941-I944 HydrophobicContact CG2-CG1 3.64Å; I941-V949 HydrophobicContact CB-CG2 4.05Å; I941-V949 HydrophobicContact CG2-CG2 3.66Å; I941-L961 HydrophobicContact CD1-CD1 4.49Å; I941-I970 HydrophobicContact CG1-CG2 4.48Å; I941-I970 HydrophobicContact CG2-CG2 3.62Å
942	I	90.7	Very high	87	Confident	24 Å²	24	41.8 Å²	41.8	12%	0.123	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	-47.3	-177.7	-54.7	-58.9	0	0	0	110.4	R940 S948 V949 V950 R971 M973 F978	R940-I942 HydrophobicContact CG-CD1 4.17Å; I942-S948 CarbonylContact O-C 3.49Å; I942-S948 WeakPolarHBondContact O-CA 3.35Å; I942-S948 PolarHBondContact O-OG 2.8Å; I942-V949 PolarHBondContact O-N 3.44Å; I942-V950 HydrophobicContact CB-CG2 4.29Å; I942-V950 HydrophobicContact CD1-CG2 3.93Å; I942-V950 HydrophobicContact CG2-CG2 3.86Å; I942-R971 PolarHBondContact N-O 2.92Å; I942-M973 HydrophobicContact CD1-CB 4.04Å; I942-M973 HydrophobicContact CG1-CB 3.78Å; I942-F978 HydrophobicContact CD1-CD2 3.66Å; I942-F978 HydrophobicContact CD1-CE2 3.84Å
943	E	92.1	Very high	87.7	Confident	53 Å²	53	41.5 Å²	41.5	25%	0.248	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	147.5	178.3	-72.3	160.4	-158.5	0	0	110.7	E947 R971	E943-E947 CarbonylContact C-O 3.56Å; E943-E947 VanDerWaalsContact CA-O 3.27Å; E943-E947 WeakPolarHBondContact CA-O 3.45Å; E943-R971 HydrophobicContact CB-CB 4.17Å; E943-R971 HydrophobicContact CB-CG 4.5Å; E943-R971 PolarHBondContact N-O 3.12Å; E943-R971 PolarHBondContact O-N 3.29Å; E943-R971 WeakPolarHBondContact OE2-CD 3.37Å; E943-R971 IonicContact OE2-CZ 2.72Å; E943-R971 IonicContact OE2-NE 3.74Å; E943-R971 IonicContact OE2-NH1 3.88Å; E943-R971 PolarHBondContact OE2-NH1 3.47Å
944	I	91.9	Very high	88.2	Confident	3 Å²	3	45.5 Å²	45.5	2%	0.015	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	120.1	171.4	-56.5	-179.8	0	0	0	107.5	I941 G946 E947 V949 I957 L961 I968 H969	I941-I944 HydrophobicContact CG2-CD1 4.04Å; I941-I944 HydrophobicContact CG2-CG1 3.64Å; I944-G946 PolarHBondContact O-N 3.12Å; I944-G946 VanDerWaalsContact O-N 3.13Å; I944-E947 PolarHBondContact N-O 3.34Å; I944-E947 PolarHBondContact O-N 3.48Å; I944-V949 HydrophobicContact CB-CG1 4.34Å; I944-V949 HydrophobicContact CD1-CG1 3.96Å; I944-V949 HydrophobicContact CD1-CG2 4.38Å; I944-V949 HydrophobicContact CG1-CG1 3.98Å; I944-V949 HydrophobicContact CG1-CG2 4.2Å; I944-I957 HydrophobicContact CD1-CG2 3.89Å; I944-L961 HydrophobicContact CD1-CD1 4.39Å; I944-L961 HydrophobicContact CD1-CD2 3.91Å; I944-L961 HydrophobicContact CD1-CG 3.93Å; I944-L961 HydrophobicContact CG2-CD2 4.33Å; I944-I968 HydrophobicContact CG2-CG2 4.34Å; I944-H969 CarbonylContact C-O 3.59Å; I944-H969 WeakPolarHBondContact CA-O 3.29Å
945	N	88.6	Confident	88.7	Confident	80 Å²	80	51.9 Å²	51.9	43%	0.428	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.3	34.6	-177.5	-58.4	-27.2	0	0	0	113.5	E947 S964 I968 H969	N945-E947 VanDerWaalsContact C-N 3.32Å; N945-E947 PolarHBondContact O-N 3.06Å; N945-S964 PolarHBondContact ND2-OG 2.88Å; N945-I968 WeakPolarHBondContact OD1-CA 3.41Å; N945-H969 PolarHBondContact N-O 3.3Å; N945-H969 PolarHBondContact OD1-N 3.15Å
946	G	87.4	Confident	88.9	Confident	66 Å²	66	55.7 Å²	55.7	68%	0.68	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.1	-5.7	-175.6	0	0	0	0	0	115.7	I944	I944-G946 PolarHBondContact O-N 3.12Å; I944-G946 VanDerWaalsContact O-N 3.13Å
947	E	90	Very high	89.2	Confident	76 Å²	76	54.3 Å²	54.3	36%	0.355	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	121.8	170.8	-171.9	174.8	-176.2	0	0	110.5	E943 I944 N945 V949 K956	E943-E947 CarbonylContact C-O 3.56Å; E943-E947 VanDerWaalsContact CA-O 3.27Å; E943-E947 WeakPolarHBondContact CA-O 3.45Å; I944-E947 PolarHBondContact N-O 3.34Å; I944-E947 PolarHBondContact O-N 3.48Å; N945-E947 VanDerWaalsContact C-N 3.32Å; N945-E947 PolarHBondContact O-N 3.06Å; E947-V949 PolarHBondContact O-N 3.14Å; E947-K956 IonicContact OE1-NZ 2.9Å; E947-K956 PolarHBondContact OE1-NZ 3.32Å; E947-K956 IonicContact OE2-NZ 4Å
