A0A3Q0KFE5_SCHMA Loading...

Ubiquitin carboxyl-terminal hydrolase

AlphaFold DB , UniProt , Accession A0A3Q0KFE5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 919 aa.

						>A0A3Q0KFE5_SCHMA|A0A3Q0KFE5
MSSTASVVPNVSYHLPKPVTQNFQHFDCGSDGSVLGFNHQSSPNNDYGPTTNFLKSESSISASKLVSYNLDNALRLSFKSSTVPLNGHISNYTEKLSQRPLSFHESSAPPLDSVIKQKIQSLPRSLILTDSEECKAVKKSSTETKLLCSDDELDHLCQTGAHCIPKRALGFGNSGNTCYLNSVLQCILATGPLLAYINHKHSNPGSCIINSGRSSIPSLNKSRFCVLCGLSRLINEHHSQNGRTIPSYFVTNVRAICPSLRPYQQEDAHEFLLGLLSRMEDSSLAGLGKVSRKLSETNVIRRIFGGVIRSEVTCHSCLKVSARDEQCFNLSMDITCARSLQQCLCNYVRSEELSGQNAYKCENCHQLRAAMRKCTIYRAPPILIIQLNRFSRHQKLDIRVDFPSSFNLRPFMTQSKGLPILYKLYAIVNHEGYSCRSGHYVSFTLRHGQWLSLNDSFVSTTNTDHVLRQSPYLLFYEAVSYVTRTVTSKESSLDTNTPKLNNSQLSPVNDTVKQQSTTKPYLPLSSSSSLSTQTNHKSFNTTKQTNLLPVTVSSVISSSTSFAKTPTINSLCCSNTTTSTVSSIPKIVFNPKLSLNKINILPSPIVPSTSISTGLNNSMSLPSKNKSIQDIIESGKNHHSNIVSTVSSVSSSTSSSTTTSIPLSAATVRELLYGKETSSNLWTERPTPINEPVLSLSSTSSSSITTLSHCNKNLTNEQSSVNLSNSSDNLTTISTTKVQTTSSQSPSVNTVGLKNKQRELTNPLVDYSYEESDSDKNVSPPPPKRSRTSHSGSDSGTVWVPGNHNETSEKHHKDKSSSDVHKRHKKKHKSRHSSKHSSSHHNSWNGSDDNRHHHNHRNRELDRSSSLPRPSSDHHHHDKHRRRHHHKKYRQDSRDSKDHRFHSHHKHYKQSHSHENGYR
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.1	Very low	31.1	Very low	202 Å²	202	102.9 Å²	102.9	100%	0.995	65%	0.65	S	S	*	*				0	150.8	0	-66.4	177.4	174.3	0	0	110.6	E676	M1-E676 WeakPolarHBondContact CE-OE1 3.17Å
2	S	29.1	Very low	30.9	Very low	127 Å²	127	101.1 Å²	101.1	89%	0.888	64%	0.643	S	S	*	*			trans	-151.7	138.3	149.2	-170.1	0	0	0	0	107.3
3	S	29.1	Very low	30.9	Very low	85 Å²	85	101.2 Å²	101.2	59%	0.594	62%	0.624	S	S	*	*			trans	-130.9	157.9	-157.5	-63.1	0	0	0	0	112.8
4	T	32.5	Very low	31	Very low	118 Å²	118	100.2 Å²	100.2	72%	0.724	61%	0.609	S	S	*	*			trans	54.5	99.2	154.9	46.9	0	0	0	0	117.6	S6	T4-S6 PolarHBondContact O-N 3.43Å; T4-S6 PolarHBondContact O-OG 3.25Å
5	A	28.5	Very low	30.9	Very low	102 Å²	102	102.5 Å²	102.5	84%	0.843	62%	0.615	S	S	*	*			trans	-34.4	119.2	150.1	0	0	0	0	0	111.9
6	S	31.5	Very low	31	Very low	110 Å²	110	99.3 Å²	99.3	77%	0.769	60%	0.597	S	S	*	*			trans	-120.9	95.9	175.5	-66.5	0	0	0	0	107.7	T4 V8	T4-S6 PolarHBondContact O-N 3.43Å; T4-S6 PolarHBondContact O-OG 3.25Å; S6-V8 PolarHBondContact O-N 3.45Å
7	V	31.5	Very low	30.8	Very low	104 Å²	104	101.4 Å²	101.4	63%	0.63	60%	0.597	S	S	*	*			trans	-67.5	122.6	-165.4	173.1	0	0	0	0	111.7	P9	V7-P9 WeakPolarHBondContact O-CD 3.4Å
8	V	33.6	Very low	31.1	Very low	62 Å²	62	100.7 Å²	100.7	38%	0.376	60%	0.596	S	S	.	*			trans	-63.5	118.8	157.4	176.5	0	0	0	0	106.9	S6 N10 V11	S6-V8 PolarHBondContact O-N 3.45Å; V8-N10 PolarHBondContact O-N 3.47Å; V8-V11 PolarHBondContact O-N 3.25Å
9	P	31	Very low	31.1	Very low	112 Å²	112	99.3 Å²	99.3	73%	0.727	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	65.1	-166.7	32.3	-37.3	0	0	0	112.9	V7	V7-P9 WeakPolarHBondContact O-CD 3.4Å
10	N	36.3	Very low	31.1	Very low	92 Å²	92	100.7 Å²	100.7	49%	0.492	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	-170.7	7	162.4	-96.2	-21.8	0	0	0	114	V8	V8-N10 PolarHBondContact O-N 3.47Å
11	V	31.1	Very low	31.1	Very low	18 Å²	18	101.9 Å²	101.9	11%	0.109	60%	0.597	C	S	.	*			trans	-127.5	119.5	176.4	-177.6	0	0	0	0	110.6	V8 Y13	V8-V11 PolarHBondContact O-N 3.25Å; V11-Y13 HydrophobicContact CB-CD2 4.41Å; V11-Y13 HydrophobicContact CB-CE2 3.81Å; V11-Y13 HydrophobicContact CG1-CD2 3.99Å; V11-Y13 HydrophobicContact CG1-CE2 3.57Å; V11-Y13 WeakPolarHBondContact O-CD2 3.35Å
12	S	28.8	Very low	31.3	Very low	81 Å²	81	99.5 Å²	99.5	57%	0.566	59%	0.589	S	S	*	*			trans	-84.4	121.2	171.2	-63.3	0	0	0	0	109.9
13	Y	31.3	Very low	31.4	Very low	103 Å²	103	102.6 Å²	102.6	40%	0.404	59%	0.586	S	S	.	*			trans	-98.6	115.9	179.4	-72.7	-100.6	0	0	0	111.1	V11 L15 L273	V11-Y13 HydrophobicContact CB-CD2 4.41Å; V11-Y13 HydrophobicContact CB-CE2 3.81Å; V11-Y13 HydrophobicContact CG1-CD2 3.99Å; V11-Y13 HydrophobicContact CG1-CE2 3.57Å; V11-Y13 WeakPolarHBondContact O-CD2 3.35Å; Y13-L15 PolarHBondContact O-N 3.29Å; Y13-L273 HydrophobicContact CD1-CD1 4.34Å; Y13-L273 HydrophobicContact CE1-CD1 3.55Å
14	H	31.2	Very low	31.4	Very low	87 Å²	87	106.5 Å²	106.5	40%	0.403	60%	0.595	S	S	.	*			trans	-91.2	93.5	168.1	-69.8	-59.6	0	0	0	110	E325	H14-E325 IonicContact CD2-OE2 3.16Å; H14-E325 IonicContact CE1-OE2 2.66Å; H14-E325 IonicContact NE2-OE2 2.8Å; H14-E325 PolarHBondContact NE2-OE2 2.93Å
15	L	30.4	Very low	31.4	Very low	135 Å²	135	108 Å²	108	71%	0.707	59%	0.594	S	S	*	*			trans	-100.5	109.8	167.2	-80.2	168.9	0	0	0	109.4	Y13 K17	Y13-L15 PolarHBondContact O-N 3.29Å; L15-K17 PolarHBondContact O-N 3.44Å
16	P	31.5	Very low	31.4	Very low	51 Å²	51	112.4 Å²	112.4	33%	0.331	59%	0.594	S	S	.	*	P	Polyproline II helix	trans	-60.5	130	172	-21.2	33.2	0	0	0	110.5	K586	P16-K586 HydrophobicContact CB-CG 4.43Å; P16-K586 HydrophobicContact CG-CG 4.47Å
17	K	28.6	Very low	31.5	Very low	134 Å²	134	113.3 Å²	113.3	58%	0.583	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-79.3	129.5	162.6	-70.8	178.8	-179.7	176.1	0	108	L15	L15-K17 PolarHBondContact O-N 3.44Å
18	P	36.4	Very low	31.4	Very low	89 Å²	89	114.8 Å²	114.8	58%	0.578	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-66.5	141.4	171.6	28.7	-33.9	0	0	0	110.1
19	V	30.1	Very low	31.3	Very low	74 Å²	74	115 Å²	115	45%	0.448	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-88.9	128.4	169.4	176.5	0	0	0	0	108.3	P585	V19-P585 HydrophobicContact CG2-CG 4.26Å
20	T	31.2	Very low	31.4	Very low	127 Å²	127	114.8 Å²	114.8	78%	0.779	62%	0.62	S	S	*	*			trans	-80.9	114.5	170.7	47.1	0	0	0	0	109.8
21	Q	32	Very low	31.1	Very low	126 Å²	126	118.6 Å²	118.6	59%	0.589	64%	0.64	S	S	*	*			trans	-103.6	131	155.6	-80.2	-178.6	-50.4	0	0	108.3	F23 S582	Q21-F23 PolarHBondContact O-N 3.45Å; Q21-S582 VanDerWaalsContact CD-OG 3.27Å; Q21-S582 PolarHBondContact NE2-OG 2.98Å; Q21-S582 VanDerWaalsContact NE2-OG 3.15Å; Q21-S582 VanDerWaalsContact OE1-CB 3.3Å; Q21-S582 PolarHBondContact OE1-OG 3.44Å
22	N	30.8	Very low	31.2	Very low	153 Å²	153	121.6 Å²	121.6	82%	0.818	67%	0.674	S	S	*	*			trans	-72.3	113.9	174.1	-67.4	-4.7	0	0	0	108.1	Q24	N22-Q24 PolarHBondContact O-N 2.93Å
23	F	31	Very low	31.3	Very low	192 Å²	192	123.2 Å²	123.2	84%	0.842	69%	0.686	S	S	*	*			trans	-73.5	102	161.8	-83	-94	0	0	0	107.9	Q21 H25	Q21-F23 PolarHBondContact O-N 3.45Å; F23-H25 PolarHBondContact O-N 3.45Å
24	Q	29.3	Very low	31.4	Very low	166 Å²	166	124.1 Å²	124.1	78%	0.776	70%	0.702	S	S	*	*			trans	-71	111	155.5	-74.8	-177.9	-70.7	0	0	107	N22 F26	N22-Q24 PolarHBondContact O-N 2.93Å; Q24-F26 PolarHBondContact O-N 2.91Å
25	H	34.1	Very low	31.4	Very low	150 Å²	150	127.7 Å²	127.7	69%	0.694	72%	0.723	S	S	*	*			trans	-63.3	123.3	160.8	-108.7	-112.1	0	0	0	108	F23 D27	F23-H25 PolarHBondContact O-N 3.45Å; H25-D27 IonicContact CG-OD2 2.72Å; H25-D27 IonicContact ND1-OD1 3.26Å; H25-D27 PolarHBondContact ND1-OD1 3.02Å; H25-D27 VanDerWaalsContact ND1-OD1 3.08Å; H25-D27 IonicContact ND1-OD2 3.42Å; H25-D27 PolarHBondContact ND1-OD2 3.37Å; H25-D27 PolarHBondContact O-N 3.46Å
26	F	28.1	Very low	31.3	Very low	194 Å²	194	124.1 Å²	124.1	85%	0.851	72%	0.718	S	S	*	*			trans	-88.2	83.9	162.1	-90.4	-90.3	0	0	0	107.4	Q24	Q24-F26 PolarHBondContact O-N 2.91Å
27	D	33.7	Very low	31.3	Very low	129 Å²	129	131.6 Å²	131.6	69%	0.69	75%	0.746	S	S	*	*			trans	-90.1	124.6	167	-61.6	-39.5	0	0	0	108.2	H25	H25-D27 IonicContact CG-OD2 2.72Å; H25-D27 IonicContact ND1-OD1 3.26Å; H25-D27 PolarHBondContact ND1-OD1 3.02Å; H25-D27 VanDerWaalsContact ND1-OD1 3.08Å; H25-D27 IonicContact ND1-OD2 3.42Å; H25-D27 PolarHBondContact ND1-OD2 3.37Å; H25-D27 PolarHBondContact O-N 3.46Å
28	C	29.5	Very low	31.3	Very low	136 Å²	136	132.3 Å²	132.3	92%	0.919	76%	0.756	S	S	*	*			trans	-89.1	117.6	175.3	-72.6	0	0	0	0	110.4
29	G	30.3	Very low	31.3	Very low	66 Å²	66	135.4 Å²	135.4	68%	0.68	76%	0.763	S	S	*	*			trans	162.4	123.3	166.1	0	0	0	0	0	116.2
30	S	34	Very low	31.4	Very low	108 Å²	108	139.6 Å²	139.6	76%	0.755	78%	0.778	S	S	*	*			trans	46.7	102.6	150.8	58.7	0	0	0	0	120.5
31	D	30.7	Very low	31.3	Very low	172 Å²	172	138.1 Å²	138.1	92%	0.92	77%	0.772	S	S	*	*				45.8	124.8	120.6	-49.3	-30.7	0	0	0	121.8
32	G	32.7	Very low	31.4	Very low	80 Å²	80	137.2 Å²	137.2	83%	0.825	78%	0.78	S	S	*	*			trans	170.7	100.3	164.8	0	0	0	0	0	115.2
33	S	29.8	Very low	31.8	Very low	116 Å²	116	135 Å²	135	81%	0.811	77%	0.774	S	S	*	*			trans	-80.2	161.4	168.8	51.1	0	0	0	0	111
34	V	34.5	Very low	31.8	Very low	122 Å²	122	132.6 Å²	132.6	74%	0.739	77%	0.77	S	S	*	*				-165.3	164	57.9	166.8	0	0	0	0	111.2
35	L	31.3	Very low	32	Very low	162 Å²	162	132.4 Å²	132.4	85%	0.848	77%	0.774	S	S	*	*			trans	-28.1	159	160.6	-46.8	167.3	0	0	0	117
36	G	27.4	Very low	31.8	Very low	59 Å²	59	132 Å²	132	61%	0.608	78%	0.777	S	S	*	*			cis	116.8	112.8	1.4	0	0	0	0	0	114.3
37	F	32.6	Very low	32.1	Very low	208 Å²	208	132.8 Å²	132.8	91%	0.912	78%	0.776	S	S	*	*			trans	-150.3	155.1	174.9	-93.7	-73.1	0	0	0	115.1
38	N	27.8	Very low	32	Very low	150 Å²	150	130.2 Å²	130.2	80%	0.802	78%	0.779	S	S	*	*			trans	-127.2	166.4	177.7	-88.4	-43.3	0	0	0	110.6
39	H	36.8	Very low	32.4	Very low	154 Å²	154	129.5 Å²	129.5	71%	0.713	77%	0.773	S	S	*	*			trans	169.5	128.3	138.7	-91.8	-72.9	0	0	0	107.5
40	Q	31.7	Very low	32.5	Very low	162 Å²	162	132.8 Å²	132.8	76%	0.757	78%	0.78	S	S	*	*				61.6	142.9	78.1	-69.2	-176.2	-9.6	0	0	114.9
41	S	30.1	Very low	32.4	Very low	95 Å²	95	133.9 Å²	133.9	66%	0.664	78%	0.783	S	S	*	*			cis	-172.7	-178.3	-19.5	57.1	0	0	0	0	110.5
42	S	34.5	Very low	32.3	Very low	108 Å²	108	132.8 Å²	132.8	76%	0.755	78%	0.777	S	S	*	*			trans	108.9	151.7	150.9	-50.7	0	0	0	0	118.6
43	P	39.1	Very low	32.2	Very low	105 Å²	105	138.2 Å²	138.2	68%	0.682	78%	0.778	S	S	*	*			trans	-142.2	-166	-150.8	42.9	-21.3	0	0	0	117.4
44	N	29.4	Very low	32.4	Very low	142 Å²	142	139.3 Å²	139.3	76%	0.759	77%	0.774	S	S	*	*			trans	89.7	155.1	153.3	-67.9	-5.7	0	0	0	121.7
45	N	33.4	Very low	32.1	Very low	163 Å²	163	141.2 Å²	141.2	87%	0.872	77%	0.772	S	S	*	*			trans	89.7	139.8	173	-55.1	-9.9	0	0	0	117.1
46	D	30.6	Very low	32.2	Very low	141 Å²	141	139.4 Å²	139.4	75%	0.754	77%	0.773	S	S	*	*				-175	-177.6	-53.3	-176	18.2	0	0	0	106.8
47	Y	34.2	Very low	32.4	Very low	211 Å²	211	143.6 Å²	143.6	83%	0.827	78%	0.777	S	S	*	*			trans	82	116.1	171.5	-72.6	-95.7	0	0	0	121
48	G	31.1	Very low	32.5	Very low	74 Å²	74	138.8 Å²	138.8	76%	0.763	77%	0.769	S	S	*	*				94	105.8	114.3	0	0	0	0	0	121.3
49	P	38.4	Very low	32.8	Very low	122 Å²	122	136.4 Å²	136.4	79%	0.792	76%	0.764	S	S	*	*			trans	-120.3	150.2	172.5	38.7	-28.1	0	0	0	115.5
50	T	32	Very low	32.6	Very low	134 Å²	134	136.7 Å²	136.7	82%	0.822	77%	0.77	S	S	*	*			trans	-160	149.4	163	5.1	0	0	0	0	117.8
51	T	32.6	Very low	32.5	Very low	132 Å²	132	135.1 Å²	135.1	81%	0.81	78%	0.776	S	S	*	*			trans	77.7	159.3	153.4	55	0	0	0	0	122.5
52	N	27.8	Very low	32.5	Very low	148 Å²	148	134.6 Å²	134.6	79%	0.791	78%	0.778	S	S	*	*			trans	-134.4	156.1	-165.9	-41.2	-94	0	0	0	111.8
53	F	31.5	Very low	32.6	Very low	194 Å²	194	134.7 Å²	134.7	85%	0.851	78%	0.779	S	S	*	*			trans	-161.4	128.8	141.9	-93.6	-85.3	0	0	0	106.2
54	L	32.8	Very low	32.4	Very low	140 Å²	140	139.2 Å²	139.2	73%	0.733	79%	0.787	S	S	*	*				60.2	139.4	66.6	-68.6	169.9	0	0	0	113.9
55	K	29.3	Very low	32.5	Very low	161 Å²	161	140.2 Å²	140.2	70%	0.7	79%	0.792	S	S	*	*			cis	-173.6	139.5	-19	-158.6	-162	-165.7	-152.8	0	109	E57	K55-E57 VanDerWaalsContact CE-OE1 3.23Å; K55-E57 WeakPolarHBondContact CE-OE1 3.37Å; K55-E57 IonicContact NZ-OE1 3.44Å; K55-E57 PolarHBondContact NZ-OE1 3.08Å
56	S	32.3	Very low	32.7	Very low	124 Å²	124	138.7 Å²	138.7	87%	0.867	79%	0.788	S	S	*	*			trans	-160.6	147.1	163.4	56.6	0	0	0	0	113.3
57	E	32	Very low	33.3	Very low	148 Å²	148	137 Å²	137	69%	0.692	79%	0.788	S	S	*	*			trans	-136.1	155.5	-166.5	-58.6	165.9	-171.3	0	0	112.1	K55	K55-E57 VanDerWaalsContact CE-OE1 3.23Å; K55-E57 WeakPolarHBondContact CE-OE1 3.37Å; K55-E57 IonicContact NZ-OE1 3.44Å; K55-E57 PolarHBondContact NZ-OE1 3.08Å
58	S	35.9	Very low	33.7	Very low	107 Å²	107	134.8 Å²	134.8	75%	0.748	78%	0.779	S	S	*	*			trans	-172.9	132.6	141.7	58.9	0	0	0	0	114.9
59	S	33.5	Very low	34.5	Very low	100 Å²	100	137.6 Å²	137.6	70%	0.699	78%	0.777	S	S	*	*			trans	33.9	114.7	151.7	55.8	0	0	0	0	120
60	I	32.2	Very low	35.1	Very low	160 Å²	160	137.4 Å²	137.4	82%	0.821	77%	0.768	S	S	*	*			cis	72.7	120.3	45.7	-51.9	170	0	0	0	115
61	S	30.8	Very low	35.8	Very low	128 Å²	128	133.2 Å²	133.2	90%	0.895	74%	0.741	S	S	*	*			trans	-136.4	143.4	146.1	-177.7	0	0	0	0	108.2
62	A	28.7	Very low	36.7	Very low	85 Å²	85	130.7 Å²	130.7	70%	0.702	72%	0.722	S	S	*	*			trans	-119.2	134.4	-157.1	0	0	0	0	0	114.7
63	S	36	Very low	38.1	Very low	110 Å²	110	126.3 Å²	126.3	77%	0.769	71%	0.707	S	S	*	*			trans	-159.5	151.5	150.5	60.9	0	0	0	0	111.4
64	K	35.6	Very low	39.1	Very low	199 Å²	199	121 Å²	121	87%	0.865	69%	0.686	S	S	*	*			trans	70.5	55.2	172.9	-57.4	-178.6	-179.1	177	0	117.1	V66	K64-V66 PolarHBondContact O-N 3.38Å
65	L	31.9	Very low	39.9	Very low	164 Å²	164	123 Å²	123	86%	0.859	68%	0.684	S	S	*	*			trans	-63.1	115	152.4	-79.2	151.2	0	0	0	110.9
66	V	38.2	Very low	41.3	Very low	130 Å²	130	121.6 Å²	121.6	79%	0.788	68%	0.684	S	S	*	*			trans	-149.1	-49.6	153.4	-178.4	0	0	0	0	110.1	K64 Y68	K64-V66 PolarHBondContact O-N 3.38Å; V66-Y68 PolarHBondContact O-N 3.21Å
67	S	42.1	Very low	42.3	Very low	107 Å²	107	120.4 Å²	120.4	75%	0.748	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-9	-159.5	-45.9	0	0	0	0	117.4
68	Y	42.2	Very low	42.9	Very low	163 Å²	163	121.7 Å²	121.7	64%	0.639	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-31.1	-165	-151.9	-100.6	0	0	0	114.5	V66 L70 D71	V66-Y68 PolarHBondContact O-N 3.21Å; Y68-L70 VanDerWaalsContact C-N 3.28Å; Y68-L70 PolarHBondContact O-N 3.03Å; Y68-D71 PolarHBondContact O-N 3.29Å
69	N	48.9	Very low	43.1	Very low	134 Å²	134	124.8 Å²	124.8	72%	0.717	68%	0.679	S	S	*	*	H	α-helix	trans	-69.8	-23.8	-172.3	-69	2.4	0	0	0	113.4	A73	N69-A73 PolarHBondContact O-N 3.35Å
70	L	51.7	Low	43.1	Very low	118 Å²	118	125.5 Å²	125.5	62%	0.618	68%	0.684	S	S	*	*	H	α-helix	trans	-77.7	-20.4	-179.2	-142.8	90.4	0	0	0	113.6	Y68 L74	Y68-L70 VanDerWaalsContact C-N 3.28Å; Y68-L70 PolarHBondContact O-N 3.03Å; L70-L74 WeakPolarHBondContact O-CD1 3.47Å; L70-L74 WeakPolarHBondContact O-CG 3.42Å
71	D	44.9	Very low	43.2	Very low	46 Å²	46	123.1 Å²	123.1	25%	0.246	68%	0.682	C	S	.	*	H	α-helix	trans	-81.4	-38	176.3	-95.5	22.1	0	0	0	111.7	Y68 L74 R75 K597 N599	Y68-D71 PolarHBondContact O-N 3.29Å; D71-L74 PolarHBondContact O-N 3.17Å; D71-R75 WeakPolarHBondContact O-CB 3.32Å; D71-R75 PolarHBondContact O-N 3.23Å; D71-K597 WeakPolarHBondContact OD1-CD 3.49Å; D71-K597 VanDerWaalsContact OD1-CE 3.32Å; D71-K597 WeakPolarHBondContact OD1-CE 3.47Å; D71-K597 IonicContact OD1-NZ 3.87Å; D71-K597 PolarHBondContact OD1-NZ 3.19Å; D71-N599 PolarHBondContact OD2-ND2 3.14Å
72	N	53.1	Low	43.4	Very low	78 Å²	78	123.5 Å²	123.5	42%	0.417	68%	0.679	S	S	.	*	H	α-helix	trans	-68.9	-37.5	176.2	-81	-10.1	0	0	0	112.5	R75 L76	N72-R75 PolarHBondContact O-N 3.33Å; N72-L76 WeakPolarHBondContact O-CG 3.48Å; N72-L76 PolarHBondContact O-N 3.39Å
73	A	55.7	Low	43.9	Very low	56 Å²	56	124.9 Å²	124.9	46%	0.463	68%	0.678	S	S	.	*	H	α-helix	trans	-58.2	-51	173	0	0	0	0	0	111.5	N69 R75 L76 S77	N69-A73 PolarHBondContact O-N 3.35Å; A73-R75 VanDerWaalsContact C-N 3.34Å; A73-R75 PolarHBondContact O-N 3.35Å; A73-L76 PolarHBondContact O-N 3.39Å; A73-S77 PolarHBondContact O-N 2.96Å
74	L	52.8	Low	44	Very low	82 Å²	82	125.2 Å²	125.2	43%	0.429	68%	0.678	S	S	.	*	H	α-helix	trans	-64.2	-35.4	178.3	-68.7	170.6	0	0	0	112.7	L70 D71 L76 S77 F78 K597	L70-L74 WeakPolarHBondContact O-CD1 3.47Å; L70-L74 WeakPolarHBondContact O-CG 3.42Å; D71-L74 PolarHBondContact O-N 3.17Å; L74-L76 VanDerWaalsContact C-N 3.29Å; L74-L76 PolarHBondContact O-N 3.32Å; L74-S77 PolarHBondContact O-N 3.36Å; L74-F78 WeakPolarHBondContact O-CD2 3.2Å; L74-K597 HydrophobicContact CD1-CD 4.26Å
75	R	49.8	Very low	43.9	Very low	183 Å²	183	123.5 Å²	123.5	69%	0.691	68%	0.677	S	S	*	*	H	α-helix	trans	-69.6	-20.1	176.9	-95.7	-178.4	160.7	162	-4.9	114.7	D71 N72 A73	D71-R75 WeakPolarHBondContact O-CB 3.32Å; D71-R75 PolarHBondContact O-N 3.23Å; N72-R75 PolarHBondContact O-N 3.33Å; A73-R75 VanDerWaalsContact C-N 3.34Å; A73-R75 PolarHBondContact O-N 3.35Å
76	L	59.2	Low	44	Very low	131 Å²	131	124 Å²	124	69%	0.686	68%	0.681	S	S	*	*	H	α-helix	trans	-83.8	-33.2	176.3	-70.7	169.2	0	0	0	112.1	N72 A73 L74 F78	N72-L76 WeakPolarHBondContact O-CG 3.48Å; N72-L76 PolarHBondContact O-N 3.39Å; A73-L76 PolarHBondContact O-N 3.39Å; L74-L76 VanDerWaalsContact C-N 3.29Å; L74-L76 PolarHBondContact O-N 3.32Å; L76-F78 VanDerWaalsContact C-N 3.28Å; L76-F78 PolarHBondContact O-N 3.29Å
77	S	53.1	Low	43.8	Very low	99 Å²	99	121.3 Å²	121.3	69%	0.692	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	-10.3	178.7	-58.9	0	0	0	0	115.7	A73 L74	A73-S77 PolarHBondContact O-N 2.96Å; L74-S77 PolarHBondContact O-N 3.36Å
78	F	45.5	Very low	43.5	Very low	175 Å²	175	125 Å²	125	77%	0.768	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.4	19.7	-175.2	-75.1	-66.7	0	0	0	114.9	L74 L76 S80	L74-F78 WeakPolarHBondContact O-CD2 3.2Å; L76-F78 VanDerWaalsContact C-N 3.28Å; L76-F78 PolarHBondContact O-N 3.29Å; F78-S80 PolarHBondContact O-N 3.26Å
79	K	38.6	Very low	43.1	Very low	173 Å²	173	123.9 Å²	123.9	75%	0.752	69%	0.688	S	S	*	*			trans	-88.6	85.8	172.4	-78.5	-168.9	171.5	-171.3	0	112.2	S81	K79-S81 PolarHBondContact O-N 2.99Å
80	S	35.1	Very low	42.5	Very low	115 Å²	115	121.8 Å²	121.8	80%	0.804	68%	0.684	S	S	*	*			trans	-65.1	125.8	156.5	-61.9	0	0	0	0	109	F78 T82	F78-S80 PolarHBondContact O-N 3.26Å; S80-T82 PolarHBondContact O-N 3.18Å
81	S	33.9	Very low	41.9	Very low	110 Å²	110	123.2 Å²	123.2	77%	0.769	69%	0.692	S	S	*	*			trans	-79.1	117.4	-179.6	-168.3	0	0	0	0	110.7	K79 V83	K79-S81 PolarHBondContact O-N 2.99Å; S81-V83 PolarHBondContact O-N 3.31Å
82	T	35	Very low	41.5	Very low	135 Å²	135	129.5 Å²	129.5	83%	0.828	71%	0.714	S	S	*	*			trans	-86.8	100.8	172.1	51	0	0	0	0	109.9	S80	S80-T82 PolarHBondContact O-N 3.18Å
83	V	39.3	Very low	41	Very low	114 Å²	114	132.1 Å²	132.1	69%	0.691	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-91.5	136.7	167.5	-177.2	0	0	0	0	108.5	S81	S81-V83 PolarHBondContact O-N 3.31Å