948	S	91.4	Very high	89.3	Confident	68 Å²	68	55.4 Å²	55.4	48%	0.476	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	122.8	175.7	-175.6	0	0	0	0	111.5	I942	I942-S948 CarbonylContact O-C 3.49Å; I942-S948 WeakPolarHBondContact O-CA 3.35Å; I942-S948 PolarHBondContact O-OG 2.8Å
949	V	90.3	Very high	89.4	Confident	3 Å²	3	56.8 Å²	56.8	2%	0.018	33%	0.327	C	S	.	.			trans	-103.7	-0.7	-175.4	-66.2	0	0	0	0	114.4	I941 I942 I944 E947 A951 V952 I957 L960	I941-V949 HydrophobicContact CB-CG2 4.05Å; I941-V949 HydrophobicContact CG2-CG2 3.66Å; I942-V949 PolarHBondContact O-N 3.44Å; I944-V949 HydrophobicContact CB-CG1 4.34Å; I944-V949 HydrophobicContact CD1-CG1 3.96Å; I944-V949 HydrophobicContact CD1-CG2 4.38Å; I944-V949 HydrophobicContact CG1-CG1 3.98Å; I944-V949 HydrophobicContact CG1-CG2 4.2Å; E947-V949 PolarHBondContact O-N 3.14Å; V949-A951 PolarHBondContact O-N 3.17Å; V949-A951 VanDerWaalsContact O-N 3.08Å; V949-V952 HydrophobicContact CB-CB 4.4Å; V949-V952 WeakPolarHBondContact O-CB 3.42Å; V949-V952 PolarHBondContact O-N 3.42Å; V949-I957 HydrophobicContact CB-CD1 4.03Å; V949-I957 HydrophobicContact CB-CG1 4Å; V949-I957 HydrophobicContact CG1-CG1 4.24Å; V949-I957 HydrophobicContact CG2-CD1 4.48Å; V949-L960 HydrophobicContact CG1-CD1 4.2Å
950	V	85.6	Confident	89.5	Confident	60 Å²	60	58 Å²	58	36%	0.364	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-28.5	-174.1	-178.7	0	0	0	0	113.8	I942 F978	I942-V950 HydrophobicContact CB-CG2 4.29Å; I942-V950 HydrophobicContact CD1-CG2 3.93Å; I942-V950 HydrophobicContact CG2-CG2 3.86Å; V950-F978 HydrophobicContact CG1-CE2 3.78Å; V950-F978 HydrophobicContact CG1-CZ 3.58Å; V950-F978 HydrophobicContact CG2-CE2 4.44Å
951	A	84.4	Confident	89.5	Confident	106 Å²	106	56.3 Å²	56.3	88%	0.876	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.8	14.9	179.4	0	0	0	0	0	113.5	V949	V949-A951 PolarHBondContact O-N 3.17Å; V949-A951 VanDerWaalsContact O-N 3.08Å
952	V	88.1	Confident	89.3	Confident	36 Å²	36	58.6 Å²	58.6	22%	0.218	35%	0.347	C	S	.	.	S	Bend	trans	-98.8	145.8	-174.7	177.3	0	0	0	0	110.6	V949 K956 I957	V949-V952 HydrophobicContact CB-CB 4.4Å; V949-V952 WeakPolarHBondContact O-CB 3.42Å; V949-V952 PolarHBondContact O-N 3.42Å; V952-K956 HydrophobicContact CG1-CB 3.6Å; V952-K956 HydrophobicContact CG1-CD 3.69Å; V952-K956 HydrophobicContact CG1-CG 3.69Å; V952-I957 HydrophobicContact CB-CG1 4.24Å; V952-I957 HydrophobicContact CG1-CG1 4.02Å
953	S	90.5	Very high	89.1	Confident	68 Å²	68	61.8 Å²	61.8	48%	0.476	37%	0.367	S	S	.	.			trans	-64.6	146.1	176	60.8	0	0	0	0	111.6	E955 K956 I957	S953-E955 PolarHBondContact O-N 2.89Å; S953-E955 VanDerWaalsContact O-N 3.12Å; S953-K956 PolarHBondContact O-N 2.95Å; S953-I957 WeakPolarHBondContact O-CG1 3.35Å; S953-I957 PolarHBondContact O-N 3.5Å; S953-I957 VanDerWaalsContact O-N 3.12Å
954	H	88.1	Confident	88.9	Confident	86 Å²	86	59.9 Å²	59.9	40%	0.398	36%	0.36	S	S	.	.	H	α-helix	trans	-56.4	-34.5	-178.7	85.2	76.5	0	0	0	112.1	K956 I957 V958	H954-K956 PolarHBondContact O-N 2.84Å; H954-I957 PolarHBondContact O-N 3.5Å; H954-V958 WeakPolarHBondContact O-CG2 3.41Å; H954-V958 PolarHBondContact O-N 3.25Å
955	E	89.9	Confident	88.6	Confident	136 Å²	136	63.4 Å²	63.4	64%	0.636	38%	0.382	S	S	*	.	H	α-helix	trans	-59.2	-46.4	177.8	-60.5	-179.6	152.6	0	0	111.7	S953 V958 Q959	S953-E955 PolarHBondContact O-N 2.89Å; S953-E955 VanDerWaalsContact O-N 3.12Å; E955-V958 PolarHBondContact O-N 3Å; E955-Q959 WeakPolarHBondContact O-CB 3.34Å; E955-Q959 PolarHBondContact O-N 3Å