84	P	38.2	Very low	40.4	Very low	118 Å²	118	137.5 Å²	137.5	77%	0.766	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-63.8	149.7	179	-22.1	34.1	0	0	0	113.2
85	L	32.8	Very low	40	Very low	163 Å²	163	142.2 Å²	142.2	85%	0.853	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-71.9	140.5	174.3	-78.7	73.3	0	0	0	111.2
86	N	34.6	Very low	39.7	Very low	173 Å²	173	140.7 Å²	140.7	93%	0.925	77%	0.77	S	S	*	*			trans	-162.3	144.4	136.4	-107.8	-20.3	0	0	0	109.8
87	G	33.7	Very low	39.1	Very low	74 Å²	74	139.6 Å²	139.6	76%	0.763	77%	0.773	S	S	*	*	S	Bend	trans	101.8	144.3	178.2	0	0	0	0	0	114.9
88	H	35.2	Very low	38.9	Very low	186 Å²	186	143.2 Å²	143.2	86%	0.861	78%	0.779	S	S	*	*			trans	-57.9	145.8	-177.5	-66.4	-113.7	0	0	0	113.7
89	I	34.8	Very low	38.8	Very low	139 Å²	139	145 Å²	145	71%	0.713	78%	0.781	S	S	*	*				-175.9	128.6	114.6	-93.4	155.6	0	0	0	109.3	Y92	I89-Y92 HydrophobicContact CG2-CD2 3.6Å; I89-Y92 HydrophobicContact CG2-CE2 3.79Å
90	S	35.7	Very low	39.1	Very low	89 Å²	89	142.2 Å²	142.2	62%	0.622	78%	0.78	S	S	*	*			trans	-82.6	171.9	170.8	46	0	0	0	0	111.7
91	N	38.8	Very low	39.3	Very low	148 Å²	148	144.5 Å²	144.5	79%	0.791	78%	0.783	S	S	*	*	S	Bend	trans	78	13.4	166.1	-50	-8.9	0	0	0	118.9
92	Y	37	Very low	39.9	Very low	178 Å²	178	144.3 Å²	144.3	70%	0.698	78%	0.781	S	S	*	*			trans	-93.9	-12.4	176.2	-89.2	-92.3	0	0	0	116.3	I89 E94	I89-Y92 HydrophobicContact CG2-CD2 3.6Å; I89-Y92 HydrophobicContact CG2-CE2 3.79Å; Y92-E94 PolarHBondContact O-N 3.44Å
93	T	42.5	Very low	40.4	Very low	134 Å²	134	147.3 Å²	147.3	82%	0.822	78%	0.784	S	S	*	*	S	Bend	trans	-72.4	-27.2	-169.6	-38.9	0	0	0	0	114.5
94	E	42.3	Very low	41.1	Very low	169 Å²	169	150.4 Å²	150.4	79%	0.79	79%	0.79	S	S	*	*	G	3₁₀ helix	trans	-82.5	-27	-173.9	-64.3	-171.9	126.2	0	0	114.1	Y92 L96 S97	Y92-E94 PolarHBondContact O-N 3.44Å; E94-L96 VanDerWaalsContact C-N 3.29Å; E94-L96 PolarHBondContact O-N 3.39Å; E94-S97 WeakPolarHBondContact O-CB 3.44Å; E94-S97 PolarHBondContact O-N 3.08Å
95	K	44.7	Very low	41.7	Very low	181 Å²	181	153.5 Å²	153.5	79%	0.787	79%	0.794	S	S	*	*	G	3₁₀ helix	trans	-77.9	-4.2	-171.4	-76.7	-173.6	174.7	178.4	0	115.6
96	L	43.1	Very low	43.3	Very low	150 Å²	150	149.8 Å²	149.8	79%	0.785	78%	0.782	S	S	*	*	G	3₁₀ helix	trans	-85	-11	170.8	-78.9	164.5	0	0	0	113.5	E94 Q98	E94-L96 VanDerWaalsContact C-N 3.29Å; E94-L96 PolarHBondContact O-N 3.39Å; L96-Q98 PolarHBondContact O-N 3.38Å
97	S	47.7	Very low	45.2	Very low	108 Å²	108	147.8 Å²	147.8	76%	0.755	78%	0.782	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	-18.5	-176.7	-163.2	0	0	0	0	114.5	E94	E94-S97 WeakPolarHBondContact O-CB 3.44Å; E94-S97 PolarHBondContact O-N 3.08Å
98	Q	49	Very low	47.2	Very low	175 Å²	175	147.2 Å²	147.2	82%	0.818	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.8	9.4	-167.5	-67.3	-173	-11.6	0	0	115.3	L96 P100	L96-Q98 PolarHBondContact O-N 3.38Å; Q98-P100 WeakPolarHBondContact O-CD 3.47Å
99	R	41.8	Very low	49.3	Very low	212 Å²	212	142 Å²	142	80%	0.8	75%	0.753	S	S	*	*			trans	-89	113.2	179.3	-147.6	173.3	-164.7	169	4.1	110	L101	R99-L101 PolarHBondContact O-N 3.47Å
100	P	45.4	Very low	51.5	Low	115 Å²	115	139.6 Å²	139.6	75%	0.747	75%	0.746	S	S	*	*			trans	-63.7	127.5	176.7	26.4	-33.4	0	0	0	109.4	Q98 S102	Q98-P100 WeakPolarHBondContact O-CD 3.47Å; P100-S102 VanDerWaalsContact C-N 3.29Å; P100-S102 PolarHBondContact O-N 3.3Å
101	L	40	Very low	53.5	Low	163 Å²	163	141.5 Å²	141.5	85%	0.853	75%	0.748	S	S	*	*			trans	-73	87.7	171.3	-73	172.3	0	0	0	108.7	R99 F103	R99-L101 PolarHBondContact O-N 3.47Å; L101-F103 PolarHBondContact O-N 3.23Å
102	S	46	Very low	55.4	Low	106 Å²	106	140.1 Å²	140.1	74%	0.741	74%	0.741	S	S	*	*			trans	-60.6	98.6	166.9	57	0	0	0	0	109	P100 H104	P100-S102 VanDerWaalsContact C-N 3.29Å; P100-S102 PolarHBondContact O-N 3.3Å; S102-H104 VanDerWaalsContact C-N 3.3Å; S102-H104 PolarHBondContact O-N 3.46Å
103	F	45.5	Very low	57.4	Low	199 Å²	199	134.4 Å²	134.4	87%	0.873	73%	0.727	S	S	*	*			trans	-64.4	95.6	165.4	-109.9	-96.1	0	0	0	107.5	L101 E105	L101-F103 PolarHBondContact O-N 3.23Å; F103-E105 PolarHBondContact O-N 3.21Å
104	H	53.2	Low	59.3	Low	179 Å²	179	131.1 Å²	131.1	83%	0.829	71%	0.706	S	S	*	*			trans	-69.3	113.3	171.3	-149.9	-59.2	0	0	0	107	S102 S106	S102-H104 VanDerWaalsContact C-N 3.3Å; S102-H104 PolarHBondContact O-N 3.46Å; H104-S106 PolarHBondContact O-N 3.23Å
105	E	52.6	Low	61.1	Low	182 Å²	182	126.7 Å²	126.7	85%	0.85	69%	0.688	S	S	*	*			trans	-63	133.9	-176	-167.7	161.5	-146.7	0	0	109.9	F103 S107	F103-E105 PolarHBondContact O-N 3.21Å; E105-S107 PolarHBondContact O-N 3.28Å
106	S	64.9	Low	62.8	Low	86 Å²	86	124.2 Å²	124.2	60%	0.601	68%	0.677	S	S	*	*			trans	-71.4	119.9	-178.6	161.1	0	0	0	0	109.4	H104 A108	H104-S106 PolarHBondContact O-N 3.23Å; S106-A108 PolarHBondContact O-N 3.22Å; S106-A108 WeakPolarHBondContact OG-CB 3.49Å; S106-A108 PolarHBondContact OG-N 3.28Å; S106-A108 PolarHBondContact OG-O 2.91Å
107	S	74.8	Confident	64.4	Low	131 Å²	131	123.5 Å²	123.5	92%	0.916	67%	0.669	S	S	*	*	S	Bend	trans	-67.2	-12.6	172.3	54.6	0	0	0	0	113.7	E105	E105-S107 PolarHBondContact O-N 3.28Å
108	A	77.2	Confident	66.1	Low	61 Å²	61	125.4 Å²	125.4	50%	0.504	66%	0.664	S	S	.	*	S	Bend	trans	-73.7	129.6	167.9	0	0	0	0	0	110.2	S106	S106-A108 PolarHBondContact O-N 3.22Å; S106-A108 WeakPolarHBondContact OG-CB 3.49Å; S106-A108 PolarHBondContact OG-N 3.28Å; S106-A108 PolarHBondContact OG-O 2.91Å
109	P	79.1	Confident	67.5	Low	78 Å²	78	120.4 Å²	120.4	51%	0.506	64%	0.642	S	S	.	*	P	Polyproline II helix	trans	-63.5	157	-177.2	25.9	-34.8	0	0	0	112.3	L111 V114	P109-L111 PolarHBondContact O-N 3.13Å; P109-V114 HydrophobicContact CG-CG2 3.9Å
110	P	81	Confident	69.2	Low	88 Å²	88	116.3 Å²	116.3	57%	0.571	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-51.4	141.3	-179.2	-27.9	34.5	0	0	0	112.8	D112 S113 V114	P110-D112 PolarHBondContact O-N 2.93Å; P110-S113 WeakPolarHBondContact O-CA 3.3Å; P110-S113 VanDerWaalsContact O-CB 3.25Å; P110-S113 WeakPolarHBondContact O-CB 3.43Å; P110-S113 PolarHBondContact O-N 3.15Å; P110-V114 PolarHBondContact O-N 3.41Å; P110-V114 VanDerWaalsContact O-N 3.13Å
111	L	77.1	Confident	70.8	Confident	129 Å²	129	114.6 Å²	114.6	68%	0.675	62%	0.623	S	S	*	*	H	α-helix	trans	-57.2	-36.8	-176	-173.6	64.9	0	0	0	112.2	P109 S113 V114 I115	P109-L111 PolarHBondContact O-N 3.13Å; L111-S113 VanDerWaalsContact C-N 3.32Å; L111-S113 PolarHBondContact O-N 3.42Å; L111-V114 PolarHBondContact O-N 2.99Å; L111-I115 HydrophobicContact CD1-CD1 4.47Å; L111-I115 HydrophobicContact CD2-CD1 4.4Å; L111-I115 HydrophobicContact CG-CD1 3.88Å; L111-I115 HydrophobicContact CG-CG1 4.45Å; L111-I115 WeakPolarHBondContact O-CB 3.45Å; L111-I115 VanDerWaalsContact O-CG1 3.26Å; L111-I115 WeakPolarHBondContact O-CG1 3Å; L111-I115 PolarHBondContact O-N 2.8Å
112	D	77.6	Confident	72.5	Confident	119 Å²	119	111.6 Å²	111.6	64%	0.636	61%	0.607	S	S	*	*	H	α-helix	trans	-64.1	-33.3	174.5	-76.3	-8.3	0	0	0	113	P110 K116	P110-D112 PolarHBondContact O-N 2.93Å; D112-K116 WeakPolarHBondContact O-CB 3.43Å; D112-K116 WeakPolarHBondContact O-CG 3.22Å; D112-K116 PolarHBondContact O-N 2.99Å
113	S	80	Confident	73.3	Confident	58 Å²	58	112.5 Å²	112.5	41%	0.406	61%	0.61	S	S	.	*	H	α-helix	trans	-67.4	-45.4	173.8	-54.2	0	0	0	0	110.7	P110 L111 I115 K116 Q117	P110-S113 WeakPolarHBondContact O-CA 3.3Å; P110-S113 VanDerWaalsContact O-CB 3.25Å; P110-S113 WeakPolarHBondContact O-CB 3.43Å; P110-S113 PolarHBondContact O-N 3.15Å; L111-S113 VanDerWaalsContact C-N 3.32Å; L111-S113 PolarHBondContact O-N 3.42Å; S113-I115 VanDerWaalsContact C-N 3.34Å; S113-I115 PolarHBondContact O-N 3.23Å; S113-K116 PolarHBondContact O-N 3.37Å; S113-Q117 WeakPolarHBondContact O-CB 3.3Å; S113-Q117 PolarHBondContact O-N 2.94Å
114	V	82.7	Confident	74.2	Confident	64 Å²	64	115.1 Å²	115.1	39%	0.388	61%	0.614	S	S	.	*	H	α-helix	trans	-62.4	-42.1	175.7	-178.1	0	0	0	0	110.8	P109 P110 L111 K118	P109-V114 HydrophobicContact CG-CG2 3.9Å; P110-V114 PolarHBondContact O-N 3.41Å; P110-V114 VanDerWaalsContact O-N 3.13Å; L111-V114 PolarHBondContact O-N 2.99Å; V114-K118 VanDerWaalsContact O-CB 3.27Å; V114-K118 WeakPolarHBondContact O-CB 3.46Å; V114-K118 PolarHBondContact O-N 3.02Å
115	I	80.7	Confident	74.5	Confident	77 Å²	77	108.6 Å²	108.6	40%	0.395	59%	0.589	S	S	.	*	H	α-helix	trans	-64.9	-48.5	176.2	-71.8	168.7	0	0	0	110.8	L111 S113 Q117 K118 I119	L111-I115 HydrophobicContact CD1-CD1 4.47Å; L111-I115 HydrophobicContact CD2-CD1 4.4Å; L111-I115 HydrophobicContact CG-CD1 3.88Å; L111-I115 HydrophobicContact CG-CG1 4.45Å; L111-I115 WeakPolarHBondContact O-CB 3.45Å; L111-I115 VanDerWaalsContact O-CG1 3.26Å; L111-I115 WeakPolarHBondContact O-CG1 3Å; L111-I115 PolarHBondContact O-N 2.8Å; S113-I115 VanDerWaalsContact C-N 3.34Å; S113-I115 PolarHBondContact O-N 3.23Å; I115-Q117 PolarHBondContact O-N 2.85Å; I115-K118 PolarHBondContact O-N 3.29Å; I115-I119 HydrophobicContact CG2-CD1 3.64Å; I115-I119 HydrophobicContact CG2-CG1 4.35Å; I115-I119 VanDerWaalsContact O-CG1 3.27Å; I115-I119 WeakPolarHBondContact O-CG1 3.38Å; I115-I119 PolarHBondContact O-N 3.45Å
116	K	78.6	Confident	74.7	Confident	128 Å²	128	108.3 Å²	108.3	56%	0.557	59%	0.592	S	S	*	*	H	α-helix	trans	-56.4	-49.9	176.2	-81.7	-176.5	175.6	-172.4	0	111.1	D112 S113 K118 I119 Q120	D112-K116 WeakPolarHBondContact O-CB 3.43Å; D112-K116 WeakPolarHBondContact O-CG 3.22Å; D112-K116 PolarHBondContact O-N 2.99Å; S113-K116 PolarHBondContact O-N 3.37Å; K116-K118 VanDerWaalsContact C-N 3.33Å; K116-K118 PolarHBondContact O-N 3.26Å; K116-I119 PolarHBondContact O-N 2.85Å; K116-Q120 WeakPolarHBondContact O-CB 3.48Å; K116-Q120 VanDerWaalsContact O-CG 3.29Å; K116-Q120 WeakPolarHBondContact O-CG 3.22Å; K116-Q120 PolarHBondContact O-N 2.68Å
117	Q	78.5	Confident	74.2	Confident	136 Å²	136	107.2 Å²	107.2	64%	0.636	58%	0.579	S	S	*	*	H	α-helix	trans	-62.9	-38.1	179.3	-162.5	177	29.2	0	0	112	S113 I115 Q120 S121	S113-Q117 WeakPolarHBondContact O-CB 3.3Å; S113-Q117 PolarHBondContact O-N 2.94Å; I115-Q117 PolarHBondContact O-N 2.85Å; Q117-Q120 PolarHBondContact O-N 3.28Å; Q117-S121 PolarHBondContact O-N 3.21Å; Q117-S121 VanDerWaalsContact O-N 3.12Å
118	K	82.5	Confident	73	Confident	147 Å²	147	108.7 Å²	108.7	64%	0.639	58%	0.576	S	S	*	*	H	α-helix	trans	-67.6	-40.9	175.6	-159.3	69.7	174.8	178.6	0	112.3	V114 I115 K116 S121	V114-K118 VanDerWaalsContact O-CB 3.27Å; V114-K118 WeakPolarHBondContact O-CB 3.46Å; V114-K118 PolarHBondContact O-N 3.02Å; I115-K118 PolarHBondContact O-N 3.29Å; K116-K118 VanDerWaalsContact C-N 3.33Å; K116-K118 PolarHBondContact O-N 3.26Å; K118-S121 PolarHBondContact O-N 2.97Å; K118-S121 PolarHBondContact O-OG 3.38Å
119	I	78.2	Confident	71.7	Confident	70 Å²	70	110.6 Å²	110.6	36%	0.359	58%	0.582	S	S	.	*	H	α-helix	trans	-67.9	-40.9	175.8	-61.2	166.7	0	0	0	110.2	I115 K116 S121 L122 S125 I127	I115-I119 HydrophobicContact CG2-CD1 3.64Å; I115-I119 HydrophobicContact CG2-CG1 4.35Å; I115-I119 VanDerWaalsContact O-CG1 3.27Å; I115-I119 WeakPolarHBondContact O-CG1 3.38Å; I115-I119 PolarHBondContact O-N 3.45Å; K116-I119 PolarHBondContact O-N 2.85Å; I119-S121 PolarHBondContact O-N 3.15Å; I119-L122 WeakPolarHBondContact O-CB 3.21Å; I119-L122 PolarHBondContact O-N 3.46Å; I119-S125 WeakPolarHBondContact O-CB 3.42Å; I119-S125 PolarHBondContact O-OG 3.28Å; I119-I127 HydrophobicContact CB-CD1 4.09Å; I119-I127 HydrophobicContact CB-CG1 4.48Å; I119-I127 HydrophobicContact CG2-CD1 3.74Å; I119-I127 HydrophobicContact CG2-CG1 3.64Å
120	Q	77.1	Confident	70	Confident	127 Å²	127	114.2 Å²	114.2	59%	0.593	60%	0.596	S	S	*	*	H	α-helix	trans	-57.1	-33.4	174.8	-76.5	171.6	-27.6	0	0	112.2	K116 Q117 L122 I127	K116-Q120 WeakPolarHBondContact O-CB 3.48Å; K116-Q120 VanDerWaalsContact O-CG 3.29Å; K116-Q120 WeakPolarHBondContact O-CG 3.22Å; K116-Q120 PolarHBondContact O-N 2.68Å; Q117-Q120 PolarHBondContact O-N 3.28Å; Q120-L122 VanDerWaalsContact C-N 3.28Å; Q120-L122 PolarHBondContact O-N 2.98Å; Q120-I127 HydrophobicContact CB-CD1 4.16Å; Q120-I127 HydrophobicContact CG-CD1 3.35Å
121	S	79	Confident	68.2	Low	78 Å²	78	114 Å²	114	55%	0.545	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76	-4.3	177.2	73.1	0	0	0	0	115.6	Q117 K118 I119	Q117-S121 PolarHBondContact O-N 3.21Å; Q117-S121 VanDerWaalsContact O-N 3.12Å; K118-S121 PolarHBondContact O-N 2.97Å; K118-S121 PolarHBondContact O-OG 3.38Å; I119-S121 PolarHBondContact O-N 3.15Å
122	L	76.4	Confident	66.5	Low	100 Å²	100	117.5 Å²	117.5	52%	0.524	61%	0.61	S	S	.	*	S	Bend	trans	-93.4	125.5	-178.9	-69	172.2	0	0	0	112.1	I119 Q120 R124 S125	I119-L122 WeakPolarHBondContact O-CB 3.21Å; I119-L122 PolarHBondContact O-N 3.46Å; Q120-L122 VanDerWaalsContact C-N 3.28Å; Q120-L122 PolarHBondContact O-N 2.98Å; L122-R124 PolarHBondContact O-N 3.07Å; L122-S125 WeakPolarHBondContact O-CB 3.41Å; L122-S125 PolarHBondContact O-N 3.35Å; L122-S125 VanDerWaalsContact O-N 3.11Å; L122-S125 PolarHBondContact O-OG 3.19Å; L122-S125 VanDerWaalsContact O-OG 3.04Å
123	P	63.4	Low	64.5	Low	125 Å²	125	120.5 Å²	120.5	81%	0.812	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	132	173.9	25.7	-33.1	0	0	0	110.7
124	R	63.4	Low	62.3	Low	254 Å²	254	123 Å²	123	96%	0.958	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	68.8	24	-171.5	-57.2	-178.8	167.6	134.3	-2.7	116.1	L122 L126	L122-R124 PolarHBondContact O-N 3.07Å; R124-L126 PolarHBondContact O-N 2.78Å
125	S	59.7	Low	60	Low	42 Å²	42	129.8 Å²	129.8	29%	0.294	66%	0.661	S	S	.	*			trans	-68.5	111.5	166.1	57.9	0	0	0	0	112	I119 L122 I127	I119-S125 WeakPolarHBondContact O-CB 3.42Å; I119-S125 PolarHBondContact O-OG 3.28Å; L122-S125 WeakPolarHBondContact O-CB 3.41Å; L122-S125 PolarHBondContact O-N 3.35Å; L122-S125 VanDerWaalsContact O-N 3.11Å; L122-S125 PolarHBondContact O-OG 3.19Å; L122-S125 VanDerWaalsContact O-OG 3.04Å; S125-I127 VanDerWaalsContact C-N 3.29Å; S125-I127 PolarHBondContact O-N 3.35Å
126	L	57.4	Low	57.7	Low	176 Å²	176	131.1 Å²	131.1	92%	0.921	68%	0.684	S	S	*	*			trans	-80.3	79.6	167.3	-70.7	176.4	0	0	0	109.7	R124	R124-L126 PolarHBondContact O-N 2.78Å
127	I	54.2	Low	55.9	Low	64 Å²	64	130.7 Å²	130.7	33%	0.328	69%	0.691	S	S	.	*			trans	-79.8	122.3	166.1	-62.6	177.9	0	0	0	108.1	I119 Q120 S125 T129	I119-I127 HydrophobicContact CB-CD1 4.09Å; I119-I127 HydrophobicContact CB-CG1 4.48Å; I119-I127 HydrophobicContact CG2-CD1 3.74Å; I119-I127 HydrophobicContact CG2-CG1 3.64Å; Q120-I127 HydrophobicContact CB-CD1 4.16Å; Q120-I127 HydrophobicContact CG-CD1 3.35Å; S125-I127 VanDerWaalsContact C-N 3.29Å; S125-I127 PolarHBondContact O-N 3.35Å; I127-T129 PolarHBondContact O-N 3.4Å
128	L	48.7	Very low	53.9	Low	161 Å²	161	133.7 Å²	133.7	84%	0.843	70%	0.702	S	S	*	*			trans	-70.7	109.4	163.7	-62.7	172.3	0	0	0	107.4
129	T	51.3	Low	51.5	Low	102 Å²	102	136.7 Å²	136.7	63%	0.626	72%	0.715	S	S	*	*			trans	-80.3	130.1	167.7	49.6	0	0	0	0	108.9	I127 S131	I127-T129 PolarHBondContact O-N 3.4Å; T129-S131 PolarHBondContact O-N 3.23Å; T129-S131 PolarHBondContact OG1-OG 2.96Å
130	D	43.1	Very low	49.5	Very low	153 Å²	153	138.3 Å²	138.3	82%	0.818	73%	0.733	S	S	*	*			trans	-74.1	69.3	173.4	-60.3	-59.7	0	0	0	109.8
131	S	42.9	Very low	47.6	Very low	83 Å²	83	137.1 Å²	137.1	58%	0.58	74%	0.739	S	S	*	*			trans	-91	110.4	-180	-58.6	0	0	0	0	109.9	T129 E133	T129-S131 PolarHBondContact O-N 3.23Å; T129-S131 PolarHBondContact OG1-OG 2.96Å; S131-E133 PolarHBondContact O-N 3.4Å
132	E	42	Very low	45.8	Very low	204 Å²	204	139.5 Å²	139.5	95%	0.953	75%	0.75	S	S	*	*			trans	-72	33.7	-179.1	-64	-159.4	116.7	0	0	114.7
133	E	35	Very low	44.3	Very low	181 Å²	181	142.9 Å²	142.9	85%	0.846	76%	0.763	S	S	*	*			trans	-138.6	69.9	-169.9	-139.7	164	-138.5	0	0	113.2	S131	S131-E133 PolarHBondContact O-N 3.4Å
134	C	33.8	Very low	44.1	Very low	111 Å²	111	141.4 Å²	141.4	75%	0.75	75%	0.752	S	S	*	*			trans	-142.6	53.2	170.6	-97.9	0	0	0	0	112.4
135	K	33.2	Very low	45	Very low	206 Å²	206	138.1 Å²	138.1	90%	0.896	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	139.9	161.6	-69.3	171.5	-177.2	165.2	0	108.7
136	A	33.7	Very low	46.6	Very low	106 Å²	106	139.1 Å²	139.1	88%	0.876	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	66.9	46.3	171.8	0	0	0	0	0	119.1
137	V	40.1	Very low	48.3	Very low	118 Å²	118	133.3 Å²	133.3	72%	0.715	72%	0.716	S	S	*	*			trans	-95.4	131.5	150.2	-177.2	0	0	0	0	109.4	K139	V137-K139 PolarHBondContact O-N 3.48Å
138	K	35.9	Very low	50.3	Low	199 Å²	199	130.3 Å²	130.3	87%	0.865	70%	0.701	S	S	*	*			trans	-61.5	118.1	-176.9	-68.3	176.2	179.9	174.8	0	110.5	S140	K138-S140 VanDerWaalsContact C-N 3.31Å; K138-S140 PolarHBondContact O-N 3.5Å
139	K	33.6	Very low	52.5	Low	211 Å²	211	124.8 Å²	124.8	92%	0.917	68%	0.675	S	S	*	*			trans	-68.3	85.1	170.8	-75.7	-176.4	177	175.4	0	110.6	V137 S141	V137-K139 PolarHBondContact O-N 3.48Å; K139-S141 PolarHBondContact O-N 3.31Å
140	S	35.2	Very low	54.5	Low	104 Å²	104	121.7 Å²	121.7	73%	0.727	66%	0.655	S	S	*	*			trans	-61.8	125.1	152	47.3	0	0	0	0	107.7	K138 T142	K138-S140 VanDerWaalsContact C-N 3.31Å; K138-S140 PolarHBondContact O-N 3.5Å; S140-T142 PolarHBondContact O-N 3.27Å
141	S	37	Very low	57	Low	102 Å²	102	120.6 Å²	120.6	71%	0.713	65%	0.649	S	S	*	*			trans	-70.3	104.5	179.8	44.9	0	0	0	0	109.6	K139 E143	K139-S141 PolarHBondContact O-N 3.31Å; S141-E143 PolarHBondContact O-N 3.28Å
142	T	41.6	Very low	59.4	Low	128 Å²	128	118.6 Å²	118.6	79%	0.785	63%	0.631	S	S	*	*			trans	-67.4	83.1	162.7	48.1	0	0	0	0	108.9	S140 T144	S140-T142 PolarHBondContact O-N 3.27Å; T142-T144 PolarHBondContact O-N 3.02Å; T142-T144 VanDerWaalsContact O-N 3.08Å
143	E	45.8	Very low	62	Low	171 Å²	171	108.9 Å²	108.9	80%	0.799	59%	0.585	S	S	*	*			trans	-55.2	114.2	168.7	-67.5	-170.9	138.2	0	0	108.3	S141 K145	S141-E143 PolarHBondContact O-N 3.28Å; E143-K145 PolarHBondContact O-N 3.13Å
144	T	59.6	Low	64.8	Low	94 Å²	94	101.6 Å²	101.6	58%	0.577	55%	0.552	S	S	*	*			trans	-75	78.7	177	52.4	0	0	0	0	108.7	T142 L146	T142-T144 PolarHBondContact O-N 3.02Å; T142-T144 VanDerWaalsContact O-N 3.08Å; T144-L146 WeakPolarHBondContact O-CD2 3.33Å; T144-L146 PolarHBondContact O-N 3.43Å