956	K	90.4	Very high	88.3	Confident	80 Å²	80	61.2 Å²	61.2	35%	0.348	38%	0.378	S	S	.	.	H	α-helix	trans	-70.2	-34	177.7	178.6	176.5	172.3	-154.4	0	111.5	E947 V952 S953 H954 Q959 L960	E947-K956 IonicContact OE1-NZ 2.9Å; E947-K956 PolarHBondContact OE1-NZ 3.32Å; E947-K956 IonicContact OE2-NZ 4Å; V952-K956 HydrophobicContact CG1-CB 3.6Å; V952-K956 HydrophobicContact CG1-CD 3.69Å; V952-K956 HydrophobicContact CG1-CG 3.69Å; S953-K956 PolarHBondContact O-N 2.95Å; H954-K956 PolarHBondContact O-N 2.84Å; K956-Q959 PolarHBondContact O-N 3.32Å; K956-L960 HydrophobicContact CG-CD1 4.32Å; K956-L960 HydrophobicContact CG-CG 4.45Å; K956-L960 WeakPolarHBondContact O-CB 3.41Å; K956-L960 VanDerWaalsContact O-CG 3.31Å; K956-L960 WeakPolarHBondContact O-CG 3.36Å; K956-L960 PolarHBondContact O-N 3.23Å
957	I	90.9	Very high	88.2	Confident	1 Å²	1	62.7 Å²	62.7	1%	0.005	37%	0.367	C	S	.	.	H	α-helix	trans	-61.7	-48.1	172.8	-59.9	177.5	0	0	0	110.4	V916 I944 V949 V952 S953 H954 Q959 L960 L961	V916-I957 HydrophobicContact CG1-CG2 4.15Å; V916-I957 HydrophobicContact CG2-CG2 4.3Å; I944-I957 HydrophobicContact CD1-CG2 3.89Å; V949-I957 HydrophobicContact CB-CD1 4.03Å; V949-I957 HydrophobicContact CB-CG1 4Å; V949-I957 HydrophobicContact CG1-CG1 4.24Å; V949-I957 HydrophobicContact CG2-CD1 4.48Å; V952-I957 HydrophobicContact CB-CG1 4.24Å; V952-I957 HydrophobicContact CG1-CG1 4.02Å; S953-I957 WeakPolarHBondContact O-CG1 3.35Å; S953-I957 PolarHBondContact O-N 3.5Å; S953-I957 VanDerWaalsContact O-N 3.12Å; H954-I957 PolarHBondContact O-N 3.5Å; I957-Q959 VanDerWaalsContact C-N 3.32Å; I957-Q959 PolarHBondContact O-N 2.97Å; I957-L960 PolarHBondContact O-N 2.86Å; I957-L961 HydrophobicContact CG2-CD1 4.22Å; I957-L961 WeakPolarHBondContact O-CG 3.47Å; I957-L961 PolarHBondContact O-N 3.25Å
958	V	89.7	Confident	88.1	Confident	65 Å²	65	59.1 Å²	59.1	39%	0.394	35%	0.351	S	S	.	.	H	α-helix	trans	-62.5	-40	175.8	172.2	0	0	0	0	110.7	V916 H954 E955 L961 A962	V916-V958 HydrophobicContact CG1-CG2 3.78Å; H954-V958 WeakPolarHBondContact O-CG2 3.41Å; H954-V958 PolarHBondContact O-N 3.25Å; E955-V958 PolarHBondContact O-N 3Å; V958-L961 PolarHBondContact O-N 3.22Å; V958-A962 WeakPolarHBondContact O-CB 3.49Å; V958-A962 PolarHBondContact O-N 3.28Å
959	Q	88.7	Confident	88.1	Confident	125 Å²	125	59.7 Å²	59.7	58%	0.584	35%	0.346	S	S	*	.	H	α-helix	trans	-62.8	-45	176.5	-169.8	177.2	13.8	0	0	112.1	E955 K956 I957 A962 T963	E955-Q959 WeakPolarHBondContact O-CB 3.34Å; E955-Q959 PolarHBondContact O-N 3Å; K956-Q959 PolarHBondContact O-N 3.32Å; I957-Q959 VanDerWaalsContact C-N 3.32Å; I957-Q959 PolarHBondContact O-N 2.97Å; Q959-A962 PolarHBondContact O-N 3.34Å; Q959-T963 WeakPolarHBondContact O-CG2 3.41Å; Q959-T963 PolarHBondContact O-N 3.06Å; Q959-T963 PolarHBondContact O-OG1 3.44Å
960	L	90.1	Very high	88.1	Confident	36 Å²	36	59.6 Å²	59.6	19%	0.188	35%	0.345	C	S	.	.	H	α-helix	trans	-60.4	-45.8	176	-73.9	168.2	0	0	0	111.7	V949 K956 I957 T963 S964	V949-L960 HydrophobicContact CG1-CD1 4.2Å; K956-L960 HydrophobicContact CG-CD1 4.32Å; K956-L960 HydrophobicContact CG-CG 4.45Å; K956-L960 WeakPolarHBondContact O-CB 3.41Å; K956-L960 VanDerWaalsContact O-CG 3.31Å; K956-L960 WeakPolarHBondContact O-CG 3.36Å; K956-L960 PolarHBondContact O-N 3.23Å; I957-L960 PolarHBondContact O-N 2.86Å; L960-T963 PolarHBondContact O-OG1 3.15Å; L960-S964 VanDerWaalsContact O-CB 3.29Å; L960-S964 WeakPolarHBondContact O-CB 3.36Å; L960-S964 PolarHBondContact O-N 3.29Å; L960-S964 PolarHBondContact O-OG 3.05Å
961	L	88.6	Confident	88.3	Confident	9 Å²	9	61.2 Å²	61.2	5%	0.047	35%	0.345	C	S	.	.	H	α-helix	trans	-66	-38.8	176.2	-70.4	172.2	0	0	0	112.2	R905 L912 F914 V916 I941 I944 I957 V958 I970	R905-L961 PolarHBondContact NH1-O 3.46Å; L912-L961 HydrophobicContact CD1-CB 3.89Å; L912-L961 HydrophobicContact CD1-CD2 4.19Å; F914-L961 HydrophobicContact CE2-CD1 4.06Å; F914-L961 HydrophobicContact CZ-CD1 3.69Å; F914-L961 HydrophobicContact CZ-CD2 4.06Å; V916-L961 HydrophobicContact CG1-CD1 4.01Å; I941-L961 HydrophobicContact CD1-CD1 4.49Å; I944-L961 HydrophobicContact CD1-CD1 4.39Å; I944-L961 HydrophobicContact CD1-CD2 3.91Å; I944-L961 HydrophobicContact CD1-CG 3.93Å; I944-L961 HydrophobicContact CG2-CD2 4.33Å; I957-L961 HydrophobicContact CG2-CD1 4.22Å; I957-L961 WeakPolarHBondContact O-CG 3.47Å; I957-L961 PolarHBondContact O-N 3.25Å; V958-L961 PolarHBondContact O-N 3.22Å; L961-I970 HydrophobicContact CD2-CD1 3.65Å
962	A	87	Confident	88.6	Confident	49 Å²	49	56.1 Å²	56.1	41%	0.405	30%	0.303	S	S	.	.	H	α-helix	trans	-68.5	-39.6	-179.8	0	0	0	0	0	112.2	R905 L908 V958 Q959	R905-A962 PolarHBondContact NH1-O 2.86Å; L908-A962 WeakPolarHBondContact CD2-O 3.14Å; V958-A962 WeakPolarHBondContact O-CB 3.49Å; V958-A962 PolarHBondContact O-N 3.28Å; Q959-A962 PolarHBondContact O-N 3.34Å
963	T	87.6	Confident	88.5	Confident	91 Å²	91	55 Å²	55	56%	0.558	30%	0.295	S	S	*	.	H	α-helix	trans	-82.7	-21.1	179.4	56.1	0	0	0	0	114	Q959 L960 V965	Q959-T963 WeakPolarHBondContact O-CG2 3.41Å; Q959-T963 PolarHBondContact O-N 3.06Å; Q959-T963 PolarHBondContact O-OG1 3.44Å; L960-T963 PolarHBondContact O-OG1 3.15Å; T963-V965 PolarHBondContact O-N 3.08Å
964	S	86.9	Confident	88.3	Confident	13 Å²	13	52.4 Å²	52.4	9%	0.091	28%	0.277	C	S	.	.			trans	-68.9	130.2	179.7	-66.1	0	0	0	0	112.2	R905 N945 L960	R905-S964 VanDerWaalsContact CD-O 3.29Å; R905-S964 WeakPolarHBondContact CD-O 3.27Å; R905-S964 PolarHBondContact NH1-O 3.44Å; N945-S964 PolarHBondContact ND2-OG 2.88Å; L960-S964 VanDerWaalsContact O-CB 3.29Å; L960-S964 WeakPolarHBondContact O-CB 3.36Å; L960-S964 PolarHBondContact O-N 3.29Å; L960-S964 PolarHBondContact O-OG 3.05Å
965	V	85.2	Confident	88.2	Confident	77 Å²	77	49 Å²	49	47%	0.467	26%	0.262	S	S	.	.			trans	-137.3	159.9	174.3	-68.1	0	0	0	0	109.1	R905 L908 T963	R905-V965 CarbonylContact O-C 3.54Å; R905-V965 WeakPolarHBondContact O-CA 3.24Å; L908-V965 HydrophobicContact CD2-CG1 3.51Å; L908-V965 HydrophobicContact CG-CG1 3.83Å; T963-V965 PolarHBondContact O-N 3.08Å
966	G	83.2	Confident	87.9	Confident	35 Å²	35	44.7 Å²	44.7	36%	0.361	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	82.4	-132.6	-169.5	0	0	0	0	0	111.2	R904 R905	R904-G966 WeakPolarHBondContact CA-O 3.24Å; R905-G966 PolarHBondContact N-O 2.76Å; R905-G966 PolarHBondContact O-N 3.31Å
967	E	85.7	Confident	87.6	Confident	96 Å²	96	40.9 Å²	40.9	45%	0.449	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	102.5	-176.6	-63.7	-159.4	133.7	0	0	111.7	L902 R904 H969	L902-E967 HydrophobicContact CD1-CB 4.02Å; R904-E967 HydrophobicContact CG-CG 4.3Å; R904-E967 IonicContact CZ-OE1 3.95Å; R904-E967 VanDerWaalsContact CZ-OE1 3.25Å; R904-E967 IonicContact NE-OE1 3.21Å; R904-E967 PolarHBondContact NE-OE1 2.75Å; R904-E967 IonicContact NH2-OE1 3.57Å; R904-E967 PolarHBondContact NH2-OE1 2.84Å; E967-H969 PolarHBondContact O-ND1 2.88Å; E967-H969 VanDerWaalsContact O-ND1 3.11Å
968	I	88.6	Confident	87.4	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	114.6	-178.5	-42.8	177.6	0	0	0	108.8	I903 R905 L912 I944 N945 I970	I903-I968 HydrophobicContact CB-CB 4.27Å; I903-I968 PolarHBondContact N-O 3.49Å; I903-I968 PolarHBondContact O-N 3.38Å; R905-I968 HydrophobicContact CB-CD1 4.08Å; L912-I968 HydrophobicContact CD2-CD1 3.69Å; I944-I968 HydrophobicContact CG2-CG2 4.34Å; N945-I968 WeakPolarHBondContact OD1-CA 3.41Å; I968-I970 HydrophobicContact CG2-CD1 4.11Å; I968-I970 HydrophobicContact CG2-CG1 3.91Å