145	K	82.1	Confident	67.7	Low	185 Å²	185	100.9 Å²	100.9	80%	0.804	54%	0.537	S	S	*	.			trans	-44.8	111	-178.3	-176.6	171.4	-176.5	169.6	0	110.7	E143 L294	E143-K145 PolarHBondContact O-N 3.13Å; K145-L294 WeakPolarHBondContact O-CD1 3.49Å
146	L	92.5	Very high	70.7	Confident	62 Å²	62	91.3 Å²	91.3	33%	0.325	50%	0.496	S	S	.	.			trans	-67.8	151.3	-177.3	-51	175.5	0	0	0	110.1	T144 C148 T297	T144-L146 WeakPolarHBondContact O-CD2 3.33Å; T144-L146 PolarHBondContact O-N 3.43Å; L146-C148 VanDerWaalsContact C-N 3.29Å; L146-C148 WeakPolarHBondContact CB-O 3.36Å; L146-T297 HydrophobicContact CD2-CG2 3.66Å
147	L	93.8	Very high	73.6	Confident	55 Å²	55	87.7 Å²	87.7	29%	0.288	46%	0.464	S	S	.	.	S	Bend	trans	-69	-30.8	176.9	-68.3	-176.5	0	0	0	112.7	L284 L287 V290 L294 T297 N298	L147-L284 HydrophobicContact CD1-CD2 3.57Å; L147-L287 HydrophobicContact CD1-CD1 3.71Å; L147-L287 HydrophobicContact CD2-CD1 3.79Å; L147-L287 HydrophobicContact CG-CD1 4.33Å; L147-V290 HydrophobicContact CD1-CG1 4.44Å; L147-L294 HydrophobicContact CD1-CG 4.5Å; L147-L294 VanDerWaalsContact CD1-O 3.31Å; L147-L294 WeakPolarHBondContact CD1-O 3.42Å; L147-L294 HydrophobicContact CD2-CD1 3.92Å; L147-L294 HydrophobicContact CD2-CD2 4.29Å; L147-L294 HydrophobicContact CD2-CG 3.89Å; L147-L294 HydrophobicContact CG-CD1 3.76Å; L147-L294 HydrophobicContact CG-CG 3.9Å; L147-L294 WeakPolarHBondContact CG-O 3.49Å; L147-T297 PolarHBondContact N-OG1 3.41Å; L147-N298 HydrophobicContact CD1-CB 4.36Å
148	C	95.1	Very high	76.2	Confident	1 Å²	1	88.9 Å²	88.9	1%	0.007	46%	0.462	C	S	.	.	S	Bend	trans	-129.2	120.1	166.6	173.7	0	0	0	0	107	L146 E152 T297 V299 R302	L146-C148 VanDerWaalsContact C-N 3.29Å; L146-C148 WeakPolarHBondContact CB-O 3.36Å; C148-E152 VanDerWaalsContact CA-OE2 3.27Å; C148-E152 WeakPolarHBondContact CA-OE2 3.39Å; C148-E152 WeakPolarHBondContact CB-OE2 3.44Å; C148-E152 PolarHBondContact SG-OE2 2.82Å; C148-T297 PolarHBondContact N-O 2.89Å; C148-V299 HydrophobicContact CB-CB 4.06Å; C148-R302 HydrophobicContact CB-CG 3.88Å; C148-R302 PolarHBondContact O-NH1 3.3Å
149	S	95.3	Very high	79	Confident	44 Å²	44	81 Å²	81	31%	0.308	43%	0.43	S	S	.	.			trans	-75.1	171.2	-175.2	70.9	0	0	0	0	111.8	E152 L153	S149-E152 WeakPolarHBondContact OG-CB 3.46Å; S149-E152 PolarHBondContact OG-N 2.83Å; S149-E152 VanDerWaalsContact OG-N 3.1Å; S149-L153 WeakPolarHBondContact O-CB 3.45Å; S149-L153 PolarHBondContact O-N 2.8Å
150	D	93.7	Very high	81.9	Confident	37 Å²	37	71 Å²	71	20%	0.198	39%	0.387	C	S	.	.	H	α-helix	trans	-67.1	-43.5	176.1	-65.8	3.1	0	0	0	109.6	E152 L153 D154 R302 T483	D150-E152 PolarHBondContact O-N 3.42Å; D150-L153 PolarHBondContact O-N 3.1Å; D150-D154 WeakPolarHBondContact O-CB 3.29Å; D150-D154 PolarHBondContact O-N 3.35Å; D150-R302 IonicContact OD1-CZ 3.7Å; D150-R302 IonicContact OD1-NH1 2.77Å; D150-R302 PolarHBondContact OD1-NH1 3.31Å; D150-R302 IonicContact OD1-NH2 3.77Å; D150-R302 PolarHBondContact OD1-NH2 2.95Å; D150-T483 HydrophobicContact CB-CG2 4.02Å; D150-T483 VanDerWaalsContact CG-CG2 3.48Å; D150-T483 VanDerWaalsContact OD2-CG2 3.24Å; D150-T483 WeakPolarHBondContact OD2-CG2 3.28Å
151	D	94.3	Very high	84.6	Confident	130 Å²	130	68.7 Å²	68.7	70%	0.695	37%	0.374	S	S	*	.	H	α-helix	trans	-63.2	-38	175.4	-34.8	-76.5	0	0	0	112.9	H155	D151-H155 WeakPolarHBondContact O-CB 3.35Å; D151-H155 PolarHBondContact O-N 3.23Å
152	E	94.9	Very high	87.3	Confident	42 Å²	42	71.5 Å²	71.5	20%	0.196	38%	0.376	C	S	.	.	H	α-helix	trans	-67.7	-42.8	177	-175.4	177.4	-132.4	0	0	110.7	C148 S149 D150 L156 K200	C148-E152 VanDerWaalsContact CA-OE2 3.27Å; C148-E152 WeakPolarHBondContact CA-OE2 3.39Å; C148-E152 WeakPolarHBondContact CB-OE2 3.44Å; C148-E152 PolarHBondContact SG-OE2 2.82Å; S149-E152 WeakPolarHBondContact OG-CB 3.46Å; S149-E152 PolarHBondContact OG-N 2.83Å; S149-E152 VanDerWaalsContact OG-N 3.1Å; D150-E152 PolarHBondContact O-N 3.42Å; E152-L156 HydrophobicContact CG-CD1 4.23Å; E152-L156 WeakPolarHBondContact O-CB 3.31Å; E152-L156 WeakPolarHBondContact O-CG 3.35Å; E152-L156 PolarHBondContact O-N 2.87Å; E152-K200 VanDerWaalsContact OE1-CE 3.31Å; E152-K200 WeakPolarHBondContact OE1-CE 3.2Å; E152-K200 IonicContact OE1-NZ 2.6Å; E152-K200 PolarHBondContact OE1-NZ 2.78Å
153	L	95.4	Very high	89.9	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-64.7	-46.5	176	-178.6	63.4	0	0	0	111.8	S149 D150 H155 L156 C157 R302 I303 P381 Y481	S149-L153 WeakPolarHBondContact O-CB 3.45Å; S149-L153 PolarHBondContact O-N 2.8Å; D150-L153 PolarHBondContact O-N 3.1Å; L153-H155 VanDerWaalsContact C-N 3.32Å; L153-H155 PolarHBondContact O-N 2.87Å; L153-L156 WeakPolarHBondContact O-CB 3.46Å; L153-L156 PolarHBondContact O-N 2.64Å; L153-C157 PolarHBondContact O-N 3.35Å; L153-C157 PolarHBondContact O-SG 3.45Å; L153-R302 HydrophobicContact CD1-CB 3.95Å; L153-R302 HydrophobicContact CD2-CB 4.04Å; L153-R302 HydrophobicContact CG-CB 4.47Å; L153-I303 HydrophobicContact CD1-CG1 3.71Å; L153-P381 HydrophobicContact CD1-CG 4.18Å; L153-P381 HydrophobicContact CD2-CG 3.96Å; L153-P381 HydrophobicContact CG-CG 4.32Å; L153-Y481 HydrophobicContact CD2-CD1 4.25Å; L153-Y481 HydrophobicContact CD2-CE1 3.41Å; L153-Y481 VanDerWaalsContact CD2-CE1 3.41Å; L153-Y481 HydrophobicContact CG-CE1 4.17Å
154	D	94.1	Very high	92.3	Very high	28 Å²	28	58.8 Å²	58.8	15%	0.15	31%	0.309	C	S	.	.	H	α-helix	trans	-65.5	-37.6	-178.5	-70.8	14.9	0	0	0	110	D150 C157 Q158 Y481 T483	D150-D154 WeakPolarHBondContact O-CB 3.29Å; D150-D154 PolarHBondContact O-N 3.35Å; D154-C157 PolarHBondContact O-N 2.84Å; D154-Q158 VanDerWaalsContact O-CG 3.22Å; D154-Q158 WeakPolarHBondContact O-CG 3.23Å; D154-Q158 PolarHBondContact O-N 3.27Å; D154-Q158 PolarHBondContact O-NE2 3.19Å; D154-Y481 WeakPolarHBondContact OD1-CD1 3.47Å; D154-T483 PolarHBondContact OD1-OG1 2.87Å; D154-T483 PolarHBondContact OD2-N 3.33Å
155	H	94.8	Very high	94	Very high	95 Å²	95	54.3 Å²	54.3	44%	0.44	28%	0.282	S	S	.	.	H	α-helix	trans	-63.5	-43.1	171	177.5	72.2	0	0	0	113.2	D151 L153 C157 Q158 T159	D151-H155 WeakPolarHBondContact O-CB 3.35Å; D151-H155 PolarHBondContact O-N 3.23Å; L153-H155 VanDerWaalsContact C-N 3.32Å; L153-H155 PolarHBondContact O-N 2.87Å; H155-C157 VanDerWaalsContact C-N 3.3Å; H155-C157 PolarHBondContact O-N 3.28Å; H155-Q158 PolarHBondContact O-N 3.26Å; H155-T159 WeakPolarHBondContact O-CB 3.29Å; H155-T159 WeakPolarHBondContact O-CG2 3.43Å; H155-T159 PolarHBondContact O-N 2.65Å; H155-T159 PolarHBondContact O-OG1 3.17Å
156	L	96.2	Very high	94.3	Very high	5 Å²	5	53.3 Å²	53.3	3%	0.026	28%	0.278	C	S	.	.	H	α-helix	trans	-62.2	-37.7	174.6	-72.2	171	0	0	0	111.8	E152 L153 G160 P192 A195 Y196 V299	E152-L156 HydrophobicContact CG-CD1 4.23Å; E152-L156 WeakPolarHBondContact O-CB 3.31Å; E152-L156 WeakPolarHBondContact O-CG 3.35Å; E152-L156 PolarHBondContact O-N 2.87Å; L153-L156 WeakPolarHBondContact O-CB 3.46Å; L153-L156 PolarHBondContact O-N 2.64Å; L156-G160 WeakPolarHBondContact O-CA 3.32Å; L156-G160 PolarHBondContact O-N 3.16Å; L156-P192 HydrophobicContact CB-CB 4.47Å; L156-P192 WeakPolarHBondContact O-CA 3.25Å; L156-A195 HydrophobicContact CD2-CB 3.64Å; L156-Y196 VanDerWaalsContact CD2-N 3.29Å; L156-V299 HydrophobicContact CD1-CG2 3.75Å
157	C	95.5	Very high	94.2	Very high	31 Å²	31	58 Å²	58	21%	0.209	29%	0.291	C	S	.	.	H	α-helix	trans	-67.2	-43.5	175.4	-63.8	0	0	0	0	112.1	L153 D154 H155	L153-C157 PolarHBondContact O-N 3.35Å; L153-C157 PolarHBondContact O-SG 3.45Å; D154-C157 PolarHBondContact O-N 2.84Å; H155-C157 VanDerWaalsContact C-N 3.3Å; H155-C157 PolarHBondContact O-N 3.28Å
158	Q	93.7	Very high	94.2	Very high	143 Å²	143	56 Å²	56	67%	0.668	28%	0.283	S	S	*	.	H	α-helix	trans	-68.1	-41.4	179.3	-69.5	164.2	27.8	0	0	112.9	D154 H155	D154-Q158 VanDerWaalsContact O-CG 3.22Å; D154-Q158 WeakPolarHBondContact O-CG 3.23Å; D154-Q158 PolarHBondContact O-N 3.27Å; D154-Q158 PolarHBondContact O-NE2 3.19Å; H155-Q158 PolarHBondContact O-N 3.26Å
159	T	94.2	Very high	94.3	Very high	33 Å²	33	56.1 Å²	56.1	20%	0.202	28%	0.283	C	S	.	.	H	α-helix	trans	-84.5	-18.3	-178	55.3	0	0	0	0	113.9	H155 A161 H162	H155-T159 WeakPolarHBondContact O-CB 3.29Å; H155-T159 WeakPolarHBondContact O-CG2 3.43Å; H155-T159 PolarHBondContact O-N 2.65Å; H155-T159 PolarHBondContact O-OG1 3.17Å; T159-A161 VanDerWaalsContact C-N 3.3Å; T159-A161 PolarHBondContact O-N 3.13Å; T159-H162 PolarHBondContact O-N 2.86Å; T159-H162 VanDerWaalsContact O-N 3.1Å
160	G	94.7	Very high	94.4	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-53.8	-39.5	-171	0	0	0	0	0	115	L156 H162 C163 G191	L156-G160 WeakPolarHBondContact O-CA 3.32Å; L156-G160 PolarHBondContact O-N 3.16Å; G160-H162 VanDerWaalsContact C-N 3.26Å; G160-H162 PolarHBondContact O-N 3.09Å; G160-C163 WeakPolarHBondContact O-CB 3.37Å; G160-C163 PolarHBondContact O-N 3.15Å; G160-G191 VanDerWaalsContact C-CA 3.49Å; G160-G191 VanDerWaalsContact CA-O 3.28Å; G160-G191 WeakPolarHBondContact CA-O 3.02Å; G160-G191 WeakPolarHBondContact O-CA 3.42Å
161	A	92.9	Very high	94.7	Very high	57 Å²	57	52.3 Å²	52.3	47%	0.471	26%	0.259	S	S	.	.	H	α-helix	trans	-59	-34.5	-179.4	0	0	0	0	0	113.3	T159 C163 H447	T159-A161 VanDerWaalsContact C-N 3.3Å; T159-A161 PolarHBondContact O-N 3.13Å; A161-C163 VanDerWaalsContact C-N 3.28Å; A161-C163 PolarHBondContact O-N 2.92Å; A161-H447 PolarHBondContact O-CE1 2.78Å
162	H	93.9	Very high	94.8	Very high	160 Å²	160	46.5 Å²	46.5	74%	0.741	23%	0.23	S	C	*	.	H	α-helix	trans	-74.1	-19	177.6	-58.6	-64.5	0	0	0	113.1	T159 G160	T159-H162 PolarHBondContact O-N 2.86Å; T159-H162 VanDerWaalsContact O-N 3.1Å; G160-H162 VanDerWaalsContact C-N 3.26Å; G160-H162 PolarHBondContact O-N 3.09Å
163	C	95.2	Very high	94.9	Very high	15 Å²	15	47.7 Å²	47.7	10%	0.101	24%	0.238	C	C	.	.	H	α-helix	trans	-88.9	-8	179	-66.6	0	0	0	0	113.8	G160 A161 L194 A195 N198	G160-C163 WeakPolarHBondContact O-CB 3.37Å; G160-C163 PolarHBondContact O-N 3.15Å; A161-C163 VanDerWaalsContact C-N 3.28Å; A161-C163 PolarHBondContact O-N 2.92Å; C163-L194 HydrophobicContact CB-CB 3.71Å; C163-L194 WeakPolarHBondContact O-CD1 3.27Å; C163-A195 HydrophobicContact CB-CB 4.48Å; C163-N198 PolarHBondContact SG-ND2 3.36Å; C163-N198 VanDerWaalsContact SG-ND2 3.43Å
164	I	96.5	Very high	94.7	Very high	18 Å²	18	49.4 Å²	49.4	9%	0.092	25%	0.25	C	C	.	.	S	Bend	trans	-74.7	126.8	174.6	-60.4	170.7	0	0	0	109.1	K166 A189 L194 R446 H447	I164-K166 PolarHBondContact O-N 2.97Å; I164-A189 VanDerWaalsContact CD1-O 3.31Å; I164-A189 WeakPolarHBondContact CD1-O 3.33Å; I164-L194 HydrophobicContact CB-CD1 4.44Å; I164-L194 HydrophobicContact CG1-CD1 4.08Å; I164-R446 HydrophobicContact CG2-CB 4.06Å; I164-R446 HydrophobicContact CG2-CG 3.86Å; I164-H447 PolarHBondContact O-NE2 3.03Å
165	P	94.5	Very high	94.6	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.259	C	S	.	.			trans	-62.8	129.1	176.7	-24	34.3	0	0	0	112.6	R167 H237 R446	P165-R167 WeakPolarHBondContact CB-O 3.26Å; P165-R167 PolarHBondContact O-N 2.66Å; P165-H237 HydrophobicContact CB-CB 3.7Å; P165-H237 HydrophobicContact CG-CB 3.78Å; P165-R446 WeakPolarHBondContact O-CD 3.41Å
166	K	89.9	Confident	94.7	Very high	164 Å²	164	47.9 Å²	47.9	71%	0.713	25%	0.253	S	S	*	.	S	Bend	trans	-61.8	-29.2	179.1	-73.3	-172.5	174.2	-171.7	0	113.7	I164	I164-K166 PolarHBondContact O-N 2.97Å
167	R	90.1	Very high	94.7	Very high	161 Å²	161	47.8 Å²	47.8	61%	0.608	25%	0.252	S	S	*	.	S	Bend	trans	-109.5	149.1	173	-63.6	-179.9	-176.8	154.7	7.3	108.9	P165 H237 N241	P165-R167 WeakPolarHBondContact CB-O 3.26Å; P165-R167 PolarHBondContact O-N 2.66Å; R167-H237 PolarHBondContact O-CD2 2.81Å; R167-N241 PolarHBondContact NH1-OD1 3.07Å
168	A	94.5	Very high	94.8	Very high	13 Å²	13	46.5 Å²	46.5	11%	0.107	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-100.4	137.8	165.5	0	0	0	0	0	109.4	L451 L453 V458	A168-L451 HydrophobicContact CB-CD1 3.72Å; A168-L453 HydrophobicContact CB-CD1 4.44Å; A168-L453 HydrophobicContact CB-CD2 3.59Å; A168-V458 HydrophobicContact CB-CG1 4.1Å; A168-V458 HydrophobicContact CB-CG2 4.41Å
169	L	96.9	Very high	95	Very high	2 Å²	2	39.9 Å²	39.9	1%	0.01	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-86.8	140.7	163.5	-66.1	177.6	0	0	0	108.8	Q185 E236 H237 Q240 G242 T244	L169-Q185 PolarHBondContact O-NE2 2.88Å; L169-E236 HydrophobicContact CD1-CB 3.98Å; L169-H237 PolarHBondContact N-CD2 2.8Å; L169-H237 PolarHBondContact N-NE2 3.25Å; L169-H237 VanDerWaalsContact N-NE2 3.13Å; L169-Q240 HydrophobicContact CD1-CB 4.31Å; L169-Q240 HydrophobicContact CD2-CB 4.36Å; L169-G242 WeakPolarHBondContact CA-O 3.14Å; L169-T244 HydrophobicContact CB-CG2 4.18Å; L169-T244 HydrophobicContact CD1-CG2 3.9Å
170	G	97.6	Very high	95.2	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	148.1	165.4	0	0	0	0	0	110.8	G242 R243 T244 D455	G170-G242 PolarHBondContact N-O 2.85Å; G170-R243 CarbonylContact O-C 3.5Å; G170-R243 WeakPolarHBondContact O-CA 3.42Å; G170-R243 WeakPolarHBondContact O-CB 3.39Å; G170-T244 PolarHBondContact O-N 2.97Å; G170-D455 CarbonylContact C-O 3.45Å; G170-D455 VanDerWaalsContact CA-O 3.27Å; G170-D455 WeakPolarHBondContact CA-O 3.5Å
171	F	98.1	Very high	95.4	Very high	1 Å²	1	38.5 Å²	38.5	0%	0.004	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	121.2	173.1	-68.3	-29.8	0	0	0	111.1	N173 N181 L184 Q185 L188 L233 H237 T244 P246 D455 S456	F171-N173 PolarHBondContact O-N 3.16Å; F171-N181 HydrophobicContact CB-CB 3.91Å; F171-N181 HydrophobicContact CD2-CB 4.06Å; F171-L184 HydrophobicContact CD2-CB 4.45Å; F171-L184 HydrophobicContact CE2-CB 3.71Å; F171-L184 HydrophobicContact CZ-CB 4.48Å; F171-Q185 HydrophobicContact CD2-CG 3.86Å; F171-Q185 HydrophobicContact CE2-CG 3.76Å; F171-L188 HydrophobicContact CE2-CD1 4.35Å; F171-L188 HydrophobicContact CZ-CD1 3.69Å; F171-L233 HydrophobicContact CE1-CD2 4.04Å; F171-L233 HydrophobicContact CZ-CD1 4.08Å; F171-L233 HydrophobicContact CZ-CD2 4.36Å; F171-H237 AromaticContact CE1-CE1 3.82Å; F171-H237 AromaticContact CZ-CE1 3.87Å; F171-T244 CarbonylContact C-O 3.52Å; F171-T244 WeakPolarHBondContact CA-O 3.42Å; F171-T244 HydrophobicContact CD1-CG2 3.62Å; F171-T244 HydrophobicContact CE1-CG2 3.6Å; F171-P246 HydrophobicContact CB-CG 4.3Å; F171-P246 HydrophobicContact CD1-CG 4.36Å; F171-P246 HydrophobicContact CD2-CG 4.46Å; F171-P246 HydrophobicContact CG-CG 4.15Å; F171-D455 PolarHBondContact N-O 3Å; F171-D455 CarbonylContact O-C 3.55Å; F171-D455 VanDerWaalsContact O-CA 3.23Å; F171-D455 WeakPolarHBondContact O-CA 3.25Å; F171-D455 VanDerWaalsContact O-CB 3.32Å; F171-D455 WeakPolarHBondContact O-CB 3.41Å; F171-S456 PolarHBondContact O-N 3.37Å
172	G	97.1	Very high	95.6	Very high	9 Å²	9	36 Å²	36	9%	0.093	18%	0.182	C	C	.	.			trans	-62.1	124.5	174.7	0	0	0	0	0	111.6	S174 T244 S456	G172-S174 PolarHBondContact O-N 2.66Å; G172-S174 PolarHBondContact O-OG 2.81Å; G172-T244 PolarHBondContact N-O 3.21Å; G172-S456 WeakPolarHBondContact CA-OG 3.44Å
173	N	96.7	Very high	95.9	Very high	66 Å²	66	28.3 Å²	28.3	35%	0.353	15%	0.147	S	C	.	.			trans	-67.4	116.3	171.1	-163.7	-46.3	0	0	0	108.7	F171 G175 N176 T177 D455	F171-N173 PolarHBondContact O-N 3.16Å; N173-G175 VanDerWaalsContact C-N 3.26Å; N173-G175 PolarHBondContact O-N 3Å; N173-G175 PolarHBondContact OD1-N 2.86Å; N173-G175 VanDerWaalsContact OD1-N 3.07Å; N173-N176 PolarHBondContact OD1-N 2.67Å; N173-T177 WeakPolarHBondContact CA-OG1 3.43Å; N173-T177 PolarHBondContact OD1-N 3.45Å; N173-D455 HydrophobicContact CB-CB 4.35Å; N173-D455 WeakPolarHBondContact CB-OD2 3.4Å; N173-D455 PolarHBondContact ND2-OD2 3.17Å
174	S	92.4	Very high	96	Very high	36 Å²	36	27.6 Å²	27.6	25%	0.252	14%	0.142	S	C	.	.			trans	-95.7	27.9	-176.4	-54.4	0	0	0	0	112.3	G172 T177 I245 Y263	G172-S174 PolarHBondContact O-N 2.66Å; G172-S174 PolarHBondContact O-OG 2.81Å; S174-T177 PolarHBondContact N-OG1 2.92Å; S174-I245 VanDerWaalsContact OG-CG2 3.28Å; S174-I245 WeakPolarHBondContact OG-CG2 3.3Å; S174-Y263 VanDerWaalsContact O-CD1 3.25Å; S174-Y263 WeakPolarHBondContact O-CD1 3.32Å; S174-Y263 WeakPolarHBondContact O-CE1 3.38Å
175	G	91.6	Very high	96.1	Very high	33 Å²	33	26.9 Å²	26.9	34%	0.34	14%	0.139	S	C	.	.	S	Bend	trans	93.1	102.4	-169.2	0	0	0	0	0	110.9	N173 T177 Y263	N173-G175 VanDerWaalsContact C-N 3.26Å; N173-G175 PolarHBondContact O-N 3Å; N173-G175 PolarHBondContact OD1-N 2.86Å; N173-G175 VanDerWaalsContact OD1-N 3.07Å; G175-T177 WeakPolarHBondContact O-CG2 3.19Å; G175-T177 PolarHBondContact O-N 3.19Å; G175-T177 VanDerWaalsContact O-N 3.11Å; G175-Y263 WeakPolarHBondContact O-CA 3.47Å
176	N	95.7	Very high	96.3	Very high	58 Å²	58	26.9 Å²	26.9	31%	0.31	14%	0.139	S	C	.	.	S	Bend	trans	56	18.6	-179.9	-65.9	-48.4	0	0	0	116.1	N173 C178 Y179 Y263 Q264 Q265	N173-N176 PolarHBondContact OD1-N 2.67Å; N176-C178 VanDerWaalsContact C-N 3.3Å; N176-C178 PolarHBondContact O-N 2.81Å; N176-Y179 WeakPolarHBondContact O-CD1 3.3Å; N176-Y179 VanDerWaalsContact O-CE1 3.27Å; N176-Y179 WeakPolarHBondContact O-CE1 3.38Å; N176-Y263 PolarHBondContact ND2-O 2.79Å; N176-Q264 WeakPolarHBondContact CB-O 3.42Å; N176-Q265 HydrophobicContact CB-CG 3.78Å; N176-Q265 VanDerWaalsContact CG-CG 3.48Å; N176-Q265 VanDerWaalsContact OD1-CG 3.22Å; N176-Q265 WeakPolarHBondContact OD1-CG 3.18Å; N176-Q265 PolarHBondContact OD1-NE2 2.99Å
177	T	97.3	Very high	96.7	Very high	3 Å²	3	19.1 Å²	19.1	2%	0.018	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	9.7	-173.2	67.6	0	0	0	0	115.1	N173 S174 G175 Y179 L180 N181 V250	N173-T177 WeakPolarHBondContact CA-OG1 3.43Å; N173-T177 PolarHBondContact OD1-N 3.45Å; S174-T177 PolarHBondContact N-OG1 2.92Å; G175-T177 WeakPolarHBondContact O-CG2 3.19Å; G175-T177 PolarHBondContact O-N 3.19Å; G175-T177 VanDerWaalsContact O-N 3.11Å; T177-Y179 VanDerWaalsContact C-N 3.31Å; T177-Y179 PolarHBondContact O-N 3.23Å; T177-L180 WeakPolarHBondContact O-CB 3.34Å; T177-L180 PolarHBondContact O-N 2.91Å; T177-L180 VanDerWaalsContact O-N 3.07Å; T177-N181 VanDerWaalsContact O-CG 3.31Å; T177-N181 PolarHBondContact O-N 3.27Å; T177-N181 PolarHBondContact OG1-ND2 3.24Å; T177-V250 HydrophobicContact CG2-CG1 4.07Å; T177-V250 HydrophobicContact CG2-CG2 4.02Å