969	H	90.5	Very high	87.3	Confident	81 Å²	81	44.1 Å²	44.1	38%	0.375	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	116.7	-179.8	-65.4	70.6	0	0	0	108.9	I944 N945 E967	I944-H969 CarbonylContact C-O 3.59Å; I944-H969 WeakPolarHBondContact CA-O 3.29Å; N945-H969 PolarHBondContact N-O 3.3Å; N945-H969 PolarHBondContact OD1-N 3.15Å; E967-H969 PolarHBondContact O-ND1 2.88Å; E967-H969 VanDerWaalsContact O-ND1 3.11Å
970	I	91	Very high	87.1	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	130	-176.6	-55.4	-175.1	0	0	0	108.9	V901 I903 F914 I935 I941 L961 I968 T972	V901-I970 HydrophobicContact CB-CB 4.29Å; V901-I970 WeakPolarHBondContact CB-O 3.33Å; V901-I970 PolarHBondContact N-O 2.99Å; V901-I970 PolarHBondContact O-N 3.36Å; I903-I970 HydrophobicContact CD1-CD1 3.64Å; I903-I970 HydrophobicContact CG1-CD1 4.4Å; F914-I970 HydrophobicContact CZ-CD1 4.22Å; I935-I970 HydrophobicContact CD1-CD1 4.35Å; I935-I970 HydrophobicContact CD1-CG2 4.21Å; I941-I970 HydrophobicContact CG1-CG2 4.48Å; I941-I970 HydrophobicContact CG2-CG2 3.62Å; L961-I970 HydrophobicContact CD2-CD1 3.65Å; I968-I970 HydrophobicContact CG2-CD1 4.11Å; I968-I970 HydrophobicContact CG2-CG1 3.91Å; I970-T972 HydrophobicContact CG2-CG2 3.83Å
971	R	89.7	Confident	86.8	Confident	94 Å²	94	41.5 Å²	41.5	36%	0.355	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	125.9	170.9	-67.8	-174.4	-179.3	159.4	-8	110.2	V898 V899 E900 I942 E943	V898-R971 HydrophobicContact CG1-CB 3.75Å; V898-R971 HydrophobicContact CG1-CG 4.22Å; V899-R971 WeakPolarHBondContact O-CA 3.45Å; E900-R971 HydrophobicContact CB-CG 4.42Å; E900-R971 HydrophobicContact CG-CG 4.27Å; E900-R971 IonicContact OE1-CZ 3.87Å; E900-R971 IonicContact OE1-NE 2.77Å; E900-R971 PolarHBondContact OE1-NE 3.45Å; E900-R971 IonicContact OE1-NH2 2.71Å; E900-R971 PolarHBondContact OE1-NH2 3.11Å; E900-R971 IonicContact OE2-NH2 2.75Å; I942-R971 PolarHBondContact N-O 2.92Å; E943-R971 HydrophobicContact CB-CB 4.17Å; E943-R971 HydrophobicContact CB-CG 4.5Å; E943-R971 PolarHBondContact N-O 3.12Å; E943-R971 PolarHBondContact O-N 3.29Å; E943-R971 WeakPolarHBondContact OE2-CD 3.37Å; E943-R971 IonicContact OE2-CZ 2.72Å; E943-R971 IonicContact OE2-NE 3.74Å; E943-R971 IonicContact OE2-NH1 3.88Å; E943-R971 PolarHBondContact OE2-NH1 3.47Å
972	T	89.2	Confident	86.6	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	153.3	-178.3	78	0	0	0	0	111.3	V898 V899 V901 I921 I935 H939 R940 I970	V898-T972 WeakPolarHBondContact CA-O 3.43Å; V899-T972 PolarHBondContact N-O 3.02Å; V899-T972 PolarHBondContact O-N 3.16Å; V901-T972 HydrophobicContact CG2-CG2 4.35Å; I921-T972 HydrophobicContact CD1-CG2 4.16Å; I935-T972 HydrophobicContact CD1-CG2 3.94Å; H939-T972 PolarHBondContact ND1-OG1 2.99Å; H939-T972 VanDerWaalsContact ND1-OG1 3.15Å; R940-T972 CarbonylContact O-C 3.56Å; R940-T972 WeakPolarHBondContact O-CA 3.5Å; I970-T972 HydrophobicContact CG2-CG2 3.83Å
973	M	86.3	Confident	86.4	Confident	13 Å²	13	44.9 Å²	44.9	6%	0.064	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	136.5	-179.8	-177.6	175.4	-167.8	0	0	109.5	P897 R940 I942 T975 V977 F978 L981	P897-M973 HydrophobicContact CB-CE 4.14Å; R940-M973 PolarHBondContact N-O 3.38Å; R940-M973 PolarHBondContact O-N 3.38Å; I942-M973 HydrophobicContact CD1-CB 4.04Å; I942-M973 HydrophobicContact CG1-CB 3.78Å; M973-T975 PolarHBondContact O-N 2.93Å; M973-V977 HydrophobicContact CE-CB 3.79Å; M973-V977 HydrophobicContact CE-CG1 3.42Å; M973-V977 VanDerWaalsContact CE-CG1 3.42Å; M973-F978 HydrophobicContact CG-CB 4.49Å; M973-F978 HydrophobicContact SD-CB 4.21Å; M973-F978 HydrophobicContact SD-CD2 4.31Å; M973-L981 HydrophobicContact CE-CD1 3.4Å; M973-L981 VanDerWaalsContact CE-CD1 3.4Å; M973-L981 HydrophobicContact CE-CG 4.45Å
974	P	86.5	Confident	86.1	Confident	13 Å²	13	46.5 Å²	46.5	8%	0.084	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.2	129	177.9	-24.3	32.5	0	0	0	111.9	S976 V977 F978	P974-S976 PolarHBondContact O-N 2.81Å; P974-S976 VanDerWaalsContact O-N 3.12Å; P974-V977 HydrophobicContact CB-CG2 4.1Å; P974-V977 HydrophobicContact CG-CG2 4.45Å; P974-V977 PolarHBondContact O-N 2.96Å; P974-F978 PolarHBondContact O-N 3.24Å
975	T	86.3	Confident	85.9	Confident	15 Å²	15	49.3 Å²	49.3	9%	0.092	27%	0.268	C	S	.	.	H	α-helix	trans	-59	-31.3	-174	-64	0	0	0	0	112.5	V920 D938 M973 R979	V920-T975 HydrophobicContact CG2-CG2 4.48Å; D938-T975 WeakPolarHBondContact O-CB 3.5Å; D938-T975 PolarHBondContact O-N 3.46Å; D938-T975 PolarHBondContact O-OG1 2.93Å; M973-T975 PolarHBondContact O-N 2.93Å; T975-R979 HydrophobicContact CG2-CG 4.15Å; T975-R979 WeakPolarHBondContact O-CB 3.44Å; T975-R979 VanDerWaalsContact O-CG 3.27Å; T975-R979 WeakPolarHBondContact O-CG 3.47Å; T975-R979 PolarHBondContact O-N 2.99Å
976	S	83.2	Confident	85.9	Confident	45 Å²	45	52.7 Å²	52.7	32%	0.315	28%	0.282	S	S	.	.	H	α-helix	trans	-59.7	-46.7	175.1	55.7	0	0	0	0	112.5	P974 L980	P974-S976 PolarHBondContact O-N 2.81Å; P974-S976 VanDerWaalsContact O-N 3.12Å; S976-L980 WeakPolarHBondContact O-CD1 3.35Å; S976-L980 WeakPolarHBondContact O-CG 3.18Å; S976-L980 PolarHBondContact O-N 3.4Å
977	V	84.4	Confident	86	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-70.8	-44.9	178.7	-167.5	0	0	0	0	110.1	V825 L837 A839 I855 M973 P974 R979 L980 L981	V825-V977 HydrophobicContact CG2-CG2 4.25Å; L837-V977 HydrophobicContact CD2-CG2 3.49Å; L837-V977 VanDerWaalsContact CD2-CG2 3.49Å; A839-V977 HydrophobicContact CB-CB 4.46Å; A839-V977 HydrophobicContact CB-CG1 4.32Å; A839-V977 HydrophobicContact CB-CG2 3.91Å; I855-V977 HydrophobicContact CG2-CG1 4.22Å; M973-V977 HydrophobicContact CE-CB 3.79Å; M973-V977 HydrophobicContact CE-CG1 3.42Å; M973-V977 VanDerWaalsContact CE-CG1 3.42Å; P974-V977 HydrophobicContact CB-CG2 4.1Å; P974-V977 HydrophobicContact CG-CG2 4.45Å; P974-V977 PolarHBondContact O-N 2.96Å; V977-R979 VanDerWaalsContact C-N 3.33Å; V977-R979 PolarHBondContact O-N 2.82Å; V977-L980 PolarHBondContact O-N 3.05Å; V977-L980 VanDerWaalsContact O-N 3.11Å; V977-L981 HydrophobicContact CG1-CD1 4.29Å; V977-L981 HydrophobicContact CG1-CG 4.38Å; V977-L981 WeakPolarHBondContact O-CG 3.14Å; V977-L981 PolarHBondContact O-N 3.43Å
978	F	86.6	Confident	85.9	Confident	20 Å²	20	58.3 Å²	58.3	9%	0.088	29%	0.292	C	S	.	.	H	α-helix	trans	-55.9	-45.8	177.2	-179.8	-83.9	0	0	0	112.2	I942 V950 M973 P974 L980 L981 T982	I942-F978 HydrophobicContact CD1-CD2 3.66Å; I942-F978 HydrophobicContact CD1-CE2 3.84Å; V950-F978 HydrophobicContact CG1-CE2 3.78Å; V950-F978 HydrophobicContact CG1-CZ 3.58Å; V950-F978 HydrophobicContact CG2-CE2 4.44Å; M973-F978 HydrophobicContact CG-CB 4.49Å; M973-F978 HydrophobicContact SD-CB 4.21Å; M973-F978 HydrophobicContact SD-CD2 4.31Å; P974-F978 PolarHBondContact O-N 3.24Å; F978-L980 VanDerWaalsContact C-N 3.32Å; F978-L980 PolarHBondContact O-N 3.17Å; F978-L981 PolarHBondContact O-N 3.48Å; F978-T982 HydrophobicContact CD1-CG2 4.13Å; F978-T982 HydrophobicContact CE1-CG2 3.56Å; F978-T982 HydrophobicContact CE2-CG2 4.05Å; F978-T982 HydrophobicContact CZ-CG2 3.53Å; F978-T982 WeakPolarHBondContact O-CB 3.37Å; F978-T982 WeakPolarHBondContact O-CG2 3.03Å; F978-T982 PolarHBondContact O-N 3.28Å; F978-T982 PolarHBondContact O-OG1 2.82Å