178	C	97.8	Very high	97.1	Very high	4 Å²	4	11.4 Å²	11.4	3%	0.027	8%	0.076	C	C	.	.	H	α-helix	trans	-62.8	-33.2	-175.9	52.5	0	0	0	0	113.5	N176 L180 N181 S182 H439	N176-C178 VanDerWaalsContact C-N 3.3Å; N176-C178 PolarHBondContact O-N 2.81Å; C178-L180 VanDerWaalsContact C-N 3.26Å; C178-L180 PolarHBondContact O-N 3.45Å; C178-N181 PolarHBondContact O-N 3.48Å; C178-S182 WeakPolarHBondContact O-CB 3.27Å; C178-S182 PolarHBondContact O-N 2.64Å; C178-S182 PolarHBondContact O-OG 2.9Å; C178-H439 VanDerWaalsContact CB-CE1 3.44Å; C178-H439 WeakPolarHBondContact CB-CE1 3.48Å; C178-H439 WeakPolarHBondContact CB-ND1 3.19Å; C178-H439 PolarHBondContact SG-ND1 3.41Å
179	Y	97.9	Very high	97.3	Very high	5 Å²	5	10.9 Å²	10.9	2%	0.02	7%	0.071	C	C	.	.	H	α-helix	trans	-60.3	-34.8	173.2	72.4	-93.7	0	0	0	112.9	N176 T177 S182 V183 L260 Q264 E266 F271 Y440	N176-Y179 WeakPolarHBondContact O-CD1 3.3Å; N176-Y179 VanDerWaalsContact O-CE1 3.27Å; N176-Y179 WeakPolarHBondContact O-CE1 3.38Å; T177-Y179 VanDerWaalsContact C-N 3.31Å; T177-Y179 PolarHBondContact O-N 3.23Å; Y179-S182 PolarHBondContact O-OG 3.45Å; Y179-V183 VanDerWaalsContact O-CG2 3.28Å; Y179-V183 WeakPolarHBondContact O-CG2 3.33Å; Y179-L260 HydrophobicContact CE2-CD1 4.29Å; Y179-Q264 WeakPolarHBondContact CE1-O 3.25Å; Y179-E266 WeakPolarHBondContact CB-O 3.47Å; Y179-E266 HydrophobicContact CD1-CB 4.27Å; Y179-E266 HydrophobicContact CD2-CB 4.42Å; Y179-E266 HydrophobicContact CE1-CB 3.97Å; Y179-E266 HydrophobicContact CE1-CG 4.28Å; Y179-E266 HydrophobicContact CE2-CB 4.16Å; Y179-E266 HydrophobicContact CG-CB 4.49Å; Y179-F271 HydrophobicContact CD2-CB 3.77Å; Y179-F271 HydrophobicContact CD2-CD2 4.49Å; Y179-F271 HydrophobicContact CD2-CG 4.04Å; Y179-F271 HydrophobicContact CE2-CB 3.96Å; Y179-F271 HydrophobicContact CE2-CD2 4.01Å; Y179-F271 HydrophobicContact CE2-CG 4.02Å; Y179-Y440 VanDerWaalsContact CB-CD2 3.47Å
180	L	97.9	Very high	97.3	Very high	1 Å²	1	10.8 Å²	10.8	1%	0.005	7%	0.071	C	C	.	.	H	α-helix	trans	-79.8	-44.1	177.1	168.8	156.4	0	0	0	110.4	T177 C178 V183 L184 P246 F249 V250 F271	T177-L180 WeakPolarHBondContact O-CB 3.34Å; T177-L180 PolarHBondContact O-N 2.91Å; T177-L180 VanDerWaalsContact O-N 3.07Å; C178-L180 VanDerWaalsContact C-N 3.26Å; C178-L180 PolarHBondContact O-N 3.45Å; L180-V183 PolarHBondContact O-N 3.38Å; L180-L184 HydrophobicContact CD2-CD1 3.6Å; L180-L184 HydrophobicContact CD2-CG 4.45Å; L180-L184 HydrophobicContact CG-CD1 4.12Å; L180-L184 WeakPolarHBondContact O-CB 3.32Å; L180-L184 VanDerWaalsContact O-CG 3.3Å; L180-L184 WeakPolarHBondContact O-CG 3.34Å; L180-L184 PolarHBondContact O-N 2.83Å; L180-P246 HydrophobicContact CD2-CB 4.44Å; L180-P246 HydrophobicContact CD2-CG 3.82Å; L180-F249 HydrophobicContact CD1-CB 4.08Å; L180-F249 HydrophobicContact CD2-CB 4.44Å; L180-V250 HydrophobicContact CD1-CG2 4.3Å; L180-V250 HydrophobicContact CD2-CG2 4.15Å; L180-F271 HydrophobicContact CB-CD1 4.33Å; L180-F271 HydrophobicContact CB-CE1 4.07Å; L180-F271 HydrophobicContact CB-CE2 4.25Å; L180-F271 HydrophobicContact CB-CZ 4.04Å; L180-F271 HydrophobicContact CD1-CD2 4.48Å; L180-F271 HydrophobicContact CD1-CE2 3.68Å; L180-F271 HydrophobicContact CD1-CZ 3.77Å; L180-F271 HydrophobicContact CG-CE1 3.94Å; L180-F271 HydrophobicContact CG-CE2 3.91Å; L180-F271 HydrophobicContact CG-CZ 3.53Å
181	N	98.3	Very high	97.3	Very high	3 Å²	3	10.8 Å²	10.8	2%	0.016	7%	0.071	C	C	.	.	H	α-helix	trans	-62.6	-50.3	-178	-71.1	-14.5	0	0	0	111.3	F171 T177 C178 V183 L184 Q185 P246 D455	F171-N181 HydrophobicContact CB-CB 3.91Å; F171-N181 HydrophobicContact CD2-CB 4.06Å; T177-N181 VanDerWaalsContact O-CG 3.31Å; T177-N181 PolarHBondContact O-N 3.27Å; T177-N181 PolarHBondContact OG1-ND2 3.24Å; C178-N181 PolarHBondContact O-N 3.48Å; N181-V183 PolarHBondContact O-N 3.29Å; N181-L184 PolarHBondContact O-N 3.18Å; N181-Q185 WeakPolarHBondContact O-CG 3.47Å; N181-Q185 PolarHBondContact O-N 3.49Å; N181-P246 VanDerWaalsContact OD1-CG 3.26Å; N181-P246 WeakPolarHBondContact OD1-CG 3.37Å; N181-D455 WeakPolarHBondContact CB-OD1 3.4Å; N181-D455 PolarHBondContact ND2-OD1 2.79Å
182	S	98.5	Very high	97.3	Very high	3 Å²	3	10.8 Å²	10.8	2%	0.021	7%	0.071	C	C	.	.	H	α-helix	trans	-57.3	-46.2	177.6	54.6	0	0	0	0	113	C178 Y179 Q185 C186 Y440 S442	C178-S182 WeakPolarHBondContact O-CB 3.27Å; C178-S182 PolarHBondContact O-N 2.64Å; C178-S182 PolarHBondContact O-OG 2.9Å; Y179-S182 PolarHBondContact O-OG 3.45Å; S182-Q185 PolarHBondContact O-N 2.75Å; S182-C186 PolarHBondContact O-N 3.29Å; S182-C186 PolarHBondContact O-SG 3.04Å; S182-C186 VanDerWaalsContact O-SG 3.37Å; S182-Y440 WeakPolarHBondContact OG-CB 3.43Å; S182-S442 WeakPolarHBondContact O-CB 3.43Å
183	V	98.8	Very high	97.3	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-64.8	-44.4	177.1	168.8	0	0	0	0	111.9	Y179 L180 N181 Q185 C186 I187 A268 F271 L272 L275 L473	Y179-V183 VanDerWaalsContact O-CG2 3.28Å; Y179-V183 WeakPolarHBondContact O-CG2 3.33Å; L180-V183 PolarHBondContact O-N 3.38Å; N181-V183 PolarHBondContact O-N 3.29Å; V183-Q185 PolarHBondContact O-N 3.43Å; V183-C186 PolarHBondContact O-N 2.74Å; V183-I187 HydrophobicContact CG1-CG1 4.29Å; V183-I187 WeakPolarHBondContact O-CG1 3.47Å; V183-I187 PolarHBondContact O-N 3.21Å; V183-A268 HydrophobicContact CG2-CB 3.91Å; V183-A268 WeakPolarHBondContact CG2-O 3.47Å; V183-F271 HydrophobicContact CB-CD1 3.81Å; V183-F271 HydrophobicContact CB-CE1 4.05Å; V183-F271 HydrophobicContact CG1-CD1 3.75Å; V183-F271 HydrophobicContact CG1-CE1 3.87Å; V183-F271 HydrophobicContact CG2-CD1 4.22Å; V183-L272 HydrophobicContact CG1-CB 3.94Å; V183-L272 HydrophobicContact CG1-CD1 3.9Å; V183-L272 HydrophobicContact CG1-CG 4.46Å; V183-L272 HydrophobicContact CG2-CB 4.28Å; V183-L275 HydrophobicContact CG1-CD2 4.18Å; V183-L473 HydrophobicContact CG2-CD1 4.45Å
184	L	98.6	Very high	97.3	Very high	0 Å²	0	7.2 Å²	7.2	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-61.3	-34.7	177.8	-73.7	178.8	0	0	0	112	F171 L180 N181 I187 L188 L230 L233 P246 F249 F271 L275	F171-L184 HydrophobicContact CD2-CB 4.45Å; F171-L184 HydrophobicContact CE2-CB 3.71Å; F171-L184 HydrophobicContact CZ-CB 4.48Å; L180-L184 HydrophobicContact CD2-CD1 3.6Å; L180-L184 HydrophobicContact CD2-CG 4.45Å; L180-L184 HydrophobicContact CG-CD1 4.12Å; L180-L184 WeakPolarHBondContact O-CB 3.32Å; L180-L184 VanDerWaalsContact O-CG 3.3Å; L180-L184 WeakPolarHBondContact O-CG 3.34Å; L180-L184 PolarHBondContact O-N 2.83Å; N181-L184 PolarHBondContact O-N 3.18Å; L184-I187 PolarHBondContact O-N 2.85Å; L184-L188 WeakPolarHBondContact O-CB 3.46Å; L184-L188 VanDerWaalsContact O-CG 3.29Å; L184-L188 WeakPolarHBondContact O-CG 3.19Å; L184-L188 PolarHBondContact O-N 2.95Å; L184-L230 HydrophobicContact CD2-CD2 4.06Å; L184-L233 HydrophobicContact CD1-CD1 4.17Å; L184-P246 HydrophobicContact CD1-CB 3.81Å; L184-P246 HydrophobicContact CD1-CG 4.22Å; L184-F249 HydrophobicContact CD1-CB 4.11Å; L184-F249 HydrophobicContact CD1-CD1 4.18Å; L184-F249 HydrophobicContact CD1-CD2 3.96Å; L184-F249 HydrophobicContact CD1-CE2 4.43Å; L184-F249 HydrophobicContact CD1-CG 3.83Å; L184-F249 HydrophobicContact CD2-CD1 3.87Å; L184-F249 HydrophobicContact CD2-CE1 3.71Å; L184-F249 HydrophobicContact CD2-CG 4.33Å; L184-F249 HydrophobicContact CD2-CZ 4.05Å; L184-F271 HydrophobicContact CG-CE1 4.36Å; L184-L275 HydrophobicContact CD2-CD2 4Å
185	Q	98.3	Very high	97.6	Very high	3 Å²	3	5.5 Å²	5.5	1%	0.014	4%	0.038	C	C	.	.	H	α-helix	trans	-65.2	-41.9	174.8	-69.3	-68.5	8.8	0	0	112.9	L169 F171 N181 S182 V183 L188 A189 S442 R446 L453	L169-Q185 PolarHBondContact O-NE2 2.88Å; F171-Q185 HydrophobicContact CD2-CG 3.86Å; F171-Q185 HydrophobicContact CE2-CG 3.76Å; N181-Q185 WeakPolarHBondContact O-CG 3.47Å; N181-Q185 PolarHBondContact O-N 3.49Å; S182-Q185 PolarHBondContact O-N 2.75Å; V183-Q185 PolarHBondContact O-N 3.43Å; Q185-L188 CarbonylContact O-C 3.53Å; Q185-L188 PolarHBondContact O-N 3.22Å; Q185-A189 PolarHBondContact O-N 2.85Å; Q185-S442 WeakPolarHBondContact CB-OG 3.37Å; Q185-R446 PolarHBondContact O-NH2 2.91Å; Q185-L453 HydrophobicContact CB-CD1 3.71Å; Q185-L453 HydrophobicContact CG-CB 4.16Å; Q185-L453 HydrophobicContact CG-CD1 3.88Å
186	C	98.7	Very high	97.8	Very high	0 Å²	0	5.1 Å²	5.1	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-65.5	-39.4	174.8	-57.8	0	0	0	0	112	S182 V183 L188 A189 T190 A426 V428 F475	S182-C186 PolarHBondContact O-N 3.29Å; S182-C186 PolarHBondContact O-SG 3.04Å; S182-C186 VanDerWaalsContact O-SG 3.37Å; V183-C186 PolarHBondContact O-N 2.74Å; C186-L188 VanDerWaalsContact C-N 3.34Å; C186-L188 PolarHBondContact O-N 3Å; C186-A189 PolarHBondContact O-N 3.1Å; C186-A189 VanDerWaalsContact O-N 3.08Å; C186-T190 PolarHBondContact O-N 3.16Å; C186-T190 PolarHBondContact O-OG1 2.89Å; C186-A426 HydrophobicContact CB-CB 3.92Å; C186-V428 WeakPolarHBondContact SG-CG2 3.37Å; C186-F475 HydrophobicContact CB-CD1 4.45Å; C186-F475 HydrophobicContact CB-CD2 3.99Å; C186-F475 HydrophobicContact CB-CE1 4.16Å; C186-F475 HydrophobicContact CB-CE2 3.67Å; C186-F475 HydrophobicContact CB-CG 4.38Å; C186-F475 HydrophobicContact CB-CZ 3.76Å
187	I	98.4	Very high	97.8	Very high	0 Å²	0	2.4 Å²	2.4	0%	0	1%	0.011	C	C	.	.	H	α-helix	trans	-63.7	-39.3	174.9	-68.1	-68.8	0	0	0	111.2	V183 L184 A189 T190 L193 L230 L272 L275 M279 F304	V183-I187 HydrophobicContact CG1-CG1 4.29Å; V183-I187 WeakPolarHBondContact O-CG1 3.47Å; V183-I187 PolarHBondContact O-N 3.21Å; L184-I187 PolarHBondContact O-N 2.85Å; I187-A189 PolarHBondContact O-N 3.3Å; I187-T190 WeakPolarHBondContact O-CB 3.36Å; I187-T190 PolarHBondContact O-N 3.42Å; I187-L193 HydrophobicContact CG2-CD2 3.77Å; I187-L230 HydrophobicContact CG2-CD1 3.84Å; I187-L230 HydrophobicContact CG2-CD2 3.78Å; I187-L272 HydrophobicContact CD1-CD1 4.07Å; I187-L275 HydrophobicContact CG1-CD2 3.96Å; I187-M279 HydrophobicContact CD1-CE 4.44Å; I187-F304 HydrophobicContact CD1-CZ 4.4Å
188	L	97.9	Very high	97.7	Very high	0 Å²	0	4.4 Å²	4.4	0%	0	2%	0.022	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	1.7	173	-68.2	170.5	0	0	0	114.8	F171 L184 Q185 C186 L194 L230 L233 I234	F171-L188 HydrophobicContact CE2-CD1 4.35Å; F171-L188 HydrophobicContact CZ-CD1 3.69Å; L184-L188 WeakPolarHBondContact O-CB 3.46Å; L184-L188 VanDerWaalsContact O-CG 3.29Å; L184-L188 WeakPolarHBondContact O-CG 3.19Å; L184-L188 PolarHBondContact O-N 2.95Å; Q185-L188 CarbonylContact O-C 3.53Å; Q185-L188 PolarHBondContact O-N 3.22Å; C186-L188 VanDerWaalsContact C-N 3.34Å; C186-L188 PolarHBondContact O-N 3Å; L188-L194 HydrophobicContact CD2-CD2 4.16Å; L188-L194 WeakPolarHBondContact O-CD1 3.29Å; L188-L230 HydrophobicContact CD2-CD2 4.47Å; L188-L233 HydrophobicContact CD1-CB 3.92Å; L188-L233 HydrophobicContact CD1-CD1 4.16Å; L188-L233 HydrophobicContact CD2-CB 4.26Å; L188-I234 HydrophobicContact CD2-CG1 3.78Å
189	A	97.9	Very high	97.3	Very high	2 Å²	2	9 Å²	9	2%	0.017	4%	0.043	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-1.3	164.5	0	0	0	0	0	112.8	I164 Q185 C186 I187 G191 Y425 T444	I164-A189 VanDerWaalsContact CD1-O 3.31Å; I164-A189 WeakPolarHBondContact CD1-O 3.33Å; Q185-A189 PolarHBondContact O-N 2.85Å; C186-A189 PolarHBondContact O-N 3.1Å; C186-A189 VanDerWaalsContact O-N 3.08Å; I187-A189 PolarHBondContact O-N 3.3Å; A189-G191 PolarHBondContact O-N 3.45Å; A189-Y425 HydrophobicContact CB-CD2 4.05Å; A189-Y425 HydrophobicContact CB-CE2 4.15Å; A189-Y425 WeakPolarHBondContact O-CE2 3.34Å; A189-T444 HydrophobicContact CB-CG2 3.88Å
190	T	98.3	Very high	96.9	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	7%	0.067	C	C	.	.			trans	-90.5	82.9	-173.9	-53.9	0	0	0	0	111.5	C186 I187 L193 L194 F304 I382 Y425	C186-T190 PolarHBondContact O-N 3.16Å; C186-T190 PolarHBondContact O-OG1 2.89Å; I187-T190 WeakPolarHBondContact O-CB 3.36Å; I187-T190 PolarHBondContact O-N 3.42Å; T190-L193 HydrophobicContact CG2-CB 4.28Å; T190-L193 WeakPolarHBondContact O-CB 3.32Å; T190-L193 PolarHBondContact O-N 2.86Å; T190-L193 VanDerWaalsContact O-N 3.1Å; T190-L194 PolarHBondContact O-N 3.33Å; T190-F304 HydrophobicContact CG2-CE1 3.85Å; T190-F304 HydrophobicContact CG2-CZ 3.68Å; T190-I382 HydrophobicContact CG2-CB 4.5Å; T190-I382 HydrophobicContact CG2-CD1 3.92Å; T190-I382 HydrophobicContact CG2-CG1 3.73Å; T190-I382 HydrophobicContact CG2-CG2 4.15Å; T190-Y425 WeakPolarHBondContact CG2-OH 3.4Å; T190-Y425 PolarHBondContact OG1-OH 3.23Å
191	G	97.2	Very high	96.5	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-40.9	-53.1	-172.8	0	0	0	0	0	116.7	G160 A189 L193 L194 A195	G160-G191 VanDerWaalsContact C-CA 3.49Å; G160-G191 VanDerWaalsContact CA-O 3.28Å; G160-G191 WeakPolarHBondContact CA-O 3.02Å; G160-G191 WeakPolarHBondContact O-CA 3.42Å; A189-G191 PolarHBondContact O-N 3.45Å; G191-L193 VanDerWaalsContact C-N 3.26Å; G191-L193 PolarHBondContact O-N 3.45Å; G191-L194 PolarHBondContact O-N 2.8Å; G191-A195 PolarHBondContact O-N 3.24Å
192	P	97.3	Very high	95.4	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-62	-31.8	-175	-22.3	32	0	0	0	113.8	L156 Y196 I303 I382 E477	L156-P192 HydrophobicContact CB-CB 4.47Å; L156-P192 WeakPolarHBondContact O-CA 3.25Å; P192-Y196 PolarHBondContact O-N 2.88Å; P192-I303 HydrophobicContact CB-CD1 4.11Å; P192-I303 HydrophobicContact CB-CG1 4.25Å; P192-I303 HydrophobicContact CB-CG2 4.24Å; P192-I382 HydrophobicContact CG-CD1 4.24Å; P192-I382 HydrophobicContact CG-CG1 4.45Å; P192-E477 WeakPolarHBondContact CD-OE1 3.5Å
193	L	98.1	Very high	94.7	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-71.7	-38.3	175.3	173.9	63.2	0	0	0	111.4	I187 T190 G191 Y196 I197 L230 M279 I300 F304	I187-L193 HydrophobicContact CG2-CD2 3.77Å; T190-L193 HydrophobicContact CG2-CB 4.28Å; T190-L193 WeakPolarHBondContact O-CB 3.32Å; T190-L193 PolarHBondContact O-N 2.86Å; T190-L193 VanDerWaalsContact O-N 3.1Å; G191-L193 VanDerWaalsContact C-N 3.26Å; G191-L193 PolarHBondContact O-N 3.45Å; L193-Y196 PolarHBondContact O-N 3.45Å; L193-I197 HydrophobicContact CD1-CD1 4.11Å; L193-I197 HydrophobicContact CD1-CG1 4.45Å; L193-I197 HydrophobicContact CG-CD1 3.97Å; L193-I197 WeakPolarHBondContact O-CG1 3.42Å; L193-I197 PolarHBondContact O-N 3.12Å; L193-L230 HydrophobicContact CD2-CD1 4.27Å; L193-M279 HydrophobicContact CD1-SD 4.02Å; L193-M279 HydrophobicContact CD2-CE 3.99Å; L193-M279 HydrophobicContact CD2-SD 3.76Å; L193-I300 HydrophobicContact CD1-CD1 3.82Å; L193-F304 HydrophobicContact CB-CE2 4.27Å; L193-F304 HydrophobicContact CB-CZ 4.28Å; L193-F304 HydrophobicContact CD1-CE2 4.49Å; L193-F304 HydrophobicContact CD2-CE2 4.04Å; L193-F304 HydrophobicContact CD2-CZ 3.9Å; L193-F304 HydrophobicContact CG-CE2 4.5Å
194	L	97.4	Very high	93.6	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-69.8	-38.6	179.2	-51.7	179.9	0	0	0	111.1	C163 I164 L188 T190 G191 Y196 I197 N198 I234	C163-L194 HydrophobicContact CB-CB 3.71Å; C163-L194 WeakPolarHBondContact O-CD1 3.27Å; I164-L194 HydrophobicContact CB-CD1 4.44Å; I164-L194 HydrophobicContact CG1-CD1 4.08Å; L188-L194 HydrophobicContact CD2-CD2 4.16Å; L188-L194 WeakPolarHBondContact O-CD1 3.29Å; T190-L194 PolarHBondContact O-N 3.33Å; G191-L194 PolarHBondContact O-N 2.8Å; L194-Y196 VanDerWaalsContact C-N 3.35Å; L194-Y196 PolarHBondContact O-N 2.95Å; L194-I197 PolarHBondContact O-N 3.22Å; L194-N198 VanDerWaalsContact O-CB 3.32Å; L194-N198 WeakPolarHBondContact O-CB 3.34Å; L194-N198 PolarHBondContact O-N 3.4Å; L194-N198 PolarHBondContact O-ND2 2.68Å; L194-I234 HydrophobicContact CB-CD1 4.38Å; L194-I234 HydrophobicContact CD2-CD1 3.69Å; L194-I234 HydrophobicContact CD2-CG1 4.04Å
195	A	97	Very high	92.7	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-58.2	-45.8	169.6	0	0	0	0	0	111.4	L156 C163 G191 I197 N198 H199	L156-A195 HydrophobicContact CD2-CB 3.64Å; C163-A195 HydrophobicContact CB-CB 4.48Å; G191-A195 PolarHBondContact O-N 3.24Å; A195-I197 PolarHBondContact O-N 2.85Å; A195-N198 PolarHBondContact O-N 3.17Å; A195-H199 WeakPolarHBondContact O-CB 3.41Å; A195-H199 PolarHBondContact O-CD2 3.07Å; A195-H199 PolarHBondContact O-N 2.84Å
196	Y	96.8	Very high	92.2	Very high	26 Å²	26	31.3 Å²	31.3	10%	0.102	18%	0.184	C	C	.	.	H	α-helix	trans	-61	-44.4	177.5	168.2	-105.2	0	0	0	111.9	L156 P192 L193 L194 H199 K200 L227 V299	L156-Y196 VanDerWaalsContact CD2-N 3.29Å; P192-Y196 PolarHBondContact O-N 2.88Å; L193-Y196 PolarHBondContact O-N 3.45Å; L194-Y196 VanDerWaalsContact C-N 3.35Å; L194-Y196 PolarHBondContact O-N 2.95Å; Y196-H199 PolarHBondContact O-N 3.32Å; Y196-K200 HydrophobicContact CD2-CB 3.82Å; Y196-K200 HydrophobicContact CD2-CG 3.7Å; Y196-K200 HydrophobicContact CE2-CB 3.49Å; Y196-K200 VanDerWaalsContact CE2-CB 3.49Å; Y196-K200 HydrophobicContact CE2-CG 3.7Å; Y196-K200 WeakPolarHBondContact O-CA 3.45Å; Y196-K200 WeakPolarHBondContact O-CB 3.48Å; Y196-K200 PolarHBondContact O-N 3.45Å; Y196-L227 HydrophobicContact CE1-CD1 3.87Å; Y196-L227 HydrophobicContact CE1-CD2 4.23Å; Y196-V299 HydrophobicContact CD1-CG1 3.97Å; Y196-V299 HydrophobicContact CD2-CB 4.25Å; Y196-V299 HydrophobicContact CD2-CG1 3.93Å; Y196-V299 HydrophobicContact CD2-CG2 3.8Å; Y196-V299 HydrophobicContact CE1-CG1 3.73Å; Y196-V299 HydrophobicContact CE2-CB 4.3Å; Y196-V299 HydrophobicContact CE2-CG1 3.69Å; Y196-V299 HydrophobicContact CE2-CG2 4.35Å; Y196-V299 HydrophobicContact CG-CG1 4.07Å; Y196-V299 HydrophobicContact CG-CG2 3.91Å
197	I	96.5	Very high	91.9	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-61.5	-46.1	176.4	-68.4	160.9	0	0	0	110.5	L193 L194 A195 H199 H201 S202 L227 L230 I234	L193-I197 HydrophobicContact CD1-CD1 4.11Å; L193-I197 HydrophobicContact CD1-CG1 4.45Å; L193-I197 HydrophobicContact CG-CD1 3.97Å; L193-I197 WeakPolarHBondContact O-CG1 3.42Å; L193-I197 PolarHBondContact O-N 3.12Å; L194-I197 PolarHBondContact O-N 3.22Å; A195-I197 PolarHBondContact O-N 2.85Å; I197-H199 PolarHBondContact O-N 2.83Å; I197-H201 CarbonylContact O-C 3.19Å; I197-H201 WeakPolarHBondContact O-CA 3.42Å; I197-H201 PolarHBondContact O-N 2.77Å; I197-S202 PolarHBondContact O-N 2.84Å; I197-L227 HydrophobicContact CD1-CD2 4.36Å; I197-L227 HydrophobicContact CG1-CD2 4.03Å; I197-L230 HydrophobicContact CD1-CB 3.69Å; I197-L230 HydrophobicContact CD1-CD1 3.84Å; I197-L230 HydrophobicContact CD1-CG 4.44Å; I197-I234 HydrophobicContact CB-CD1 4.3Å; I197-I234 HydrophobicContact CD1-CD1 4.36Å; I197-I234 HydrophobicContact CG2-CD1 3.89Å