979	R	86.9	Confident	85.8	Confident	114 Å²	114	62 Å²	62	43%	0.43	31%	0.307	S	S	.	.	H	α-helix	trans	-67.2	-29.6	178.6	-73.4	-177.6	-178.3	-177	4.1	113.4	T975 V977 T982 G983 Q984 I985	T975-R979 HydrophobicContact CG2-CG 4.15Å; T975-R979 WeakPolarHBondContact O-CB 3.44Å; T975-R979 VanDerWaalsContact O-CG 3.27Å; T975-R979 WeakPolarHBondContact O-CG 3.47Å; T975-R979 PolarHBondContact O-N 2.99Å; V977-R979 VanDerWaalsContact C-N 3.33Å; V977-R979 PolarHBondContact O-N 2.82Å; R979-T982 WeakPolarHBondContact CA-OG1 3.18Å; R979-G983 PolarHBondContact O-N 3.34Å; R979-Q984 HydrophobicContact CB-CB 4.29Å; R979-Q984 HydrophobicContact CG-CB 4.46Å; R979-Q984 PolarHBondContact O-N 3.22Å; R979-I985 HydrophobicContact CB-CB 4.41Å; R979-I985 HydrophobicContact CB-CD1 3.62Å; R979-I985 HydrophobicContact CB-CG1 3.88Å; R979-I985 HydrophobicContact CG-CD1 4.32Å; R979-I985 PolarHBondContact O-N 3.46Å
980	L	85.2	Confident	85.6	Confident	16 Å²	16	59.2 Å²	59.2	8%	0.084	29%	0.294	C	S	.	.	H	α-helix	trans	-74.6	-39.3	174.4	-75.1	165.5	0	0	0	112	V823 V825 A839 S976 V977 F978 G983 I985 P987	V823-L980 HydrophobicContact CG1-CD1 4.09Å; V825-L980 HydrophobicContact CG1-CD1 4.35Å; A839-L980 HydrophobicContact CB-CD1 3.6Å; S976-L980 WeakPolarHBondContact O-CD1 3.35Å; S976-L980 WeakPolarHBondContact O-CG 3.18Å; S976-L980 PolarHBondContact O-N 3.4Å; V977-L980 PolarHBondContact O-N 3.05Å; V977-L980 VanDerWaalsContact O-N 3.11Å; F978-L980 VanDerWaalsContact C-N 3.32Å; F978-L980 PolarHBondContact O-N 3.17Å; L980-G983 PolarHBondContact O-N 3.07Å; L980-I985 HydrophobicContact CD2-CB 4.1Å; L980-I985 HydrophobicContact CD2-CG2 3.74Å; L980-I985 HydrophobicContact CG-CB 4.48Å; L980-I985 HydrophobicContact CG-CG2 4.44Å; L980-P987 HydrophobicContact CD2-CB 4.06Å
981	L	83.9	Confident	85.3	Confident	90 Å²	90	62.2 Å²	62.2	47%	0.471	31%	0.309	S	S	.	.	H	α-helix	trans	-72.2	-37.9	177.4	-67.7	-177.4	0	0	0	113	I855 M973 V977 F978 G983	I855-L981 HydrophobicContact CD1-CD2 4Å; I855-L981 HydrophobicContact CG2-CD2 4.49Å; M973-L981 HydrophobicContact CE-CD1 3.4Å; M973-L981 VanDerWaalsContact CE-CD1 3.4Å; M973-L981 HydrophobicContact CE-CG 4.45Å; V977-L981 HydrophobicContact CG1-CD1 4.29Å; V977-L981 HydrophobicContact CG1-CG 4.38Å; V977-L981 WeakPolarHBondContact O-CG 3.14Å; V977-L981 PolarHBondContact O-N 3.43Å; F978-L981 PolarHBondContact O-N 3.48Å; L981-G983 PolarHBondContact O-N 3Å
982	T	85.2	Confident	85.1	Confident	70 Å²	70	60.5 Å²	60.5	43%	0.429	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	1.6	176.6	51.8	0	0	0	0	114.1	F978 R979 Q984	F978-T982 HydrophobicContact CD1-CG2 4.13Å; F978-T982 HydrophobicContact CE1-CG2 3.56Å; F978-T982 HydrophobicContact CE2-CG2 4.05Å; F978-T982 HydrophobicContact CZ-CG2 3.53Å; F978-T982 WeakPolarHBondContact O-CB 3.37Å; F978-T982 WeakPolarHBondContact O-CG2 3.03Å; F978-T982 PolarHBondContact O-N 3.28Å; F978-T982 PolarHBondContact O-OG1 2.82Å; R979-T982 WeakPolarHBondContact CA-OG1 3.18Å; T982-Q984 PolarHBondContact O-N 2.9Å
983	G	81.4	Confident	84.9	Confident	59 Å²	59	63.8 Å²	63.8	61%	0.608	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.2	8.4	179.9	0	0	0	0	0	115	R979 L980 L981 I985	R979-G983 PolarHBondContact O-N 3.34Å; L980-G983 PolarHBondContact O-N 3.07Å; L981-G983 PolarHBondContact O-N 3Å; G983-I985 VanDerWaalsContact C-N 3.28Å; G983-I985 PolarHBondContact O-N 3.41Å
984	Q	81.7	Confident	84.8	Confident	124 Å²	124	66.8 Å²	66.8	58%	0.579	34%	0.339	S	S	*	.	S	Bend	trans	-68.8	-27.4	176.1	-65.2	-175.5	-6.9	0	0	112.4	R979 T982	R979-Q984 HydrophobicContact CB-CB 4.29Å; R979-Q984 HydrophobicContact CG-CB 4.46Å; R979-Q984 PolarHBondContact O-N 3.22Å; T982-Q984 PolarHBondContact O-N 2.9Å
985	I	83.7	Confident	84.7	Confident	72 Å²	72	70.2 Å²	70.2	37%	0.369	36%	0.355	S	S	.	.	S	Bend	trans	-117.9	131.4	172.7	-67.2	175.1	0	0	0	109.2	R979 L980 G983 P987	R979-I985 HydrophobicContact CB-CB 4.41Å; R979-I985 HydrophobicContact CB-CD1 3.62Å; R979-I985 HydrophobicContact CB-CG1 3.88Å; R979-I985 HydrophobicContact CG-CD1 4.32Å; R979-I985 PolarHBondContact O-N 3.46Å; L980-I985 HydrophobicContact CD2-CB 4.1Å; L980-I985 HydrophobicContact CD2-CG2 3.74Å; L980-I985 HydrophobicContact CG-CB 4.48Å; L980-I985 HydrophobicContact CG-CG2 4.44Å; G983-I985 VanDerWaalsContact C-N 3.28Å; G983-I985 PolarHBondContact O-N 3.41Å; I985-P987 WeakPolarHBondContact O-CD 3.32Å
986	I	84.9	Confident	84.6	Confident	148 Å²	148	73.9 Å²	73.9	76%	0.759	37%	0.372	S	S	*	.			trans	-71.8	120.1	174.3	-58.4	172.7	0	0	0	109.1	R988	I986-R988 PolarHBondContact O-N 3.03Å
987	P	84.5	Confident	84.7	Confident	32 Å²	32	75.9 Å²	75.9	21%	0.208	38%	0.376	C	S	.	.			trans	-65.7	130.4	179.6	24.9	-33.1	0	0	0	111.9	V823 N840 L980 I985 Y989	V823-P987 HydrophobicContact CG2-CB 3.84Å; N840-P987 HydrophobicContact CB-CB 4.44Å; L980-P987 HydrophobicContact CD2-CB 4.06Å; I985-P987 WeakPolarHBondContact O-CD 3.32Å; P987-Y989 HydrophobicContact CB-CE1 3.99Å; P987-Y989 HydrophobicContact CB-CE2 3.95Å; P987-Y989 HydrophobicContact CG-CE1 4.38Å; P987-Y989 HydrophobicContact CG-CE2 3.75Å; P987-Y989 VanDerWaalsContact CG-OH 3.24Å; P987-Y989 WeakPolarHBondContact CG-OH 3.26Å
988	R	85.1	Confident	84.7	Confident	218 Å²	218	81.8 Å²	81.8	82%	0.823	41%	0.405	S	S	*	.			trans	-103.3	92.4	175.3	-68.9	-175.3	178.7	-179.6	0.2	110.2	I986	I986-R988 PolarHBondContact O-N 3.03Å
989	Y	85.7	Confident	84.5	Confident	78 Å²	78	86.9 Å²	86.9	31%	0.306	43%	0.432	S	S	.	.			trans	-69.9	140.6	-176.8	-55.2	-75.5	0	0	0	113.1	V822 V823 H842 P987	V822-Y989 WeakPolarHBondContact O-CA 3.31Å; V823-Y989 HydrophobicContact CG2-CD1 3.6Å; V823-Y989 HydrophobicContact CG2-CE1 3.86Å; V823-Y989 HydrophobicContact CG2-CG 4.3Å; H842-Y989 HydrophobicContact CB-CD1 3.7Å; H842-Y989 HydrophobicContact CB-CD2 4.36Å; H842-Y989 HydrophobicContact CB-CE1 3.77Å; H842-Y989 HydrophobicContact CB-CE2 4.43Å; H842-Y989 HydrophobicContact CB-CG 4Å; H842-Y989 AromaticContact CD2-CD2 3.76Å; H842-Y989 AromaticContact CD2-CE2 3.53Å; H842-Y989 AromaticContact CD2-CZ 3.82Å; H842-Y989 VanDerWaalsContact N-CE1 3.28Å; P987-Y989 HydrophobicContact CB-CE1 3.99Å; P987-Y989 HydrophobicContact CB-CE2 3.95Å; P987-Y989 HydrophobicContact CG-CE1 4.38Å; P987-Y989 HydrophobicContact CG-CE2 3.75Å; P987-Y989 VanDerWaalsContact CG-OH 3.24Å; P987-Y989 WeakPolarHBondContact CG-OH 3.26Å
990	I	86.1	Confident	84.3	Confident	22 Å²	22	84.5 Å²	84.5	11%	0.113	43%	0.432	C	S	.	.			trans	-117.1	0	177	62.6	173.1	0	0	0	112.6	S819 L820 G821 V822 I824 Q876 I879 K880	S819-I990 WeakPolarHBondContact CB-OXT 3.41Å; L820-I990 CarbonylContact C-O 3.53Å; L820-I990 PolarHBondContact N-O 3.41Å; L820-I990 PolarHBondContact N-OXT 2.87Å; G821-I990 PolarHBondContact N-O 2.78Å; V822-I990 HydrophobicContact CG2-CD1 4.35Å; V822-I990 HydrophobicContact CG2-CG1 3.81Å; V822-I990 PolarHBondContact N-O 3.1Å; V822-I990 WeakPolarHBondContact O-CG1 3.43Å; V822-I990 PolarHBondContact O-N 2.59Å; I824-I990 HydrophobicContact CD1-CD1 4.41Å; I824-I990 HydrophobicContact CG1-CD1 4Å; Q876-I990 HydrophobicContact CB-CD1 4.33Å; Q876-I990 HydrophobicContact CG-CD1 4.14Å; I879-I990 HydrophobicContact CB-CD1 3.82Å; I879-I990 HydrophobicContact CD1-CD1 4.01Å; I879-I990 HydrophobicContact CG2-CD1 3.65Å; I879-I990 HydrophobicContact CG2-CG1 3.83Å; K880-I990 VanDerWaalsContact CE-CG2 3.44Å; K880-I990 HydrophobicContact CG-CB 4.21Å; K880-I990 HydrophobicContact CG-CG2 4.41Å

Retrieved 990 of 990 residues in 1184.5 ms (Link to these results)

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