198	N	93.6	Very high	91.6	Very high	45 Å²	45	34 Å²	34	24%	0.241	20%	0.199	C	C	.	.	H	α-helix	trans	-67.7	-33.3	-178.2	-69.3	-15.8	0	0	0	113.2	C163 L194 A195 S202	C163-N198 PolarHBondContact SG-ND2 3.36Å; C163-N198 VanDerWaalsContact SG-ND2 3.43Å; L194-N198 VanDerWaalsContact O-CB 3.32Å; L194-N198 WeakPolarHBondContact O-CB 3.34Å; L194-N198 PolarHBondContact O-N 3.4Å; L194-N198 PolarHBondContact O-ND2 2.68Å; A195-N198 PolarHBondContact O-N 3.17Å; N198-S202 WeakPolarHBondContact O-CB 3.49Å; N198-S202 PolarHBondContact O-OG 3.17Å
199	H	90.4	Very high	91.4	Very high	102 Å²	102	34.1 Å²	34.1	47%	0.472	20%	0.199	S	C	.	.	H	α-helix	trans	-93.2	-24.5	-179	-64.3	-55.1	0	0	0	114.8	A195 Y196 I197	A195-H199 WeakPolarHBondContact O-CB 3.41Å; A195-H199 PolarHBondContact O-CD2 3.07Å; A195-H199 PolarHBondContact O-N 2.84Å; Y196-H199 PolarHBondContact O-N 3.32Å; I197-H199 PolarHBondContact O-N 2.83Å
200	K	89.9	Confident	91	Very high	119 Å²	119	35.9 Å²	35.9	52%	0.517	21%	0.208	S	C	.	.	H	α-helix	trans	-128.4	-11.7	-170.8	-53.2	-73.7	172	132.8	0	114.8	E152 Y196	E152-K200 VanDerWaalsContact OE1-CE 3.31Å; E152-K200 WeakPolarHBondContact OE1-CE 3.2Å; E152-K200 IonicContact OE1-NZ 2.6Å; E152-K200 PolarHBondContact OE1-NZ 2.78Å; Y196-K200 HydrophobicContact CD2-CB 3.82Å; Y196-K200 HydrophobicContact CD2-CG 3.7Å; Y196-K200 HydrophobicContact CE2-CB 3.49Å; Y196-K200 VanDerWaalsContact CE2-CB 3.49Å; Y196-K200 HydrophobicContact CE2-CG 3.7Å; Y196-K200 WeakPolarHBondContact O-CA 3.45Å; Y196-K200 WeakPolarHBondContact O-CB 3.48Å; Y196-K200 PolarHBondContact O-N 3.45Å
201	H	88.3	Confident	90.6	Very high	26 Å²	26	37.6 Å²	37.6	12%	0.12	22%	0.221	C	C	.	.	S	Bend	trans	-137.3	18.1	-178.4	-145.5	92.2	0	0	0	114.3	I197 N203 C207 C225 L227 C228	I197-H201 CarbonylContact O-C 3.19Å; I197-H201 WeakPolarHBondContact O-CA 3.42Å; I197-H201 PolarHBondContact O-N 2.77Å; H201-N203 VanDerWaalsContact C-N 3.25Å; H201-N203 PolarHBondContact O-N 2.84Å; H201-C207 PolarHBondContact NE2-SG 3.11Å; H201-C207 VanDerWaalsContact NE2-SG 3.45Å; H201-C225 PolarHBondContact NE2-SG 2.99Å; H201-L227 HydrophobicContact CB-CB 4.21Å; H201-L227 VanDerWaalsContact CD2-CB 3.46Å; H201-L227 WeakPolarHBondContact CD2-CB 3.37Å; H201-C228 PolarHBondContact NE2-SG 3.38Å
202	S	76.3	Confident	90.2	Very high	66 Å²	66	38.8 Å²	38.8	46%	0.462	23%	0.233	S	C	.	.			trans	-73.9	-4.8	-170.3	34.6	0	0	0	0	115.6	I197 N198 P204	I197-S202 PolarHBondContact O-N 2.84Å; N198-S202 WeakPolarHBondContact O-CB 3.49Å; N198-S202 PolarHBondContact O-OG 3.17Å; S202-P204 WeakPolarHBondContact O-CD 3.37Å
203	N	82.2	Confident	89.9	Confident	97 Å²	97	46.8 Å²	46.8	52%	0.519	26%	0.263	S	S	.	.			trans	-116.3	95.3	173	-173.5	-17.2	0	0	0	111.5	H201 G205 S206	H201-N203 VanDerWaalsContact C-N 3.25Å; H201-N203 PolarHBondContact O-N 2.84Å; N203-G205 PolarHBondContact O-N 2.62Å; N203-G205 VanDerWaalsContact O-N 3.13Å; N203-G205 WeakPolarHBondContact OD1-CA 3.43Å; N203-G205 PolarHBondContact OD1-N 3.34Å; N203-S206 PolarHBondContact O-N 3.1Å; N203-S206 PolarHBondContact O-OG 3.46Å; N203-S206 PolarHBondContact OD1-N 3.46Å
204	P	77.5	Confident	89.6	Confident	32 Å²	32	47.2 Å²	47.2	21%	0.208	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-17	175.8	-27	36.4	0	0	0	115.4	S202 C207 N210 C228	S202-P204 WeakPolarHBondContact O-CD 3.37Å; P204-C207 WeakPolarHBondContact O-CB 3.37Å; P204-N210 PolarHBondContact O-ND2 2.72Å; P204-C228 HydrophobicContact CB-CB 4.24Å
205	G	79.4	Confident	89.2	Confident	67 Å²	67	49.8 Å²	49.8	69%	0.691	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-33.1	179.3	0	0	0	0	0	113.8	N203 C207	N203-G205 PolarHBondContact O-N 2.62Å; N203-G205 VanDerWaalsContact O-N 3.13Å; N203-G205 WeakPolarHBondContact OD1-CA 3.43Å; N203-G205 PolarHBondContact OD1-N 3.34Å; G205-C207 VanDerWaalsContact C-N 3.29Å
206	S	86.5	Confident	88.9	Confident	75 Å²	75	51.2 Å²	51.2	52%	0.524	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-6.8	173.1	60.9	0	0	0	0	113.3	N203 I208	N203-S206 PolarHBondContact O-N 3.1Å; N203-S206 PolarHBondContact O-OG 3.46Å; N203-S206 PolarHBondContact OD1-N 3.46Å; S206-I208 PolarHBondContact O-N 2.92Å
207	C	92.6	Very high	88.6	Confident	7 Å²	7	54.9 Å²	54.9	5%	0.047	32%	0.319	C	S	.	.			trans	-59.6	117.8	-175.1	-174	0	0	0	0	112.7	H201 P204 G205 I209 N210 S211 C228	H201-C207 PolarHBondContact NE2-SG 3.11Å; H201-C207 VanDerWaalsContact NE2-SG 3.45Å; P204-C207 WeakPolarHBondContact O-CB 3.37Å; G205-C207 VanDerWaalsContact C-N 3.29Å; C207-I209 PolarHBondContact O-N 2.93Å; C207-N210 HydrophobicContact CB-CB 4.19Å; C207-N210 PolarHBondContact O-N 2.77Å; C207-S211 PolarHBondContact O-N 2.85Å; C207-S211 PolarHBondContact O-OG 3.46Å; C207-C228 VanDerWaalsContact CB-SG 3.59Å
208	I	92.2	Very high	88.2	Confident	51 Å²	51	57.5 Å²	57.5	26%	0.262	34%	0.337	S	S	.	.	H	α-helix	trans	-63	-25.8	179.5	60.9	176.3	0	0	0	113.3	S206 S211 G212 R213 A285	S206-I208 PolarHBondContact O-N 2.92Å; I208-S211 CarbonylContact O-C 3.53Å; I208-S211 WeakPolarHBondContact O-CB 3.2Å; I208-S211 PolarHBondContact O-N 3.38Å; I208-G212 PolarHBondContact O-N 3.4Å; I208-R213 HydrophobicContact CB-CB 4.25Å; I208-R213 PolarHBondContact O-N 2.85Å; I208-A285 HydrophobicContact CD1-CB 4.29Å; I208-A285 WeakPolarHBondContact CD1-O 3.5Å
209	I	93.4	Very high	88	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.005	33%	0.326	C	S	.	.	H	α-helix	trans	-73.9	-48.7	178.9	-61.7	160.7	0	0	0	110.3	C207 S211 G212 L219 F224 C225 A285	C207-I209 PolarHBondContact O-N 2.93Å; I209-S211 PolarHBondContact O-N 2.74Å; I209-G212 PolarHBondContact O-N 2.83Å; I209-L219 HydrophobicContact CD1-CD1 3.8Å; I209-L219 HydrophobicContact CG1-CB 4.48Å; I209-L219 HydrophobicContact CG1-CD1 3.95Å; I209-L219 HydrophobicContact CG2-CB 4.08Å; I209-L219 HydrophobicContact CG2-CD2 4.28Å; I209-F224 WeakPolarHBondContact CG2-O 3.08Å; I209-C225 HydrophobicContact CB-CB 3.91Å; I209-C225 HydrophobicContact CD1-CB 3.89Å; I209-C225 HydrophobicContact CG2-CB 3.81Å; I209-A285 HydrophobicContact CD1-CB 3.68Å; I209-A285 HydrophobicContact CG1-CB 3.74Å
210	N	91	Very high	87.9	Confident	39 Å²	39	53 Å²	53	21%	0.209	32%	0.317	C	S	.	.	H	α-helix	trans	-59.9	-30.4	171.8	-60.7	-13.5	0	0	0	110.8	P204 C207 R223 C228	P204-N210 PolarHBondContact O-ND2 2.72Å; C207-N210 HydrophobicContact CB-CB 4.19Å; C207-N210 PolarHBondContact O-N 2.77Å; N210-R223 PolarHBondContact O-NE 2.93Å; N210-R223 PolarHBondContact O-NH2 3.14Å; N210-C228 PolarHBondContact ND2-SG 3.26Å
211	S	88.5	Confident	87.9	Confident	37 Å²	37	56.7 Å²	56.7	26%	0.259	33%	0.332	S	S	.	.	H	α-helix	trans	-73.2	-19.2	172.5	-52.2	0	0	0	0	114.5	C207 I208 I209 R213 R223	C207-S211 PolarHBondContact O-N 2.85Å; C207-S211 PolarHBondContact O-OG 3.46Å; I208-S211 CarbonylContact O-C 3.53Å; I208-S211 WeakPolarHBondContact O-CB 3.2Å; I208-S211 PolarHBondContact O-N 3.38Å; I209-S211 PolarHBondContact O-N 2.74Å; S211-R213 VanDerWaalsContact CB-NE 3.27Å; S211-R213 PolarHBondContact OG-NE 2.84Å; S211-R213 PolarHBondContact OG-NH2 3.33Å; S211-R213 VanDerWaalsContact OG-NH2 3.09Å; S211-R223 PolarHBondContact O-NH1 3.16Å; S211-R223 PolarHBondContact O-NH2 2.98Å
212	G	90.3	Very high	88	Confident	25 Å²	25	57 Å²	57	26%	0.258	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	72	25.8	-170.5	0	0	0	0	0	114.5	I208 I209 N220	I208-G212 PolarHBondContact O-N 3.4Å; I209-G212 PolarHBondContact O-N 2.83Å; G212-N220 PolarHBondContact O-OD1 2.85Å
213	R	90.3	Very high	88.7	Confident	167 Å²	167	60.2 Å²	60.2	63%	0.63	34%	0.34	S	S	*	.			trans	-110.5	21.9	-177.8	-64.7	-175.3	-70.3	155.1	-1.3	113	I208 S211	I208-R213 HydrophobicContact CB-CB 4.25Å; I208-R213 PolarHBondContact O-N 2.85Å; S211-R213 VanDerWaalsContact CB-NE 3.27Å; S211-R213 PolarHBondContact OG-NE 2.84Å; S211-R213 PolarHBondContact OG-NH2 3.33Å; S211-R213 VanDerWaalsContact OG-NH2 3.09Å
214	S	91	Very high	89.3	Confident	10 Å²	10	55.7 Å²	55.7	7%	0.07	32%	0.315	C	S	.	.			trans	-74.7	152.6	176.5	-178.1	0	0	0	0	111.6	I216 N220 A285	S214-I216 PolarHBondContact O-N 2.93Å; S214-I216 PolarHBondContact OG-N 3.24Å; S214-N220 VanDerWaalsContact CB-OD1 3.28Å; S214-N220 WeakPolarHBondContact CB-OD1 3.33Å; S214-N220 PolarHBondContact N-OD1 2.99Å; S214-N220 PolarHBondContact O-ND2 2.8Å; S214-A285 CarbonylContact C-O 3.57Å; S214-A285 VanDerWaalsContact CA-O 3.28Å; S214-A285 WeakPolarHBondContact CA-O 3.47Å; S214-A285 WeakPolarHBondContact OG-CA 3.17Å; S214-A285 WeakPolarHBondContact OG-CB 3.43Å; S214-A285 PolarHBondContact OG-O 2.81Å
215	S	90.5	Very high	90.2	Very high	53 Å²	53	54.1 Å²	54.1	37%	0.371	31%	0.305	S	S	.	.	S	Bend	trans	-69.2	-14.9	165	57.8	0	0	0	0	113.6	A285 G288	S215-A285 PolarHBondContact N-O 2.78Å; S215-A285 PolarHBondContact OG-O 2.67Å; S215-G288 PolarHBondContact OG-O 2.93Å
216	I	90.8	Very high	91	Very high	30 Å²	30	51 Å²	51	15%	0.154	27%	0.273	C	S	.	.			trans	-101.3	114	-171.6	-59.3	176.5	0	0	0	110.4	S214 S218 L219 N220 D281 L284	S214-I216 PolarHBondContact O-N 2.93Å; S214-I216 PolarHBondContact OG-N 3.24Å; I216-S218 VanDerWaalsContact C-N 3.3Å; I216-S218 VanDerWaalsContact CG2-OG 3.23Å; I216-S218 WeakPolarHBondContact CG2-OG 3.06Å; I216-S218 PolarHBondContact O-N 2.81Å; I216-L219 HydrophobicContact CB-CB 4.45Å; I216-L219 HydrophobicContact CB-CD1 4.13Å; I216-L219 HydrophobicContact CB-CG 4.36Å; I216-L219 HydrophobicContact CD1-CD1 4.19Å; I216-L219 HydrophobicContact CG2-CD1 4.39Å; I216-L219 HydrophobicContact CG2-CG 4.22Å; I216-L219 PolarHBondContact O-N 3.28Å; I216-L219 VanDerWaalsContact O-N 3.11Å; I216-N220 PolarHBondContact O-N 3.42Å; I216-D281 HydrophobicContact CD1-CB 4.32Å; I216-D281 VanDerWaalsContact CD1-O 3.32Å; I216-D281 WeakPolarHBondContact CD1-O 3.34Å; I216-L284 HydrophobicContact CD1-CB 4.15Å
217	P	89.1	Confident	91.5	Very high	104 Å²	104	47.4 Å²	47.4	68%	0.675	25%	0.248	S	C	*	.	H	α-helix	trans	-61.7	-31.6	-175.2	-26.3	35.7	0	0	0	114.9	L219 N220 K221	P217-L219 VanDerWaalsContact C-N 3.26Å; P217-L219 PolarHBondContact O-N 2.97Å; P217-N220 PolarHBondContact O-N 3.26Å; P217-K221 PolarHBondContact O-N 3.25Å
218	S	88.5	Confident	91.6	Very high	55 Å²	55	47.1 Å²	47.1	39%	0.385	25%	0.246	S	C	.	.	H	α-helix	trans	-69.1	-21.6	178.4	64	0	0	0	0	113.3	I216 S222 R278	I216-S218 VanDerWaalsContact C-N 3.3Å; I216-S218 VanDerWaalsContact CG2-OG 3.23Å; I216-S218 WeakPolarHBondContact CG2-OG 3.06Å; I216-S218 PolarHBondContact O-N 2.81Å; S218-S222 PolarHBondContact O-OG 2.8Å; S218-R278 PolarHBondContact O-NH2 3.12Å; S218-R278 PolarHBondContact OG-NH1 2.75Å
219	L	90.2	Very high	91.8	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-87.1	-41.3	173.4	-72.3	177.7	0	0	0	111.3	I209 I216 P217 K221 S222 R223 D281 A285	I209-L219 HydrophobicContact CD1-CD1 3.8Å; I209-L219 HydrophobicContact CG1-CB 4.48Å; I209-L219 HydrophobicContact CG1-CD1 3.95Å; I209-L219 HydrophobicContact CG2-CB 4.08Å; I209-L219 HydrophobicContact CG2-CD2 4.28Å; I216-L219 HydrophobicContact CB-CB 4.45Å; I216-L219 HydrophobicContact CB-CD1 4.13Å; I216-L219 HydrophobicContact CB-CG 4.36Å; I216-L219 HydrophobicContact CD1-CD1 4.19Å; I216-L219 HydrophobicContact CG2-CD1 4.39Å; I216-L219 HydrophobicContact CG2-CG 4.22Å; I216-L219 PolarHBondContact O-N 3.28Å; I216-L219 VanDerWaalsContact O-N 3.11Å; P217-L219 VanDerWaalsContact C-N 3.26Å; P217-L219 PolarHBondContact O-N 2.97Å; L219-K221 VanDerWaalsContact C-N 3.29Å; L219-K221 PolarHBondContact O-N 2.89Å; L219-S222 PolarHBondContact O-N 3.44Å; L219-S222 PolarHBondContact O-OG 3.42Å; L219-R223 WeakPolarHBondContact O-CA 3.46Å; L219-R223 PolarHBondContact O-N 3.26Å; L219-D281 HydrophobicContact CD1-CB 4Å; L219-D281 HydrophobicContact CD2-CB 4.32Å; L219-D281 HydrophobicContact CG-CB 4.24Å; L219-A285 HydrophobicContact CD1-CB 3.72Å
220	N	87.3	Confident	92	Very high	53 Å²	53	44.7 Å²	44.7	28%	0.283	23%	0.233	S	C	.	.	H	α-helix	trans	-63.5	-34.2	176.2	-70.9	-21.5	0	0	0	112.5	G212 S214 I216 P217 R223	G212-N220 PolarHBondContact O-OD1 2.85Å; S214-N220 VanDerWaalsContact CB-OD1 3.28Å; S214-N220 WeakPolarHBondContact CB-OD1 3.33Å; S214-N220 PolarHBondContact N-OD1 2.99Å; S214-N220 PolarHBondContact O-ND2 2.8Å; I216-N220 PolarHBondContact O-N 3.42Å; P217-N220 PolarHBondContact O-N 3.26Å; N220-R223 WeakPolarHBondContact O-CG 3.32Å
221	K	89.1	Confident	92.2	Very high	195 Å²	195	42.9 Å²	42.9	85%	0.848	22%	0.224	S	C	*	.	H	α-helix	trans	-67.7	-36	176.9	-176.3	175.2	177.8	-179.1	0	113.1	P217 L219	P217-K221 PolarHBondContact O-N 3.25Å; L219-K221 VanDerWaalsContact C-N 3.29Å; L219-K221 PolarHBondContact O-N 2.89Å
222	S	90.7	Very high	92.5	Very high	34 Å²	34	46.2 Å²	46.2	24%	0.238	23%	0.231	C	C	.	.	H	α-helix	trans	-90.2	-26.6	179.1	59.2	0	0	0	0	113.5	S218 L219 F224 R278	S218-S222 PolarHBondContact O-OG 2.8Å; L219-S222 PolarHBondContact O-N 3.44Å; L219-S222 PolarHBondContact O-OG 3.42Å; S222-F224 PolarHBondContact O-N 2.89Å; S222-F224 PolarHBondContact OG-N 3.29Å; S222-R278 PolarHBondContact OG-NH2 2.85Å
223	R	92.4	Very high	92.7	Very high	132 Å²	132	45.2 Å²	45.2	50%	0.498	22%	0.22	S	C	.	.			trans	51	23	-167	-54.8	-175.1	71	107.2	-4.9	113.5	N210 S211 L219 N220	N210-R223 PolarHBondContact O-NE 2.93Å; N210-R223 PolarHBondContact O-NH2 3.14Å; S211-R223 PolarHBondContact O-NH1 3.16Å; S211-R223 PolarHBondContact O-NH2 2.98Å; L219-R223 WeakPolarHBondContact O-CA 3.46Å; L219-R223 PolarHBondContact O-N 3.26Å; N220-R223 WeakPolarHBondContact O-CG 3.32Å
224	F	94	Very high	92.9	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.009	19%	0.19	C	C	.	.			trans	-105.1	121	-176.2	166.5	-98.9	0	0	0	109.5	I209 S222 V226 Y248 F249 N252 A255 I256	I209-F224 WeakPolarHBondContact CG2-O 3.08Å; S222-F224 PolarHBondContact O-N 2.89Å; S222-F224 PolarHBondContact OG-N 3.29Å; F224-V226 HydrophobicContact CD1-CG2 4.46Å; F224-V226 HydrophobicContact CE1-CG2 3.54Å; F224-V226 HydrophobicContact CZ-CG2 3.99Å; F224-Y248 HydrophobicContact CD2-CD1 4.17Å; F224-Y248 AromaticContact CD2-CE1 3.53Å; F224-Y248 HydrophobicContact CD2-CE1 3.53Å; F224-Y248 HydrophobicContact CD2-CE2 4.15Å; F224-Y248 AromaticContact CD2-CZ 3.52Å; F224-Y248 AromaticContact CE2-CD1 3.69Å; F224-Y248 HydrophobicContact CE2-CD1 3.69Å; F224-Y248 AromaticContact CE2-CE1 3.34Å; F224-Y248 HydrophobicContact CE2-CE1 3.34Å; F224-Y248 HydrophobicContact CE2-CG 4.47Å; F224-Y248 AromaticContact CE2-CZ 3.88Å; F224-Y248 HydrophobicContact CZ-CE1 4.4Å; F224-F249 HydrophobicContact CZ-CD1 4.37Å; F224-N252 HydrophobicContact CB-CB 4.39Å; F224-N252 HydrophobicContact CD1-CB 4.24Å; F224-N252 HydrophobicContact CD2-CB 3.31Å; F224-N252 HydrophobicContact CE1-CB 4.39Å; F224-N252 HydrophobicContact CE2-CB 3.5Å; F224-N252 VanDerWaalsContact CE2-CB 3.5Å; F224-N252 HydrophobicContact CG-CB 3.72Å; F224-N252 HydrophobicContact CZ-CB 4.06Å; F224-A255 HydrophobicContact CB-CB 4.4Å; F224-A255 HydrophobicContact CD1-CB 4.07Å; F224-A255 HydrophobicContact CG-CB 4.41Å; F224-I256 HydrophobicContact CE1-CD1 4.18Å; F224-I256 HydrophobicContact CE1-CG1 3.45Å; F224-I256 VanDerWaalsContact CE1-CG1 3.45Å; F224-I256 HydrophobicContact CZ-CD1 3.8Å; F224-I256 HydrophobicContact CZ-CG1 3.6Å
225	C	96.1	Very high	93.1	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.208	C	C	.	.			trans	-111.6	118	175.8	177.6	0	0	0	0	109.7	H201 I209 L227 C228 G229 Y248	H201-C225 PolarHBondContact NE2-SG 2.99Å; I209-C225 HydrophobicContact CB-CB 3.91Å; I209-C225 HydrophobicContact CD1-CB 3.89Å; I209-C225 HydrophobicContact CG2-CB 3.81Å; C225-L227 VanDerWaalsContact C-N 3.28Å; C225-L227 PolarHBondContact O-N 3.11Å; C225-C228 HydrophobicContact CB-CB 3.89Å; C225-C228 PolarHBondContact O-N 2.86Å; C225-C228 PolarHBondContact SG-N 3.48Å; C225-G229 PolarHBondContact O-N 3.33Å; C225-G229 VanDerWaalsContact O-N 3.15Å; C225-Y248 PolarHBondContact N-OH 3.37Å; C225-Y248 VanDerWaalsContact N-OH 3.09Å; C225-Y248 WeakPolarHBondContact O-CE1 3.22Å; C225-Y248 PolarHBondContact O-OH 2.9Å
226	V	96.3	Very high	93.2	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.006	20%	0.199	C	C	.	.	H	α-helix	trans	-59.4	-42.2	178.8	-179.6	0	0	0	0	111.1	F224 C228 G229 L230 F249 L275 R278 M279	F224-V226 HydrophobicContact CD1-CG2 4.46Å; F224-V226 HydrophobicContact CE1-CG2 3.54Å; F224-V226 HydrophobicContact CZ-CG2 3.99Å; V226-C228 VanDerWaalsContact C-N 3.33Å; V226-C228 PolarHBondContact O-N 3.04Å; V226-G229 WeakPolarHBondContact O-CA 3.46Å; V226-G229 PolarHBondContact O-N 2.93Å; V226-L230 HydrophobicContact CG1-CD1 4.16Å; V226-L230 HydrophobicContact CG1-CG 4.36Å; V226-L230 PolarHBondContact O-N 3.37Å; V226-F249 HydrophobicContact CG1-CE1 4.21Å; V226-L275 HydrophobicContact CG1-CD1 3.52Å; V226-L275 HydrophobicContact CG1-CG 4.22Å; V226-L275 HydrophobicContact CG2-CD1 4.38Å; V226-R278 HydrophobicContact CG2-CB 3.69Å; V226-M279 HydrophobicContact CB-CG 3.82Å; V226-M279 HydrophobicContact CG1-CG 3.35Å; V226-M279 HydrophobicContact CG1-SD 4.06Å
227	L	96.8	Very high	93.4	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-65.4	-34.8	-177.8	-56.4	172.8	0	0	0	112.2	Y196 I197 H201 C225 L230 S231 M279	Y196-L227 HydrophobicContact CE1-CD1 3.87Å; Y196-L227 HydrophobicContact CE1-CD2 4.23Å; I197-L227 HydrophobicContact CD1-CD2 4.36Å; I197-L227 HydrophobicContact CG1-CD2 4.03Å; H201-L227 HydrophobicContact CB-CB 4.21Å; H201-L227 VanDerWaalsContact CD2-CB 3.46Å; H201-L227 WeakPolarHBondContact CD2-CB 3.37Å; C225-L227 VanDerWaalsContact C-N 3.28Å; C225-L227 PolarHBondContact O-N 3.11Å; L227-L230 PolarHBondContact O-N 3.06Å; L227-S231 VanDerWaalsContact O-CB 3.29Å; L227-S231 WeakPolarHBondContact O-CB 3.44Å; L227-S231 PolarHBondContact O-N 3.22Å; L227-M279 HydrophobicContact CD2-CB 4.3Å; L227-M279 HydrophobicContact CD2-CG 4.03Å; L227-M279 HydrophobicContact CD2-SD 4.22Å
228	C	95.9	Very high	93.5	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-66.8	-36.9	170.3	-74.7	0	0	0	0	112.5	H201 P204 C207 N210 C225 V226 R232	H201-C228 PolarHBondContact NE2-SG 3.38Å; P204-C228 HydrophobicContact CB-CB 4.24Å; C207-C228 VanDerWaalsContact CB-SG 3.59Å; N210-C228 PolarHBondContact ND2-SG 3.26Å; C225-C228 HydrophobicContact CB-CB 3.89Å; C225-C228 PolarHBondContact O-N 2.86Å; C225-C228 PolarHBondContact SG-N 3.48Å; V226-C228 VanDerWaalsContact C-N 3.33Å; V226-C228 PolarHBondContact O-N 3.04Å; C228-R232 WeakPolarHBondContact O-CG 3.48Å; C228-R232 PolarHBondContact O-N 3.02Å; C228-R232 VanDerWaalsContact O-N 3.09Å
229	G	96	Very high	93.5	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.01	20%	0.198	C	C	.	.	H	α-helix	trans	-63.5	-45.9	174.3	0	0	0	0	0	112.1	C225 V226 R232 L233 Y248 F249	C225-G229 PolarHBondContact O-N 3.33Å; C225-G229 VanDerWaalsContact O-N 3.15Å; V226-G229 WeakPolarHBondContact O-CA 3.46Å; V226-G229 PolarHBondContact O-N 2.93Å; G229-R232 PolarHBondContact O-N 2.9Å; G229-L233 PolarHBondContact O-N 2.74Å; G229-L233 VanDerWaalsContact O-N 3.11Å; G229-Y248 VanDerWaalsContact CA-CE1 3.45Å; G229-F249 VanDerWaalsContact C-CZ 3.42Å
230	L	96.9	Very high	93.1	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-67.3	-42.6	177.8	-67.2	176.1	0	0	0	111.2	L184 I187 L188 L193 I197 V226 L227 R232 L233 I234 F249 M279	L184-L230 HydrophobicContact CD2-CD2 4.06Å; I187-L230 HydrophobicContact CG2-CD1 3.84Å; I187-L230 HydrophobicContact CG2-CD2 3.78Å; L188-L230 HydrophobicContact CD2-CD2 4.47Å; L193-L230 HydrophobicContact CD2-CD1 4.27Å; I197-L230 HydrophobicContact CD1-CB 3.69Å; I197-L230 HydrophobicContact CD1-CD1 3.84Å; I197-L230 HydrophobicContact CD1-CG 4.44Å; V226-L230 HydrophobicContact CG1-CD1 4.16Å; V226-L230 HydrophobicContact CG1-CG 4.36Å; V226-L230 PolarHBondContact O-N 3.37Å; L227-L230 PolarHBondContact O-N 3.06Å; L230-R232 VanDerWaalsContact C-N 3.28Å; L230-R232 PolarHBondContact O-N 3.28Å; L230-L233 PolarHBondContact O-N 3.01Å; L230-L233 VanDerWaalsContact O-N 3.11Å; L230-I234 VanDerWaalsContact O-CG1 3.28Å; L230-I234 WeakPolarHBondContact O-CG1 3.44Å; L230-I234 PolarHBondContact O-N 3.24Å; L230-F249 HydrophobicContact CD2-CE1 4.3Å; L230-F249 HydrophobicContact CD2-CZ 3.8Å; L230-F249 HydrophobicContact CG-CE1 4.47Å; L230-F249 HydrophobicContact CG-CZ 3.99Å; L230-M279 HydrophobicContact CD1-SD 3.5Å; L230-M279 VanDerWaalsContact CD1-SD 3.5Å
231	S	95.6	Very high	92.9	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.014	23%	0.234	C	C	.	.	H	α-helix	trans	-54.8	-41.5	173.1	175.1	0	0	0	0	112.6	L227 N235	L227-S231 VanDerWaalsContact O-CB 3.29Å; L227-S231 WeakPolarHBondContact O-CB 3.44Å; L227-S231 PolarHBondContact O-N 3.22Å; S231-N235 VanDerWaalsContact O-CG 3.25Å; S231-N235 PolarHBondContact O-N 2.94Å; S231-N235 VanDerWaalsContact O-N 3.08Å; S231-N235 PolarHBondContact O-ND2 3.22Å
232	R	94.5	Very high	93	Very high	107 Å²	107	41.9 Å²	41.9	40%	0.404	22%	0.221	S	C	.	.	H	α-helix	trans	-62.6	-48.7	173.5	-73.2	169.3	178.5	176.4	-2.3	112	C228 G229 L230 I234 N235 E236 Y248	C228-R232 WeakPolarHBondContact O-CG 3.48Å; C228-R232 PolarHBondContact O-N 3.02Å; C228-R232 VanDerWaalsContact O-N 3.09Å; G229-R232 PolarHBondContact O-N 2.9Å; L230-R232 VanDerWaalsContact C-N 3.28Å; L230-R232 PolarHBondContact O-N 3.28Å; R232-I234 VanDerWaalsContact C-N 3.34Å; R232-I234 PolarHBondContact O-N 2.53Å; R232-N235 PolarHBondContact O-N 3.26Å; R232-N235 VanDerWaalsContact O-N 3.14Å; R232-E236 WeakPolarHBondContact O-CG 3.37Å; R232-E236 PolarHBondContact O-N 3.31Å; R232-Y248 VanDerWaalsContact NH1-CD2 3.26Å
233	L	95.6	Very high	93.1	Very high	4 Å²	4	48.6 Å²	48.6	2%	0.021	24%	0.241	C	C	.	.	H	α-helix	trans	-63	-37	179	-67.8	178.6	0	0	0	113	F171 L184 L188 G229 L230 E236 H237 T244 P246 F249	F171-L233 HydrophobicContact CE1-CD2 4.04Å; F171-L233 HydrophobicContact CZ-CD1 4.08Å; F171-L233 HydrophobicContact CZ-CD2 4.36Å; L184-L233 HydrophobicContact CD1-CD1 4.17Å; L188-L233 HydrophobicContact CD1-CB 3.92Å; L188-L233 HydrophobicContact CD1-CD1 4.16Å; L188-L233 HydrophobicContact CD2-CB 4.26Å; G229-L233 PolarHBondContact O-N 2.74Å; G229-L233 VanDerWaalsContact O-N 3.11Å; L230-L233 PolarHBondContact O-N 3.01Å; L230-L233 VanDerWaalsContact O-N 3.11Å; L233-E236 PolarHBondContact O-N 2.72Å; L233-H237 WeakPolarHBondContact O-CB 3.44Å; L233-H237 PolarHBondContact O-N 2.99Å; L233-H237 PolarHBondContact O-ND1 2.82Å; L233-T244 HydrophobicContact CD2-CG2 4.32Å; L233-P246 HydrophobicContact CD1-CB 4.31Å; L233-P246 HydrophobicContact CD2-CB 4.29Å; L233-F249 HydrophobicContact CD1-CD2 4.01Å; L233-F249 HydrophobicContact CD1-CE2 3.43Å; L233-F249 VanDerWaalsContact CD1-CE2 3.43Å; L233-F249 HydrophobicContact CD1-CZ 4.13Å; L233-F249 HydrophobicContact CG-CE2 4.03Å
234	I	94.7	Very high	93.3	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-60.1	-48.4	172.3	-64.9	163.2	0	0	0	110	L188 L194 I197 L230 R232 E236 H237 H238	L188-I234 HydrophobicContact CD2-CG1 3.78Å; L194-I234 HydrophobicContact CB-CD1 4.38Å; L194-I234 HydrophobicContact CD2-CD1 3.69Å; L194-I234 HydrophobicContact CD2-CG1 4.04Å; I197-I234 HydrophobicContact CB-CD1 4.3Å; I197-I234 HydrophobicContact CD1-CD1 4.36Å; I197-I234 HydrophobicContact CG2-CD1 3.89Å; L230-I234 VanDerWaalsContact O-CG1 3.28Å; L230-I234 WeakPolarHBondContact O-CG1 3.44Å; L230-I234 PolarHBondContact O-N 3.24Å; R232-I234 VanDerWaalsContact C-N 3.34Å; R232-I234 PolarHBondContact O-N 2.53Å; I234-E236 PolarHBondContact O-N 2.85Å; I234-H237 WeakPolarHBondContact O-CB 3.46Å; I234-H237 PolarHBondContact O-N 3.48Å; I234-H238 PolarHBondContact O-N 3.08Å; I234-H238 VanDerWaalsContact O-N 3.1Å
235	N	93.3	Very high	93.4	Very high	83 Å²	83	47.3 Å²	47.3	44%	0.444	24%	0.244	S	C	.	.	H	α-helix	trans	-66.4	-37.7	-179.9	-69.3	-20.3	0	0	0	112.5	S231 R232 H238 S239	S231-N235 VanDerWaalsContact O-CG 3.25Å; S231-N235 PolarHBondContact O-N 2.94Å; S231-N235 VanDerWaalsContact O-N 3.08Å; S231-N235 PolarHBondContact O-ND2 3.22Å; R232-N235 PolarHBondContact O-N 3.26Å; R232-N235 VanDerWaalsContact O-N 3.14Å; N235-H238 PolarHBondContact O-N 2.84Å; N235-S239 WeakPolarHBondContact O-CB 3.43Å; N235-S239 PolarHBondContact O-N 3.15Å; N235-S239 VanDerWaalsContact O-N 3.1Å; N235-S239 PolarHBondContact O-OG 3.02Å
236	E	94.4	Very high	93.4	Very high	42 Å²	42	47.5 Å²	47.5	20%	0.196	25%	0.245	C	C	.	.	H	α-helix	trans	-60.2	-47.1	171.4	-72.5	167.8	-137.7	0	0	110.8	L169 R232 L233 I234 H238 S239 Q240 T244	L169-E236 HydrophobicContact CD1-CB 3.98Å; R232-E236 WeakPolarHBondContact O-CG 3.37Å; R232-E236 PolarHBondContact O-N 3.31Å; L233-E236 PolarHBondContact O-N 2.72Å; I234-E236 PolarHBondContact O-N 2.85Å; E236-H238 PolarHBondContact O-N 3.3Å; E236-S239 PolarHBondContact O-N 3.22Å; E236-S239 VanDerWaalsContact O-N 3.1Å; E236-S239 PolarHBondContact O-OG 3.23Å; E236-Q240 PolarHBondContact O-N 3.49Å; E236-T244 WeakPolarHBondContact OE2-CB 3.14Å; E236-T244 WeakPolarHBondContact OE2-CG2 3.43Å; E236-T244 PolarHBondContact OE2-OG1 3.09Å
237	H	94	Very high	93.4	Very high	8 Å²	8	50.7 Å²	50.7	4%	0.037	27%	0.268	C	S	.	.	H	α-helix	trans	-61.8	-23.4	176.9	-82.7	69.2	0	0	0	114.4	P165 R167 L169 F171 L233 I234	P165-H237 HydrophobicContact CB-CB 3.7Å; P165-H237 HydrophobicContact CG-CB 3.78Å; R167-H237 PolarHBondContact O-CD2 2.81Å; L169-H237 PolarHBondContact N-CD2 2.8Å; L169-H237 PolarHBondContact N-NE2 3.25Å; L169-H237 VanDerWaalsContact N-NE2 3.13Å; F171-H237 AromaticContact CE1-CE1 3.82Å; F171-H237 AromaticContact CZ-CE1 3.87Å; L233-H237 WeakPolarHBondContact O-CB 3.44Å; L233-H237 PolarHBondContact O-N 2.99Å; L233-H237 PolarHBondContact O-ND1 2.82Å; I234-H237 WeakPolarHBondContact O-CB 3.46Å; I234-H237 PolarHBondContact O-N 3.48Å
238	H	90.7	Very high	93.3	Very high	109 Å²	109	52.8 Å²	52.8	51%	0.505	28%	0.276	S	S	.	.	H	α-helix	trans	-91.9	-17.3	175.7	-65.9	161.8	0	0	0	113.9	I234 N235 E236	I234-H238 PolarHBondContact O-N 3.08Å; I234-H238 VanDerWaalsContact O-N 3.1Å; N235-H238 PolarHBondContact O-N 2.84Å; E236-H238 PolarHBondContact O-N 3.3Å
239	S	89.4	Confident	93.4	Very high	91 Å²	91	52.9 Å²	52.9	64%	0.636	28%	0.276	S	S	*	.	H	α-helix	trans	-114.5	-16.2	-172	56.6	0	0	0	0	115	N235 E236	N235-S239 WeakPolarHBondContact O-CB 3.43Å; N235-S239 PolarHBondContact O-N 3.15Å; N235-S239 VanDerWaalsContact O-N 3.1Å; N235-S239 PolarHBondContact O-OG 3.02Å; E236-S239 PolarHBondContact O-N 3.22Å; E236-S239 VanDerWaalsContact O-N 3.1Å; E236-S239 PolarHBondContact O-OG 3.23Å
240	Q	82.3	Confident	93.4	Very high	89 Å²	89	53.3 Å²	53.3	42%	0.416	28%	0.279	S	S	.	.			trans	-124.2	164.8	-174.5	-56.7	-178.8	23.4	0	0	111.9	L169 E236	L169-Q240 HydrophobicContact CD1-CB 4.31Å; L169-Q240 HydrophobicContact CD2-CB 4.36Å; E236-Q240 PolarHBondContact O-N 3.49Å
241	N	81.7	Confident	93.3	Very high	120 Å²	120	58 Å²	58	64%	0.642	31%	0.308	S	S	*	.			trans	-122.1	156.3	169.1	-65	-51.6	0	0	0	109.4	R167	R167-N241 PolarHBondContact NH1-OD1 3.07Å
242	G	90.8	Very high	93.3	Very high	55 Å²	55	59.7 Å²	59.7	57%	0.567	32%	0.317	S	S	*	.	S	Bend	trans	91.5	-112.5	175.6	0	0	0	0	0	113.2	L169 G170	L169-G242 WeakPolarHBondContact CA-O 3.14Å; G170-G242 PolarHBondContact N-O 2.85Å
243	R	94.3	Very high	93.3	Very high	174 Å²	174	54.7 Å²	54.7	66%	0.657	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.4	146.2	-172.2	65.8	-179.5	179.3	-178.6	-3.3	113.2	G170	G170-R243 CarbonylContact O-C 3.5Å; G170-R243 WeakPolarHBondContact O-CA 3.42Å; G170-R243 WeakPolarHBondContact O-CB 3.39Å
244	T	96.4	Very high	93.3	Very high	19 Å²	19	62.4 Å²	62.4	12%	0.117	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	175.3	169.8	-175.2	0	0	0	0	109.9	L169 G170 F171 G172 L233 E236	L169-T244 HydrophobicContact CB-CG2 4.18Å; L169-T244 HydrophobicContact CD1-CG2 3.9Å; G170-T244 PolarHBondContact O-N 2.97Å; F171-T244 CarbonylContact C-O 3.52Å; F171-T244 WeakPolarHBondContact CA-O 3.42Å; F171-T244 HydrophobicContact CD1-CG2 3.62Å; F171-T244 HydrophobicContact CE1-CG2 3.6Å; G172-T244 PolarHBondContact N-O 3.21Å; L233-T244 HydrophobicContact CD2-CG2 4.32Å; E236-T244 WeakPolarHBondContact OE2-CB 3.14Å; E236-T244 WeakPolarHBondContact OE2-CG2 3.43Å; E236-T244 PolarHBondContact OE2-OG1 3.09Å
245	I	95.9	Very high	93.3	Very high	89 Å²	89	63.3 Å²	63.3	46%	0.456	33%	0.334	S	S	.	.			trans	-119.8	122.5	168.8	-66.8	169.5	0	0	0	107.1	S174 S247	S174-I245 VanDerWaalsContact OG-CG2 3.28Å; S174-I245 WeakPolarHBondContact OG-CG2 3.3Å; I245-S247 PolarHBondContact O-N 2.89Å
246	P	96.4	Very high	93.5	Very high	3 Å²	3	59.6 Å²	59.6	2%	0.019	31%	0.314	C	S	.	.			trans	-74.4	49.4	178.7	31.8	-35.2	0	0	0	112.1	F171 L180 N181 L184 L233 Y248 F249 V250	F171-P246 HydrophobicContact CB-CG 4.3Å; F171-P246 HydrophobicContact CD1-CG 4.36Å; F171-P246 HydrophobicContact CD2-CG 4.46Å; F171-P246 HydrophobicContact CG-CG 4.15Å; L180-P246 HydrophobicContact CD2-CB 4.44Å; L180-P246 HydrophobicContact CD2-CG 3.82Å; N181-P246 VanDerWaalsContact OD1-CG 3.26Å; N181-P246 WeakPolarHBondContact OD1-CG 3.37Å; L184-P246 HydrophobicContact CD1-CB 3.81Å; L184-P246 HydrophobicContact CD1-CG 4.22Å; L233-P246 HydrophobicContact CD1-CB 4.31Å; L233-P246 HydrophobicContact CD2-CB 4.29Å; P246-Y248 PolarHBondContact O-N 2.8Å; P246-Y248 VanDerWaalsContact O-N 3.15Å; P246-F249 HydrophobicContact CB-CD2 4.19Å; P246-F249 WeakPolarHBondContact O-CA 3.36Å; P246-F249 WeakPolarHBondContact O-CB 3.32Å; P246-F249 PolarHBondContact O-N 2.92Å; P246-V250 PolarHBondContact O-N 3.1Å; P246-V250 VanDerWaalsContact O-N 3.07Å
247	S	95.7	Very high	93.5	Very high	69 Å²	69	58.1 Å²	58.1	48%	0.483	31%	0.308	S	S	.	.	H	α-helix	trans	-53.6	-36	-173.5	56.7	0	0	0	0	113.2	I245 F249 V250 T251	I245-S247 PolarHBondContact O-N 2.89Å; S247-F249 PolarHBondContact O-N 2.88Å; S247-V250 PolarHBondContact O-N 2.81Å; S247-T251 WeakPolarHBondContact O-CB 3.36Å; S247-T251 WeakPolarHBondContact O-CG2 3.15Å; S247-T251 PolarHBondContact O-N 2.77Å; S247-T251 PolarHBondContact O-OG1 2.82Å
248	Y	95.7	Very high	93.5	Very high	44 Å²	44	62 Å²	62	17%	0.173	33%	0.334	C	S	.	.	H	α-helix	trans	-60.1	-32	174.5	-175.5	-105.4	0	0	0	112.8	F224 C225 G229 R232 P246 N252	F224-Y248 HydrophobicContact CD2-CD1 4.17Å; F224-Y248 AromaticContact CD2-CE1 3.53Å; F224-Y248 HydrophobicContact CD2-CE1 3.53Å; F224-Y248 HydrophobicContact CD2-CE2 4.15Å; F224-Y248 AromaticContact CD2-CZ 3.52Å; F224-Y248 AromaticContact CE2-CD1 3.69Å; F224-Y248 HydrophobicContact CE2-CD1 3.69Å; F224-Y248 AromaticContact CE2-CE1 3.34Å; F224-Y248 HydrophobicContact CE2-CE1 3.34Å; F224-Y248 HydrophobicContact CE2-CG 4.47Å; F224-Y248 AromaticContact CE2-CZ 3.88Å; F224-Y248 HydrophobicContact CZ-CE1 4.4Å; C225-Y248 PolarHBondContact N-OH 3.37Å; C225-Y248 VanDerWaalsContact N-OH 3.09Å; C225-Y248 WeakPolarHBondContact O-CE1 3.22Å; C225-Y248 PolarHBondContact O-OH 2.9Å; G229-Y248 VanDerWaalsContact CA-CE1 3.45Å; R232-Y248 VanDerWaalsContact NH1-CD2 3.26Å; P246-Y248 PolarHBondContact O-N 2.8Å; P246-Y248 VanDerWaalsContact O-N 3.15Å; Y248-N252 WeakPolarHBondContact O-CB 3.31Å; Y248-N252 PolarHBondContact O-ND2 3.29Å
249	F	97.2	Very high	93.6	Very high	1 Å²	1	60 Å²	60	0%	0.004	33%	0.333	C	S	.	.	H	α-helix	trans	-84.3	-44.9	174.1	-65.2	-97.7	0	0	0	111.6	L180 L184 F224 V226 G229 L230 L233 P246 S247 T251 N252 V253 I256 L275	L180-F249 HydrophobicContact CD1-CB 4.08Å; L180-F249 HydrophobicContact CD2-CB 4.44Å; L184-F249 HydrophobicContact CD1-CB 4.11Å; L184-F249 HydrophobicContact CD1-CD1 4.18Å; L184-F249 HydrophobicContact CD1-CD2 3.96Å; L184-F249 HydrophobicContact CD1-CE2 4.43Å; L184-F249 HydrophobicContact CD1-CG 3.83Å; L184-F249 HydrophobicContact CD2-CD1 3.87Å; L184-F249 HydrophobicContact CD2-CE1 3.71Å; L184-F249 HydrophobicContact CD2-CG 4.33Å; L184-F249 HydrophobicContact CD2-CZ 4.05Å; F224-F249 HydrophobicContact CZ-CD1 4.37Å; V226-F249 HydrophobicContact CG1-CE1 4.21Å; G229-F249 VanDerWaalsContact C-CZ 3.42Å; L230-F249 HydrophobicContact CD2-CE1 4.3Å; L230-F249 HydrophobicContact CD2-CZ 3.8Å; L230-F249 HydrophobicContact CG-CE1 4.47Å; L230-F249 HydrophobicContact CG-CZ 3.99Å; L233-F249 HydrophobicContact CD1-CD2 4.01Å; L233-F249 HydrophobicContact CD1-CE2 3.43Å; L233-F249 VanDerWaalsContact CD1-CE2 3.43Å; L233-F249 HydrophobicContact CD1-CZ 4.13Å; L233-F249 HydrophobicContact CG-CE2 4.03Å; P246-F249 HydrophobicContact CB-CD2 4.19Å; P246-F249 WeakPolarHBondContact O-CA 3.36Å; P246-F249 WeakPolarHBondContact O-CB 3.32Å; P246-F249 PolarHBondContact O-N 2.92Å; S247-F249 PolarHBondContact O-N 2.88Å; F249-T251 PolarHBondContact O-N 3.03Å; F249-N252 CarbonylContact O-C 3.51Å; F249-N252 VanDerWaalsContact O-C 3.32Å; F249-N252 PolarHBondContact O-N 3.03Å; F249-V253 PolarHBondContact O-N 2.74Å; F249-I256 HydrophobicContact CB-CD1 4.32Å; F249-I256 HydrophobicContact CD1-CD1 3.86Å; F249-L275 HydrophobicContact CD1-CD1 4.21Å; F249-L275 HydrophobicContact CE1-CD1 4Å
250	V	95.7	Very high	93.8	Very high	10 Å²	10	55.7 Å²	55.7	6%	0.061	30%	0.302	C	S	.	.	H	α-helix	trans	-57.3	-47.4	-179.9	178	0	0	0	0	111.4	T177 L180 P246 S247 N252	T177-V250 HydrophobicContact CG2-CG1 4.07Å; T177-V250 HydrophobicContact CG2-CG2 4.02Å; L180-V250 HydrophobicContact CD1-CG2 4.3Å; L180-V250 HydrophobicContact CD2-CG2 4.15Å; P246-V250 PolarHBondContact O-N 3.1Å; P246-V250 VanDerWaalsContact O-N 3.07Å; S247-V250 PolarHBondContact O-N 2.81Å; V250-N252 PolarHBondContact O-N 3.49Å
251	T	94.7	Very high	94.3	Very high	99 Å²	99	57.3 Å²	57.3	61%	0.607	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-21.6	177.3	52.8	0	0	0	0	113.7	S247 F249	S247-T251 WeakPolarHBondContact O-CB 3.36Å; S247-T251 WeakPolarHBondContact O-CG2 3.15Å; S247-T251 PolarHBondContact O-N 2.77Å; S247-T251 PolarHBondContact O-OG1 2.82Å; F249-T251 PolarHBondContact O-N 3.03Å
252	N	95.7	Very high	94.7	Very high	38 Å²	38	53.9 Å²	53.9	20%	0.203	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.5	16.3	-176.6	-70.9	-79.4	0	0	0	113.6	F224 Y248 F249 V250 R254 A255 I256	F224-N252 HydrophobicContact CB-CB 4.39Å; F224-N252 HydrophobicContact CD1-CB 4.24Å; F224-N252 HydrophobicContact CD2-CB 3.31Å; F224-N252 HydrophobicContact CE1-CB 4.39Å; F224-N252 HydrophobicContact CE2-CB 3.5Å; F224-N252 VanDerWaalsContact CE2-CB 3.5Å; F224-N252 HydrophobicContact CG-CB 3.72Å; F224-N252 HydrophobicContact CZ-CB 4.06Å; Y248-N252 WeakPolarHBondContact O-CB 3.31Å; Y248-N252 PolarHBondContact O-ND2 3.29Å; F249-N252 CarbonylContact O-C 3.51Å; F249-N252 VanDerWaalsContact O-C 3.32Å; F249-N252 PolarHBondContact O-N 3.03Å; V250-N252 PolarHBondContact O-N 3.49Å; N252-R254 PolarHBondContact O-N 3.41Å; N252-R254 VanDerWaalsContact O-N 3.15Å; N252-A255 HydrophobicContact CB-CB 4.31Å; N252-A255 CarbonylContact O-C 3.52Å; N252-A255 WeakPolarHBondContact O-CA 3.4Å; N252-A255 WeakPolarHBondContact O-CB 3.18Å; N252-A255 PolarHBondContact O-N 2.8Å; N252-I256 PolarHBondContact O-N 3.15Å; N252-I256 VanDerWaalsContact O-N 3.09Å
253	V	95.9	Very high	94.8	Very high	2 Å²	2	57.7 Å²	57.7	1%	0.012	29%	0.287	C	S	.	.	H	α-helix	trans	-55.9	-37.8	-176.7	66.8	0	0	0	0	112.7	F249 A255 I256 C257 L260 P262 F271	F249-V253 PolarHBondContact O-N 2.74Å; V253-A255 VanDerWaalsContact C-N 3.26Å; V253-A255 PolarHBondContact O-N 2.79Å; V253-I256 WeakPolarHBondContact O-CA 3.39Å; V253-I256 WeakPolarHBondContact O-CB 3.46Å; V253-I256 PolarHBondContact O-N 3.37Å; V253-C257 PolarHBondContact O-N 2.7Å; V253-L260 HydrophobicContact CG2-CB 4.03Å; V253-L260 HydrophobicContact CG2-CD1 4.19Å; V253-P262 HydrophobicContact CG1-CB 4.31Å; V253-P262 HydrophobicContact CG1-CG 3.76Å; V253-F271 HydrophobicContact CG2-CD2 4.23Å; V253-F271 HydrophobicContact CG2-CE2 4.32Å
254	R	95.3	Very high	94.7	Very high	165 Å²	165	53.5 Å²	53.5	62%	0.623	28%	0.275	S	S	*	.	H	α-helix	trans	-69.5	-19.1	174.3	-63.5	-174.2	72.3	-162.4	2.6	114.5	N252 P258 L260 P262	N252-R254 PolarHBondContact O-N 3.41Å; N252-R254 VanDerWaalsContact O-N 3.15Å; R254-P258 WeakPolarHBondContact O-CA 3.41Å; R254-L260 VanDerWaalsContact CG-O 3.31Å; R254-L260 WeakPolarHBondContact CG-O 3.48Å; R254-P262 HydrophobicContact CG-CG 4.44Å
255	A	95	Very high	94.6	Very high	19 Å²	19	55.6 Å²	55.6	16%	0.157	28%	0.283	C	S	.	.	H	α-helix	trans	-89.8	-9.8	171	0	0	0	0	0	112.6	F224 N252 V253 R278	F224-A255 HydrophobicContact CB-CB 4.4Å; F224-A255 HydrophobicContact CD1-CB 4.07Å; F224-A255 HydrophobicContact CG-CB 4.41Å; N252-A255 HydrophobicContact CB-CB 4.31Å; N252-A255 CarbonylContact O-C 3.52Å; N252-A255 WeakPolarHBondContact O-CA 3.4Å; N252-A255 WeakPolarHBondContact O-CB 3.18Å; N252-A255 PolarHBondContact O-N 2.8Å; V253-A255 VanDerWaalsContact C-N 3.26Å; V253-A255 PolarHBondContact O-N 2.79Å; A255-R278 PolarHBondContact O-NE 3.3Å; A255-R278 PolarHBondContact O-NH2 3.38Å; A255-R278 VanDerWaalsContact O-NH2 3.11Å
256	I	95.9	Very high	94.5	Very high	5 Å²	5	52.9 Å²	52.9	3%	0.026	27%	0.269	C	S	.	.	H	α-helix	trans	-87.7	-55.3	167.9	-63.3	166.9	0	0	0	109.4	F224 F249 N252 V253 F271 L275 R278	F224-I256 HydrophobicContact CE1-CD1 4.18Å; F224-I256 HydrophobicContact CE1-CG1 3.45Å; F224-I256 VanDerWaalsContact CE1-CG1 3.45Å; F224-I256 HydrophobicContact CZ-CD1 3.8Å; F224-I256 HydrophobicContact CZ-CG1 3.6Å; F249-I256 HydrophobicContact CB-CD1 4.32Å; F249-I256 HydrophobicContact CD1-CD1 3.86Å; N252-I256 PolarHBondContact O-N 3.15Å; N252-I256 VanDerWaalsContact O-N 3.09Å; V253-I256 WeakPolarHBondContact O-CA 3.39Å; V253-I256 WeakPolarHBondContact O-CB 3.46Å; V253-I256 PolarHBondContact O-N 3.37Å; I256-F271 HydrophobicContact CB-CE2 4.42Å; I256-F271 HydrophobicContact CD1-CE2 3.66Å; I256-F271 HydrophobicContact CD1-CZ 4.06Å; I256-F271 HydrophobicContact CG2-CD2 4.24Å; I256-F271 HydrophobicContact CG2-CE2 3.95Å; I256-L275 HydrophobicContact CD1-CD1 4.26Å; I256-L275 HydrophobicContact CG2-CB 4.07Å; I256-L275 HydrophobicContact CG2-CD1 4.23Å; I256-R278 VanDerWaalsContact O-CG 3.28Å; I256-R278 WeakPolarHBondContact O-CG 3.4Å
257	C	94.7	Very high	94.5	Very high	11 Å²	11	54.7 Å²	54.7	7%	0.074	28%	0.278	C	S	.	.			trans	-139.5	114.5	176.3	-164.7	0	0	0	0	109.9	V253 S259 L260	V253-C257 PolarHBondContact O-N 2.7Å; C257-S259 VanDerWaalsContact C-N 3.29Å; C257-S259 PolarHBondContact O-N 3.13Å; C257-S259 PolarHBondContact SG-OG 3.36Å; C257-L260 HydrophobicContact CB-CD1 3.81Å; C257-L260 HydrophobicContact CB-CG 3.81Å; C257-L260 PolarHBondContact O-N 3.2Å
258	P	93.7	Very high	94.6	Very high	89 Å²	89	51.4 Å²	51.4	58%	0.578	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-21.6	-169.3	-26.8	36.4	0	0	0	117.1	R254	R254-P258 WeakPolarHBondContact O-CA 3.41Å
259	S	93	Very high	94.7	Very high	68 Å²	68	50.1 Å²	50.1	48%	0.476	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-36.4	176.9	33.9	0	0	0	0	112.9	C257 E270	C257-S259 VanDerWaalsContact C-N 3.29Å; C257-S259 PolarHBondContact O-N 3.13Å; C257-S259 PolarHBondContact SG-OG 3.36Å; S259-E270 VanDerWaalsContact CB-OE1 3.3Å; S259-E270 WeakPolarHBondContact CB-OE1 3.43Å; S259-E270 PolarHBondContact OG-OE1 3.27Å
260	L	94.7	Very high	94.6	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.266	C	S	.	.			trans	-69.9	137.3	-174.1	-57.3	-171.4	0	0	0	111.9	Y179 V253 R254 C257 E266 E270 F271	Y179-L260 HydrophobicContact CE2-CD1 4.29Å; V253-L260 HydrophobicContact CG2-CB 4.03Å; V253-L260 HydrophobicContact CG2-CD1 4.19Å; R254-L260 VanDerWaalsContact CG-O 3.31Å; R254-L260 WeakPolarHBondContact CG-O 3.48Å; C257-L260 HydrophobicContact CB-CD1 3.81Å; C257-L260 HydrophobicContact CB-CG 3.81Å; C257-L260 PolarHBondContact O-N 3.2Å; L260-E266 HydrophobicContact CB-CG 4.35Å; L260-E266 HydrophobicContact CD2-CB 3.87Å; L260-E266 HydrophobicContact CD2-CG 4.13Å; L260-E270 HydrophobicContact CD2-CB 4.27Å; L260-E270 VanDerWaalsContact CD2-CD 3.47Å; L260-E270 HydrophobicContact CD2-CG 3.8Å; L260-E270 HydrophobicContact CG-CG 4.39Å; L260-F271 HydrophobicContact CD1-CB 3.85Å; L260-F271 HydrophobicContact CD1-CD2 4.05Å; L260-F271 HydrophobicContact CD1-CG 4.47Å
261	R	92.5	Very high	94.8	Very high	124 Å²	124	53 Å²	53	47%	0.468	26%	0.264	S	S	.	.			trans	-104.5	133.2	-178.5	-63.6	158.9	-63.4	157.6	8.6	110.5	Q264 E266	R261-Q264 HydrophobicContact CB-CB 4.1Å; R261-Q264 HydrophobicContact CB-CG 3.66Å; R261-Q264 PolarHBondContact O-N 3.33Å; R261-E266 WeakPolarHBondContact CB-OE1 3.19Å; R261-E266 IonicContact CZ-OE1 3.82Å; R261-E266 PolarHBondContact N-OE1 2.93Å; R261-E266 IonicContact NE-OE1 3.84Å; R261-E266 PolarHBondContact NE-OE1 3.34Å; R261-E266 IonicContact NH2-OE1 3.66Å; R261-E266 PolarHBondContact NH2-OE1 3.21Å; R261-E266 VanDerWaalsContact NH2-OE1 3.07Å; R261-E266 IonicContact NH2-OE2 3.64Å
262	P	90	Very high	94.9	Very high	47 Å²	47	48.2 Å²	48.2	31%	0.305	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	143.5	169.5	-22.4	31.6	0	0	0	111.4	V253 R254 Q264	V253-P262 HydrophobicContact CG1-CB 4.31Å; V253-P262 HydrophobicContact CG1-CG 3.76Å; R254-P262 HydrophobicContact CG-CG 4.44Å; P262-Q264 PolarHBondContact O-N 3.15Å
263	Y	91.8	Very high	95	Very high	135 Å²	135	46.7 Å²	46.7	53%	0.529	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.8	4.1	176	-40.6	-68.2	0	0	0	116.5	S174 G175 N176	S174-Y263 VanDerWaalsContact O-CD1 3.25Å; S174-Y263 WeakPolarHBondContact O-CD1 3.32Å; S174-Y263 WeakPolarHBondContact O-CE1 3.38Å; G175-Y263 WeakPolarHBondContact O-CA 3.47Å; N176-Y263 PolarHBondContact ND2-O 2.79Å
264	Q	93.3	Very high	95.1	Very high	86 Å²	86	46.9 Å²	46.9	40%	0.402	23%	0.228	S	C	.	.	S	Bend	trans	-93.1	157.6	169.7	-63.7	-63.8	-67.7	0	0	110.6	N176 Y179 R261 P262 E266	N176-Q264 WeakPolarHBondContact CB-O 3.42Å; Y179-Q264 WeakPolarHBondContact CE1-O 3.25Å; R261-Q264 HydrophobicContact CB-CB 4.1Å; R261-Q264 HydrophobicContact CB-CG 3.66Å; R261-Q264 PolarHBondContact O-N 3.33Å; P262-Q264 PolarHBondContact O-N 3.15Å; Q264-E266 HydrophobicContact CB-CG 4.23Å
265	Q	93.3	Very high	95.2	Very high	63 Å²	63	39 Å²	39	29%	0.294	20%	0.199	S	C	.	.			trans	-76	133.3	161.5	-61.8	-162.3	7.2	0	0	108.5	N176 S437 G438	N176-Q265 HydrophobicContact CB-CG 3.78Å; N176-Q265 VanDerWaalsContact CG-CG 3.48Å; N176-Q265 VanDerWaalsContact OD1-CG 3.22Å; N176-Q265 WeakPolarHBondContact OD1-CG 3.18Å; N176-Q265 PolarHBondContact OD1-NE2 2.99Å; Q265-S437 VanDerWaalsContact OE1-CA 3.26Å; Q265-G438 PolarHBondContact NE2-O 2.77Å; Q265-G438 PolarHBondContact OE1-O 3.29Å
266	E	95.3	Very high	95.4	Very high	32 Å²	32	38.1 Å²	38.1	15%	0.15	19%	0.191	C	C	.	.			trans	-144.8	163.9	-173.6	-59.4	-67.8	-171.3	0	0	108.9	Y179 L260 R261 Q264 A268	Y179-E266 WeakPolarHBondContact CB-O 3.47Å; Y179-E266 HydrophobicContact CD1-CB 4.27Å; Y179-E266 HydrophobicContact CD2-CB 4.42Å; Y179-E266 HydrophobicContact CE1-CB 3.97Å; Y179-E266 HydrophobicContact CE1-CG 4.28Å; Y179-E266 HydrophobicContact CE2-CB 4.16Å; Y179-E266 HydrophobicContact CG-CB 4.49Å; L260-E266 HydrophobicContact CB-CG 4.35Å; L260-E266 HydrophobicContact CD2-CB 3.87Å; L260-E266 HydrophobicContact CD2-CG 4.13Å; R261-E266 WeakPolarHBondContact CB-OE1 3.19Å; R261-E266 IonicContact CZ-OE1 3.82Å; R261-E266 PolarHBondContact N-OE1 2.93Å; R261-E266 IonicContact NE-OE1 3.84Å; R261-E266 PolarHBondContact NE-OE1 3.34Å; R261-E266 IonicContact NH2-OE1 3.66Å; R261-E266 PolarHBondContact NH2-OE1 3.21Å; R261-E266 VanDerWaalsContact NH2-OE1 3.07Å; R261-E266 IonicContact NH2-OE2 3.64Å; Q264-E266 HydrophobicContact CB-CG 4.23Å; E266-A268 PolarHBondContact O-N 2.86Å
267	D	95.3	Very high	95.4	Very high	41 Å²	41	38.3 Å²	38.3	22%	0.219	19%	0.193	C	C	.	.			trans	-76.2	124.2	-175.6	-166.2	-24.7	0	0	0	112.5	H269 E270 F271 Y440 Y472	D267-H269 PolarHBondContact O-N 2.86Å; D267-H269 WeakPolarHBondContact OD1-CB 3.41Å; D267-H269 PolarHBondContact OD1-N 3.01Å; D267-E270 HydrophobicContact CB-CB 4.15Å; D267-E270 PolarHBondContact O-N 2.72Å; D267-E270 VanDerWaalsContact O-N 3.15Å; D267-F271 PolarHBondContact O-N 3.07Å; D267-Y440 PolarHBondContact OD1-OH 3.04Å; D267-Y472 VanDerWaalsContact CG-OH 3.23Å; D267-Y472 WeakPolarHBondContact OD1-CE1 3.15Å; D267-Y472 PolarHBondContact OD1-OH 3.5Å; D267-Y472 PolarHBondContact OD2-OH 3.42Å
268	A	97.6	Very high	95.4	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-56.3	-31	173.6	0	0	0	0	0	113.3	V183 E266 L272 Y440 Y472 L473	V183-A268 HydrophobicContact CG2-CB 3.91Å; V183-A268 WeakPolarHBondContact CG2-O 3.47Å; E266-A268 PolarHBondContact O-N 2.86Å; A268-L272 VanDerWaalsContact O-CB 3.25Å; A268-L272 WeakPolarHBondContact O-CB 3.46Å; A268-L272 PolarHBondContact O-N 3.23Å; A268-Y440 HydrophobicContact CB-CD1 3.8Å; A268-Y440 HydrophobicContact CB-CE1 3.44Å; A268-Y440 VanDerWaalsContact CB-CE1 3.44Å; A268-Y440 HydrophobicContact CB-CE2 4.21Å; A268-Y440 HydrophobicContact CB-CG 4.32Å; A268-Y440 PolarHBondContact N-OH 3.36Å; A268-Y472 HydrophobicContact CB-CE1 4.49Å; A268-L473 HydrophobicContact CB-CD1 4.41Å
269	H	97.2	Very high	95.6	Very high	17 Å²	17	34.9 Å²	34.9	8%	0.079	17%	0.167	C	C	.	.	H	α-helix	trans	-70.9	-42.1	176.1	-178.4	-113.2	0	0	0	112.4	D267 F271 L272 L273 N329 Q386 Y472 L473	D267-H269 PolarHBondContact O-N 2.86Å; D267-H269 WeakPolarHBondContact OD1-CB 3.41Å; D267-H269 PolarHBondContact OD1-N 3.01Å; H269-F271 VanDerWaalsContact C-N 3.34Å; H269-L272 PolarHBondContact O-N 2.95Å; H269-L273 WeakPolarHBondContact CE1-CD1 3.45Å; H269-L273 PolarHBondContact O-N 3.16Å; H269-N329 VanDerWaalsContact NE2-CG 3.31Å; H269-N329 PolarHBondContact NE2-ND2 2.93Å; H269-N329 PolarHBondContact NE2-OD1 3.39Å; H269-N329 VanDerWaalsContact NE2-OD1 3.08Å; H269-Q386 PolarHBondContact CE1-OE1 2.89Å; H269-Q386 VanDerWaalsContact CG-NE2 3.26Å; H269-Q386 PolarHBondContact ND1-NE2 3.03Å; H269-Q386 VanDerWaalsContact ND1-NE2 3.11Å; H269-Q386 PolarHBondContact ND1-OE1 2.86Å; H269-Q386 PolarHBondContact NE2-OE1 2.81Å; H269-Y472 HydrophobicContact CB-CE1 3.95Å; H269-Y472 WeakPolarHBondContact CB-OH 3.49Å; H269-L473 HydrophobicContact CB-CD2 4.23Å
270	E	96.9	Very high	95.7	Very high	71 Å²	71	32.4 Å²	32.4	33%	0.332	15%	0.148	S	C	.	.	H	α-helix	trans	-65	-40.7	175.6	-175.8	172	-174.2	0	0	110.9	S259 L260 D267 G274	S259-E270 VanDerWaalsContact CB-OE1 3.3Å; S259-E270 WeakPolarHBondContact CB-OE1 3.43Å; S259-E270 PolarHBondContact OG-OE1 3.27Å; L260-E270 HydrophobicContact CD2-CB 4.27Å; L260-E270 VanDerWaalsContact CD2-CD 3.47Å; L260-E270 HydrophobicContact CD2-CG 3.8Å; L260-E270 HydrophobicContact CG-CG 4.39Å; D267-E270 HydrophobicContact CB-CB 4.15Å; D267-E270 PolarHBondContact O-N 2.72Å; D267-E270 VanDerWaalsContact O-N 3.15Å; E270-G274 PolarHBondContact O-N 3.23Å
271	F	98.2	Very high	95.7	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-61.7	-46.4	172.4	178.9	-102.3	0	0	0	112.4	Y179 L180 V183 L184 V253 I256 L260 D267 H269 L273 G274 L275	Y179-F271 HydrophobicContact CD2-CB 3.77Å; Y179-F271 HydrophobicContact CD2-CD2 4.49Å; Y179-F271 HydrophobicContact CD2-CG 4.04Å; Y179-F271 HydrophobicContact CE2-CB 3.96Å; Y179-F271 HydrophobicContact CE2-CD2 4.01Å; Y179-F271 HydrophobicContact CE2-CG 4.02Å; L180-F271 HydrophobicContact CB-CD1 4.33Å; L180-F271 HydrophobicContact CB-CE1 4.07Å; L180-F271 HydrophobicContact CB-CE2 4.25Å; L180-F271 HydrophobicContact CB-CZ 4.04Å; L180-F271 HydrophobicContact CD1-CD2 4.48Å; L180-F271 HydrophobicContact CD1-CE2 3.68Å; L180-F271 HydrophobicContact CD1-CZ 3.77Å; L180-F271 HydrophobicContact CG-CE1 3.94Å; L180-F271 HydrophobicContact CG-CE2 3.91Å; L180-F271 HydrophobicContact CG-CZ 3.53Å; V183-F271 HydrophobicContact CB-CD1 3.81Å; V183-F271 HydrophobicContact CB-CE1 4.05Å; V183-F271 HydrophobicContact CG1-CD1 3.75Å; V183-F271 HydrophobicContact CG1-CE1 3.87Å; V183-F271 HydrophobicContact CG2-CD1 4.22Å; L184-F271 HydrophobicContact CG-CE1 4.36Å; V253-F271 HydrophobicContact CG2-CD2 4.23Å; V253-F271 HydrophobicContact CG2-CE2 4.32Å; I256-F271 HydrophobicContact CB-CE2 4.42Å; I256-F271 HydrophobicContact CD1-CE2 3.66Å; I256-F271 HydrophobicContact CD1-CZ 4.06Å; I256-F271 HydrophobicContact CG2-CD2 4.24Å; I256-F271 HydrophobicContact CG2-CE2 3.95Å; L260-F271 HydrophobicContact CD1-CB 3.85Å; L260-F271 HydrophobicContact CD1-CD2 4.05Å; L260-F271 HydrophobicContact CD1-CG 4.47Å; D267-F271 PolarHBondContact O-N 3.07Å; H269-F271 VanDerWaalsContact C-N 3.34Å; F271-L273 PolarHBondContact O-N 3.04Å; F271-G274 PolarHBondContact O-N 2.78Å; F271-L275 HydrophobicContact CE1-CD2 4.17Å; F271-L275 HydrophobicContact CZ-CD1 4.29Å; F271-L275 VanDerWaalsContact O-CB 3.28Å; F271-L275 WeakPolarHBondContact O-CB 3.31Å; F271-L275 PolarHBondContact O-N 3.46Å
272	L	98.4	Very high	95.8	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-59.7	-45.1	177.9	172.5	59.4	0	0	0	112.5	V183 I187 A268 H269 L275 L276 I384 L473 F475	V183-L272 HydrophobicContact CG1-CB 3.94Å; V183-L272 HydrophobicContact CG1-CD1 3.9Å; V183-L272 HydrophobicContact CG1-CG 4.46Å; V183-L272 HydrophobicContact CG2-CB 4.28Å; I187-L272 HydrophobicContact CD1-CD1 4.07Å; A268-L272 VanDerWaalsContact O-CB 3.25Å; A268-L272 WeakPolarHBondContact O-CB 3.46Å; A268-L272 PolarHBondContact O-N 3.23Å; H269-L272 PolarHBondContact O-N 2.95Å; L272-L275 WeakPolarHBondContact O-CB 3.23Å; L272-L275 PolarHBondContact O-N 3.11Å; L272-L276 HydrophobicContact CD1-CD1 3.7Å; L272-L276 HydrophobicContact CD1-CG 4.18Å; L272-L276 HydrophobicContact CG-CD1 3.94Å; L272-L276 WeakPolarHBondContact O-CG 3.42Å; L272-L276 PolarHBondContact O-N 3.27Å; L272-I384 HydrophobicContact CD1-CD1 4.41Å; L272-I384 HydrophobicContact CD2-CD1 4.34Å; L272-I384 HydrophobicContact CD2-CG2 3.95Å; L272-L473 HydrophobicContact CD2-CD1 3.9Å; L272-F475 HydrophobicContact CD1-CE1 4.35Å; L272-F475 HydrophobicContact CD1-CZ 4.24Å; L272-F475 HydrophobicContact CD2-CE1 4.29Å; L272-F475 HydrophobicContact CD2-CZ 3.74Å
273	L	97.7	Very high	96	Very high	6 Å²	6	27.7 Å²	27.7	3%	0.031	13%	0.132	C	C	.	.	H	α-helix	trans	-71.5	-34.8	179.2	-70.6	-176.4	0	0	0	112.9	Y13 H269 F271 L276 S277 F328	Y13-L273 HydrophobicContact CD1-CD1 4.34Å; Y13-L273 HydrophobicContact CE1-CD1 3.55Å; H269-L273 WeakPolarHBondContact CE1-CD1 3.45Å; H269-L273 PolarHBondContact O-N 3.16Å; F271-L273 PolarHBondContact O-N 3.04Å; L273-L276 HydrophobicContact CD2-CD1 4.32Å; L273-S277 VanDerWaalsContact O-CB 3.31Å; L273-S277 WeakPolarHBondContact O-CB 3.39Å; L273-S277 PolarHBondContact O-N 2.87Å; L273-S277 PolarHBondContact O-OG 3.21Å; L273-F328 HydrophobicContact CD2-CB 3.75Å; L273-F328 HydrophobicContact CD2-CD2 4.39Å
274	G	97.5	Very high	96.1	Very high	5 Å²	5	22.5 Å²	22.5	5%	0.052	11%	0.113	C	C	.	.	H	α-helix	trans	-61.1	-45.1	167.7	0	0	0	0	0	112	E270 F271 S277 R278	E270-G274 PolarHBondContact O-N 3.23Å; F271-G274 PolarHBondContact O-N 2.78Å; G274-S277 PolarHBondContact O-N 3.07Å; G274-R278 WeakPolarHBondContact O-CB 3.46Å; G274-R278 VanDerWaalsContact O-CG 3.26Å; G274-R278 WeakPolarHBondContact O-CG 3.36Å; G274-R278 PolarHBondContact O-N 2.99Å
275	L	98.2	Very high	96.1	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-61.9	-47.8	179.1	-169.7	72.3	0	0	0	111.9	V183 L184 I187 V226 F249 I256 F271 L272 R278 M279	V183-L275 HydrophobicContact CG1-CD2 4.18Å; L184-L275 HydrophobicContact CD2-CD2 4Å; I187-L275 HydrophobicContact CG1-CD2 3.96Å; V226-L275 HydrophobicContact CG1-CD1 3.52Å; V226-L275 HydrophobicContact CG1-CG 4.22Å; V226-L275 HydrophobicContact CG2-CD1 4.38Å; F249-L275 HydrophobicContact CD1-CD1 4.21Å; F249-L275 HydrophobicContact CE1-CD1 4Å; I256-L275 HydrophobicContact CD1-CD1 4.26Å; I256-L275 HydrophobicContact CG2-CB 4.07Å; I256-L275 HydrophobicContact CG2-CD1 4.23Å; F271-L275 HydrophobicContact CE1-CD2 4.17Å; F271-L275 HydrophobicContact CZ-CD1 4.29Å; F271-L275 VanDerWaalsContact O-CB 3.28Å; F271-L275 WeakPolarHBondContact O-CB 3.31Å; F271-L275 PolarHBondContact O-N 3.46Å; L272-L275 WeakPolarHBondContact O-CB 3.23Å; L272-L275 PolarHBondContact O-N 3.11Å; L275-R278 PolarHBondContact O-N 3.06Å; L275-M279 HydrophobicContact CG-CE 4.45Å; L275-M279 WeakPolarHBondContact O-CG 3.26Å; L275-M279 PolarHBondContact O-N 3.49Å
276	L	98.1	Very high	95.8	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-61.5	-46.9	175.9	-75.7	159.5	0	0	0	111.9	L272 L273 R278 M279 E280 I300 F304 F328 I384	L272-L276 HydrophobicContact CD1-CD1 3.7Å; L272-L276 HydrophobicContact CD1-CG 4.18Å; L272-L276 HydrophobicContact CG-CD1 3.94Å; L272-L276 WeakPolarHBondContact O-CG 3.42Å; L272-L276 PolarHBondContact O-N 3.27Å; L273-L276 HydrophobicContact CD2-CD1 4.32Å; L276-R278 PolarHBondContact O-N 3.29Å; L276-M279 HydrophobicContact CD2-CE 3.75Å; L276-M279 HydrophobicContact CG-CE 4.21Å; L276-M279 PolarHBondContact O-N 3.3Å; L276-E280 PolarHBondContact O-N 3Å; L276-I300 HydrophobicContact CD2-CG2 4.22Å; L276-F304 HydrophobicContact CD2-CB 4.09Å; L276-F304 HydrophobicContact CD2-CD1 3.92Å; L276-F304 HydrophobicContact CD2-CD2 3.58Å; L276-F304 HydrophobicContact CD2-CE1 4.15Å; L276-F304 HydrophobicContact CD2-CE2 3.85Å; L276-F304 HydrophobicContact CD2-CG 3.61Å; L276-F304 HydrophobicContact CD2-CZ 4.12Å; L276-F328 HydrophobicContact CB-CD2 4.11Å; L276-F328 HydrophobicContact CB-CE2 4.16Å; L276-F328 HydrophobicContact CB-CG 4.29Å; L276-F328 HydrophobicContact CB-CZ 4.38Å; L276-F328 HydrophobicContact CD1-CB 4.07Å; L276-F328 HydrophobicContact CD1-CG 4.27Å; L276-I384 HydrophobicContact CD1-CD1 3.85Å
277	S	96.1	Very high	95.5	Very high	9 Å²	9	20.6 Å²	20.6	6%	0.063	12%	0.121	C	C	.	.	H	α-helix	trans	-60.4	-34.5	176.8	-56	0	0	0	0	112.3	L273 G274 E280 D281	L273-S277 VanDerWaalsContact O-CB 3.31Å; L273-S277 WeakPolarHBondContact O-CB 3.39Å; L273-S277 PolarHBondContact O-N 2.87Å; L273-S277 PolarHBondContact O-OG 3.21Å; G274-S277 PolarHBondContact O-N 3.07Å; S277-E280 WeakPolarHBondContact O-CB 3.28Å; S277-E280 PolarHBondContact O-N 2.95Å; S277-D281 PolarHBondContact O-N 3.28Å
278	R	95.7	Very high	95.2	Very high	28 Å²	28	20.8 Å²	20.8	11%	0.106	13%	0.133	C	C	.	.	H	α-helix	trans	-87	-17.6	-180	-63.4	-70.1	-85	164.5	-7.3	113.9	S218 S222 V226 A255 I256 G274 L275 L276 D281 S282	S218-R278 PolarHBondContact O-NH2 3.12Å; S218-R278 PolarHBondContact OG-NH1 2.75Å; S222-R278 PolarHBondContact OG-NH2 2.85Å; V226-R278 HydrophobicContact CG2-CB 3.69Å; A255-R278 PolarHBondContact O-NE 3.3Å; A255-R278 PolarHBondContact O-NH2 3.38Å; A255-R278 VanDerWaalsContact O-NH2 3.11Å; I256-R278 VanDerWaalsContact O-CG 3.28Å; I256-R278 WeakPolarHBondContact O-CG 3.4Å; G274-R278 WeakPolarHBondContact O-CB 3.46Å; G274-R278 VanDerWaalsContact O-CG 3.26Å; G274-R278 WeakPolarHBondContact O-CG 3.36Å; G274-R278 PolarHBondContact O-N 2.99Å; L275-R278 PolarHBondContact O-N 3.06Å; L276-R278 PolarHBondContact O-N 3.29Å; R278-D281 WeakPolarHBondContact CD-OD2 3.47Å; R278-D281 IonicContact CZ-OD2 3.07Å; R278-D281 IonicContact NE-OD2 3.55Å; R278-D281 IonicContact NH1-OD2 2.71Å; R278-D281 PolarHBondContact NH1-OD2 2.8Å; R278-S282 VanDerWaalsContact O-CB 3.3Å; R278-S282 WeakPolarHBondContact O-CB 3.31Å; R278-S282 PolarHBondContact O-N 2.84Å; R278-S282 PolarHBondContact O-OG 2.94Å
279	M	96.7	Very high	94.8	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-71.3	-40.2	160.5	-70.9	-170.7	-68.4	0	0	111.5	I187 L193 V226 L227 L230 L275 L276 S282 S283 I300	I187-M279 HydrophobicContact CD1-CE 4.44Å; L193-M279 HydrophobicContact CD1-SD 4.02Å; L193-M279 HydrophobicContact CD2-CE 3.99Å; L193-M279 HydrophobicContact CD2-SD 3.76Å; V226-M279 HydrophobicContact CB-CG 3.82Å; V226-M279 HydrophobicContact CG1-CG 3.35Å; V226-M279 HydrophobicContact CG1-SD 4.06Å; L227-M279 HydrophobicContact CD2-CB 4.3Å; L227-M279 HydrophobicContact CD2-CG 4.03Å; L227-M279 HydrophobicContact CD2-SD 4.22Å; L230-M279 HydrophobicContact CD1-SD 3.5Å; L230-M279 VanDerWaalsContact CD1-SD 3.5Å; L275-M279 HydrophobicContact CG-CE 4.45Å; L275-M279 WeakPolarHBondContact O-CG 3.26Å; L275-M279 PolarHBondContact O-N 3.49Å; L276-M279 HydrophobicContact CD2-CE 3.75Å; L276-M279 HydrophobicContact CG-CE 4.21Å; L276-M279 PolarHBondContact O-N 3.3Å; M279-S282 CarbonylContact O-C 3.57Å; M279-S282 PolarHBondContact O-N 2.78Å; M279-S282 VanDerWaalsContact O-N 3.15Å; M279-S283 PolarHBondContact O-N 2.7Å; M279-I300 HydrophobicContact CB-CD1 3.9Å; M279-I300 HydrophobicContact CB-CG1 3.95Å; M279-I300 HydrophobicContact CB-CG2 4.32Å
280	E	95.5	Very high	94.4	Very high	16 Å²	16	32.7 Å²	32.7	8%	0.075	19%	0.189	C	C	.	.	H	α-helix	trans	-57.8	-54.6	173.1	166.4	164.5	-114.6	0	0	110.9	L276 S277 S282 S283 L284 N298 I300 R301	L276-E280 PolarHBondContact O-N 3Å; S277-E280 WeakPolarHBondContact O-CB 3.28Å; S277-E280 PolarHBondContact O-N 2.95Å; E280-S282 VanDerWaalsContact C-N 3.27Å; E280-S282 PolarHBondContact O-N 2.77Å; E280-S283 PolarHBondContact O-N 2.91Å; E280-S283 VanDerWaalsContact O-N 3.1Å; E280-S283 PolarHBondContact O-OG 2.76Å; E280-L284 HydrophobicContact CG-CD1 4.02Å; E280-L284 WeakPolarHBondContact O-CG 3.49Å; E280-L284 PolarHBondContact O-N 2.77Å; E280-N298 PolarHBondContact OE1-ND2 3.32Å; E280-I300 HydrophobicContact CB-CB 4.39Å; E280-R301 VanDerWaalsContact CD-NE 3.34Å; E280-R301 WeakPolarHBondContact OE1-CD 3.48Å; E280-R301 WeakPolarHBondContact OE1-CG 3.31Å; E280-R301 IonicContact OE1-CZ 2.74Å; E280-R301 IonicContact OE1-NE 3.8Å; E280-R301 PolarHBondContact OE1-NE 2.86Å; E280-R301 IonicContact OE1-NH2 3.58Å; E280-R301 IonicContact OE2-CZ 2.7Å; E280-R301 IonicContact OE2-NE 3.17Å; E280-R301 PolarHBondContact OE2-NE 3.35Å; E280-R301 IonicContact OE2-NH2 3.33Å; E280-R301 PolarHBondContact OE2-NH2 3.07Å
281	D	94.5	Very high	94.2	Very high	43 Å²	43	33.1 Å²	33.1	23%	0.23	20%	0.199	C	C	.	.	H	α-helix	trans	-48.4	-49.7	169.7	-90.2	-8.4	0	0	0	111.2	I216 L219 S277 R278 S283 L284 A285	I216-D281 HydrophobicContact CD1-CB 4.32Å; I216-D281 VanDerWaalsContact CD1-O 3.32Å; I216-D281 WeakPolarHBondContact CD1-O 3.34Å; L219-D281 HydrophobicContact CD1-CB 4Å; L219-D281 HydrophobicContact CD2-CB 4.32Å; L219-D281 HydrophobicContact CG-CB 4.24Å; S277-D281 PolarHBondContact O-N 3.28Å; R278-D281 WeakPolarHBondContact CD-OD2 3.47Å; R278-D281 IonicContact CZ-OD2 3.07Å; R278-D281 IonicContact NE-OD2 3.55Å; R278-D281 IonicContact NH1-OD2 2.71Å; R278-D281 PolarHBondContact NH1-OD2 2.8Å; D281-S283 VanDerWaalsContact C-N 3.28Å; D281-S283 PolarHBondContact O-N 3.33Å; D281-L284 PolarHBondContact O-N 3.3Å; D281-A285 WeakPolarHBondContact O-CB 3.39Å; D281-A285 PolarHBondContact O-N 3.06Å
282	S	94.6	Very high	93.8	Very high	6 Å²	6	40.8 Å²	40.8	4%	0.042	23%	0.228	C	C	.	.	H	α-helix	trans	-63.8	-31.5	-176.8	-61.6	0	0	0	0	113.2	R278 M279 E280 A285	R278-S282 VanDerWaalsContact O-CB 3.3Å; R278-S282 WeakPolarHBondContact O-CB 3.31Å; R278-S282 PolarHBondContact O-N 2.84Å; R278-S282 PolarHBondContact O-OG 2.94Å; M279-S282 CarbonylContact O-C 3.57Å; M279-S282 PolarHBondContact O-N 2.78Å; M279-S282 VanDerWaalsContact O-N 3.15Å; E280-S282 VanDerWaalsContact C-N 3.27Å; E280-S282 PolarHBondContact O-N 2.77Å; S282-A285 WeakPolarHBondContact O-CB 3.42Å
283	S	93.9	Very high	93.4	Very high	23 Å²	23	48.1 Å²	48.1	16%	0.161	26%	0.26	C	S	.	.	H	α-helix	trans	-76.9	-32.4	176.9	74.9	0	0	0	0	112.9	M279 E280 D281	M279-S283 PolarHBondContact O-N 2.7Å; E280-S283 PolarHBondContact O-N 2.91Å; E280-S283 VanDerWaalsContact O-N 3.1Å; E280-S283 PolarHBondContact O-OG 2.76Å; D281-S283 VanDerWaalsContact C-N 3.28Å; D281-S283 PolarHBondContact O-N 3.33Å
284	L	94.1	Very high	93.1	Very high	26 Å²	26	50.3 Å²	50.3	14%	0.136	27%	0.272	C	S	.	.	H	α-helix	trans	-85.1	-13.7	179.5	-67	174.6	0	0	0	113.2	L147 I216 E280 D281 G286 L287 N298	L147-L284 HydrophobicContact CD1-CD2 3.57Å; I216-L284 HydrophobicContact CD1-CB 4.15Å; E280-L284 HydrophobicContact CG-CD1 4.02Å; E280-L284 WeakPolarHBondContact O-CG 3.49Å; E280-L284 PolarHBondContact O-N 2.77Å; D281-L284 PolarHBondContact O-N 3.3Å; L284-G286 PolarHBondContact O-N 2.81Å; L284-L287 HydrophobicContact CD2-CD1 3.88Å; L284-L287 PolarHBondContact O-N 3.34Å; L284-N298 HydrophobicContact CD2-CB 3.91Å; L284-N298 HydrophobicContact CG-CB 4.33Å
285	A	92.9	Very high	92.9	Very high	2 Å²	2	51.1 Å²	51.1	2%	0.017	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-19	-167.4	0	0	0	0	0	117.4	I208 I209 S214 S215 L219 D281 S282	I208-A285 HydrophobicContact CD1-CB 4.29Å; I208-A285 WeakPolarHBondContact CD1-O 3.5Å; I209-A285 HydrophobicContact CD1-CB 3.68Å; I209-A285 HydrophobicContact CG1-CB 3.74Å; S214-A285 CarbonylContact C-O 3.57Å; S214-A285 VanDerWaalsContact CA-O 3.28Å; S214-A285 WeakPolarHBondContact CA-O 3.47Å; S214-A285 WeakPolarHBondContact OG-CA 3.17Å; S214-A285 WeakPolarHBondContact OG-CB 3.43Å; S214-A285 PolarHBondContact OG-O 2.81Å; S215-A285 PolarHBondContact N-O 2.78Å; S215-A285 PolarHBondContact OG-O 2.67Å; L219-A285 HydrophobicContact CD1-CB 3.72Å; D281-A285 WeakPolarHBondContact O-CB 3.39Å; D281-A285 PolarHBondContact O-N 3.06Å; S282-A285 WeakPolarHBondContact O-CB 3.42Å
286	G	88.2	Confident	92.6	Very high	55 Å²	55	53.1 Å²	53.1	57%	0.567	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.1	-4.1	-179.1	0	0	0	0	0	115.4	L284 G288	L284-G286 PolarHBondContact O-N 2.81Å; G286-G288 VanDerWaalsContact C-N 3.35Å; G286-G288 PolarHBondContact O-N 3.25Å
287	L	89.2	Confident	92.4	Very high	84 Å²	84	54.2 Å²	54.2	44%	0.44	29%	0.293	S	S	.	.	S	Bend	trans	-88.6	4.7	-170.7	-59.7	175.9	0	0	0	114.4	L147 L284 K289 V290	L147-L287 HydrophobicContact CD1-CD1 3.71Å; L147-L287 HydrophobicContact CD2-CD1 3.79Å; L147-L287 HydrophobicContact CG-CD1 4.33Å; L284-L287 HydrophobicContact CD2-CD1 3.88Å; L284-L287 PolarHBondContact O-N 3.34Å; L287-K289 PolarHBondContact O-N 3.15Å; L287-V290 HydrophobicContact CB-CG2 3.52Å; L287-V290 HydrophobicContact CD1-CG2 4.37Å; L287-V290 WeakPolarHBondContact O-CG2 3.27Å
288	G	88.1	Confident	92.4	Very high	46 Å²	46	54 Å²	54	47%	0.474	29%	0.291	S	S	.	.			trans	68.1	-130.2	-179.6	0	0	0	0	0	112.6	S215 G286	S215-G288 PolarHBondContact OG-O 2.93Å; G286-G288 VanDerWaalsContact C-N 3.35Å; G286-G288 PolarHBondContact O-N 3.25Å
289	K	88.3	Confident	92.4	Very high	220 Å²	220	53 Å²	53	96%	0.957	29%	0.288	S	S	*	.	S	Bend	trans	-98.6	113.2	173.5	-69.7	-178.4	-179.2	177.1	0	109.2	L287	L287-K289 PolarHBondContact O-N 3.15Å
290	V	89.2	Confident	92.5	Very high	47 Å²	47	53 Å²	53	29%	0.285	29%	0.288	S	S	.	.			trans	-109	147	179.2	-175.2	0	0	0	0	109.4	L147 L287 L294	L147-V290 HydrophobicContact CD1-CG1 4.44Å; L287-V290 HydrophobicContact CB-CG2 3.52Å; L287-V290 HydrophobicContact CD1-CG2 4.37Å; L287-V290 WeakPolarHBondContact O-CG2 3.27Å; V290-L294 HydrophobicContact CG1-CB 3.73Å; V290-L294 HydrophobicContact CG1-CD2 3.82Å; V290-L294 HydrophobicContact CG1-CG 3.63Å
291	S	92.3	Very high	92.5	Very high	79 Å²	79	52.5 Å²	52.5	55%	0.552	29%	0.285	S	S	*	.			trans	-67.7	145.6	173.7	71.5	0	0	0	0	110.7	K293 L294 S295	S291-K293 PolarHBondContact O-N 2.93Å; S291-L294 WeakPolarHBondContact O-CA 3.19Å; S291-L294 PolarHBondContact O-N 2.82Å; S291-L294 WeakPolarHBondContact OG-CB 3.39Å; S291-S295 PolarHBondContact O-N 2.81Å; S291-S295 PolarHBondContact O-OG 2.86Å
292	R	89.8	Confident	92.6	Very high	162 Å²	162	51.5 Å²	51.5	61%	0.611	28%	0.278	S	S	*	.	H	α-helix	trans	-51.6	-50.9	-174.4	179.6	176.4	172.2	142.4	16.4	112.9	L294 S295 E296	R292-L294 PolarHBondContact O-N 2.92Å; R292-S295 WeakPolarHBondContact CA-OG 3.04Å; R292-S295 PolarHBondContact O-N 2.82Å; R292-S295 VanDerWaalsContact O-N 3.16Å; R292-S295 PolarHBondContact O-OG 3.25Å; R292-E296 HydrophobicContact CG-CG 4.48Å; R292-E296 WeakPolarHBondContact CG-OE1 3.27Å; R292-E296 IonicContact CZ-OE1 2.76Å; R292-E296 IonicContact NE-OE1 3.68Å; R292-E296 PolarHBondContact NE-OE1 3.29Å; R292-E296 IonicContact NH2-OE1 3.66Å; R292-E296 PolarHBondContact NH2-OE1 2.71Å; R292-E296 WeakPolarHBondContact O-CG 3.33Å; R292-E296 PolarHBondContact O-N 3.18Å
293	K	90.5	Very high	92.8	Very high	153 Å²	153	51.2 Å²	51.2	67%	0.665	28%	0.276	S	S	*	.	H	α-helix	trans	-57.3	-34.2	178.7	-176.5	-179.9	177.3	-174.1	0	112.5	S291 T297	S291-K293 PolarHBondContact O-N 2.93Å; K293-T297 WeakPolarHBondContact O-CG2 3.28Å
294	L	92.7	Very high	93	Very high	53 Å²	53	50.1 Å²	50.1	28%	0.277	27%	0.268	S	S	.	.	H	α-helix	trans	-80	-41.2	177.3	-179.5	57.2	0	0	0	111.4	K145 L147 V290 S291 R292 E296 T297	K145-L294 WeakPolarHBondContact O-CD1 3.49Å; L147-L294 HydrophobicContact CD1-CG 4.5Å; L147-L294 VanDerWaalsContact CD1-O 3.31Å; L147-L294 WeakPolarHBondContact CD1-O 3.42Å; L147-L294 HydrophobicContact CD2-CD1 3.92Å; L147-L294 HydrophobicContact CD2-CD2 4.29Å; L147-L294 HydrophobicContact CD2-CG 3.89Å; L147-L294 HydrophobicContact CG-CD1 3.76Å; L147-L294 HydrophobicContact CG-CG 3.9Å; L147-L294 WeakPolarHBondContact CG-O 3.49Å; V290-L294 HydrophobicContact CG1-CB 3.73Å; V290-L294 HydrophobicContact CG1-CD2 3.82Å; V290-L294 HydrophobicContact CG1-CG 3.63Å; S291-L294 WeakPolarHBondContact O-CA 3.19Å; S291-L294 PolarHBondContact O-N 2.82Å; S291-L294 WeakPolarHBondContact OG-CB 3.39Å; R292-L294 PolarHBondContact O-N 2.92Å; L294-E296 PolarHBondContact O-N 3.12Å; L294-T297 WeakPolarHBondContact O-CB 3.42Å; L294-T297 PolarHBondContact O-N 2.6Å; L294-T297 PolarHBondContact O-OG1 3.41Å
295	S	92	Very high	93.1	Very high	22 Å²	22	48.9 Å²	48.9	15%	0.154	26%	0.262	C	S	.	.	H	α-helix	trans	-60.2	-33.2	176.5	57.6	0	0	0	0	113.1	S291 R292 T297 N298	S291-S295 PolarHBondContact O-N 2.81Å; S291-S295 PolarHBondContact O-OG 2.86Å; R292-S295 WeakPolarHBondContact CA-OG 3.04Å; R292-S295 PolarHBondContact O-N 2.82Å; R292-S295 VanDerWaalsContact O-N 3.16Å; R292-S295 PolarHBondContact O-OG 3.25Å; S295-T297 PolarHBondContact O-N 3.03Å; S295-T297 VanDerWaalsContact O-N 3.16Å; S295-N298 PolarHBondContact O-N 2.82Å; S295-N298 PolarHBondContact O-ND2 3.12Å
296	E	91.6	Very high	93.2	Very high	41 Å²	41	48.9 Å²	48.9	19%	0.192	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-4.1	176.3	-69.4	170.4	173.3	0	0	113.5	R292 L294 R301 Q326	R292-E296 HydrophobicContact CG-CG 4.48Å; R292-E296 WeakPolarHBondContact CG-OE1 3.27Å; R292-E296 IonicContact CZ-OE1 2.76Å; R292-E296 IonicContact NE-OE1 3.68Å; R292-E296 PolarHBondContact NE-OE1 3.29Å; R292-E296 IonicContact NH2-OE1 3.66Å; R292-E296 PolarHBondContact NH2-OE1 2.71Å; R292-E296 WeakPolarHBondContact O-CG 3.33Å; R292-E296 PolarHBondContact O-N 3.18Å; L294-E296 PolarHBondContact O-N 3.12Å; E296-R301 VanDerWaalsContact O-CB 3.27Å; E296-R301 WeakPolarHBondContact O-CB 3.42Å; E296-Q326 PolarHBondContact OE2-NE2 3Å
297	T	95.1	Very high	93.6	Very high	24 Å²	24	47 Å²	47	15%	0.147	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100	12.4	175.4	71.4	0	0	0	0	113.6	L146 L147 C148 K293 L294 S295 R302	L146-T297 HydrophobicContact CD2-CG2 3.66Å; L147-T297 PolarHBondContact N-OG1 3.41Å; C148-T297 PolarHBondContact N-O 2.89Å; K293-T297 WeakPolarHBondContact O-CG2 3.28Å; L294-T297 WeakPolarHBondContact O-CB 3.42Å; L294-T297 PolarHBondContact O-N 2.6Å; L294-T297 PolarHBondContact O-OG1 3.41Å; S295-T297 PolarHBondContact O-N 3.03Å; S295-T297 VanDerWaalsContact O-N 3.16Å; T297-R302 WeakPolarHBondContact O-CG 3.44Å
298	N	95.3	Very high	94	Very high	3 Å²	3	43.6 Å²	43.6	2%	0.016	22%	0.222	C	C	.	.	S	Bend	trans	-63.3	156.3	175.7	72.5	77.2	0	0	0	112.5	L147 E280 L284 S295 I300 R301 R302	L147-N298 HydrophobicContact CD1-CB 4.36Å; E280-N298 PolarHBondContact OE1-ND2 3.32Å; L284-N298 HydrophobicContact CD2-CB 3.91Å; L284-N298 HydrophobicContact CG-CB 4.33Å; S295-N298 PolarHBondContact O-N 2.82Å; S295-N298 PolarHBondContact O-ND2 3.12Å; N298-I300 PolarHBondContact O-N 3.42Å; N298-I300 VanDerWaalsContact O-N 3.1Å; N298-I300 WeakPolarHBondContact OD1-CA 3.25Å; N298-I300 WeakPolarHBondContact OD1-CB 3.13Å; N298-I300 PolarHBondContact OD1-N 3.01Å; N298-R301 VanDerWaalsContact ND2-CG 3.33Å; N298-R301 WeakPolarHBondContact ND2-CG 3.48Å; N298-R301 CarbonylContact O-C 3.43Å; N298-R301 PolarHBondContact O-N 3.46Å; N298-R301 PolarHBondContact OD1-N 3.46Å; N298-R302 WeakPolarHBondContact O-CG 3.36Å; N298-R302 PolarHBondContact O-N 2.93Å
299	V	96.8	Very high	94.5	Very high	7 Å²	7	43.7 Å²	43.7	4%	0.042	21%	0.208	C	C	.	.	H	α-helix	trans	-53.7	-33	-176.1	67.7	0	0	0	0	114.2	C148 L156 Y196 R302 I303	C148-V299 HydrophobicContact CB-CB 4.06Å; L156-V299 HydrophobicContact CD1-CG2 3.75Å; Y196-V299 HydrophobicContact CD1-CG1 3.97Å; Y196-V299 HydrophobicContact CD2-CB 4.25Å; Y196-V299 HydrophobicContact CD2-CG1 3.93Å; Y196-V299 HydrophobicContact CD2-CG2 3.8Å; Y196-V299 HydrophobicContact CE1-CG1 3.73Å; Y196-V299 HydrophobicContact CE2-CB 4.3Å; Y196-V299 HydrophobicContact CE2-CG1 3.69Å; Y196-V299 HydrophobicContact CE2-CG2 4.35Å; Y196-V299 HydrophobicContact CG-CG1 4.07Å; Y196-V299 HydrophobicContact CG-CG2 3.91Å; V299-R302 WeakPolarHBondContact O-CB 3.28Å; V299-R302 PolarHBondContact O-N 3.08Å; V299-I303 HydrophobicContact CG2-CD1 3.78Å; V299-I303 HydrophobicContact CG2-CG1 4.33Å; V299-I303 WeakPolarHBondContact O-CB 3.22Å; V299-I303 VanDerWaalsContact O-CG1 3.31Å; V299-I303 WeakPolarHBondContact O-CG1 3.44Å; V299-I303 PolarHBondContact O-N 2.85Å
300	I	97.7	Very high	94.8	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-73.7	-39.4	-179.8	-50.4	-59.1	0	0	0	110.5	L193 L276 M279 E280 N298 R302 F304 F328	L193-I300 HydrophobicContact CD1-CD1 3.82Å; L276-I300 HydrophobicContact CD2-CG2 4.22Å; M279-I300 HydrophobicContact CB-CD1 3.9Å; M279-I300 HydrophobicContact CB-CG1 3.95Å; M279-I300 HydrophobicContact CB-CG2 4.32Å; E280-I300 HydrophobicContact CB-CB 4.39Å; N298-I300 PolarHBondContact O-N 3.42Å; N298-I300 VanDerWaalsContact O-N 3.1Å; N298-I300 WeakPolarHBondContact OD1-CA 3.25Å; N298-I300 WeakPolarHBondContact OD1-CB 3.13Å; N298-I300 PolarHBondContact OD1-N 3.01Å; I300-R302 VanDerWaalsContact C-N 3.32Å; I300-F304 HydrophobicContact CG2-CD2 4.04Å; I300-F304 PolarHBondContact O-N 3.3Å; I300-F328 HydrophobicContact CG2-CE1 4.08Å; I300-F328 HydrophobicContact CG2-CZ 4.34Å
301	R	96.6	Very high	95.2	Very high	7 Å²	7	34.2 Å²	34.2	3%	0.026	17%	0.166	C	C	.	.	H	α-helix	trans	-70.5	-26.2	169.7	-66.9	-73.6	175.6	169.9	-1.4	113	E280 E296 N298 G305 F328	E280-R301 VanDerWaalsContact CD-NE 3.34Å; E280-R301 WeakPolarHBondContact OE1-CD 3.48Å; E280-R301 WeakPolarHBondContact OE1-CG 3.31Å; E280-R301 IonicContact OE1-CZ 2.74Å; E280-R301 IonicContact OE1-NE 3.8Å; E280-R301 PolarHBondContact OE1-NE 2.86Å; E280-R301 IonicContact OE1-NH2 3.58Å; E280-R301 IonicContact OE2-CZ 2.7Å; E280-R301 IonicContact OE2-NE 3.17Å; E280-R301 PolarHBondContact OE2-NE 3.35Å; E280-R301 IonicContact OE2-NH2 3.33Å; E280-R301 PolarHBondContact OE2-NH2 3.07Å; E296-R301 VanDerWaalsContact O-CB 3.27Å; E296-R301 WeakPolarHBondContact O-CB 3.42Å; N298-R301 VanDerWaalsContact ND2-CG 3.33Å; N298-R301 WeakPolarHBondContact ND2-CG 3.48Å; N298-R301 CarbonylContact O-C 3.43Å; N298-R301 PolarHBondContact O-N 3.46Å; N298-R301 PolarHBondContact OD1-N 3.46Å; R301-G305 WeakPolarHBondContact O-CA 3.41Å; R301-G305 PolarHBondContact O-N 3.37Å; R301-F328 VanDerWaalsContact CZ-CZ 3.46Å; R301-F328 VanDerWaalsContact NE-CZ 3.34Å
302	R	96.6	Very high	95.4	Very high	21 Å²	21	31.1 Å²	31.1	8%	0.079	14%	0.144	C	C	.	.	H	α-helix	trans	-71.7	-42.2	172.8	-71.8	-55.4	-56.3	-110	13	112.4	C148 D150 L153 T297 N298 V299 I300 P381	C148-R302 HydrophobicContact CB-CG 3.88Å; C148-R302 PolarHBondContact O-NH1 3.3Å; D150-R302 IonicContact OD1-CZ 3.7Å; D150-R302 IonicContact OD1-NH1 2.77Å; D150-R302 PolarHBondContact OD1-NH1 3.31Å; D150-R302 IonicContact OD1-NH2 3.77Å; D150-R302 PolarHBondContact OD1-NH2 2.95Å; L153-R302 HydrophobicContact CD1-CB 3.95Å; L153-R302 HydrophobicContact CD2-CB 4.04Å; L153-R302 HydrophobicContact CG-CB 4.47Å; T297-R302 WeakPolarHBondContact O-CG 3.44Å; N298-R302 WeakPolarHBondContact O-CG 3.36Å; N298-R302 PolarHBondContact O-N 2.93Å; V299-R302 WeakPolarHBondContact O-CB 3.28Å; V299-R302 PolarHBondContact O-N 3.08Å; I300-R302 VanDerWaalsContact C-N 3.32Å; R302-P381 WeakPolarHBondContact O-CD 3.48Å
303	I	97.7	Very high	95.7	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-79.6	-48.5	-179.6	-65.9	168.7	0	0	0	112.6	L153 P192 V299 P381 I382	L153-I303 HydrophobicContact CD1-CG1 3.71Å; P192-I303 HydrophobicContact CB-CD1 4.11Å; P192-I303 HydrophobicContact CB-CG1 4.25Å; P192-I303 HydrophobicContact CB-CG2 4.24Å; V299-I303 HydrophobicContact CG2-CD1 3.78Å; V299-I303 HydrophobicContact CG2-CG1 4.33Å; V299-I303 WeakPolarHBondContact O-CB 3.22Å; V299-I303 VanDerWaalsContact O-CG1 3.31Å; V299-I303 WeakPolarHBondContact O-CG1 3.44Å; V299-I303 PolarHBondContact O-N 2.85Å; I303-P381 VanDerWaalsContact O-CD 3.3Å; I303-P381 WeakPolarHBondContact O-CD 3.45Å; I303-I382 HydrophobicContact CG2-CB 4.18Å; I303-I382 HydrophobicContact CG2-CG1 3.61Å; I303-I382 PolarHBondContact O-N 2.75Å
304	F	98.1	Very high	96.1	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.5	-16.9	-171.7	-60.4	-86.7	0	0	0	114.1	I187 T190 L193 L276 I300 G306 F328 I382 I384	I187-F304 HydrophobicContact CD1-CZ 4.4Å; T190-F304 HydrophobicContact CG2-CE1 3.85Å; T190-F304 HydrophobicContact CG2-CZ 3.68Å; L193-F304 HydrophobicContact CB-CE2 4.27Å; L193-F304 HydrophobicContact CB-CZ 4.28Å; L193-F304 HydrophobicContact CD1-CE2 4.49Å; L193-F304 HydrophobicContact CD2-CE2 4.04Å; L193-F304 HydrophobicContact CD2-CZ 3.9Å; L193-F304 HydrophobicContact CG-CE2 4.5Å; L276-F304 HydrophobicContact CD2-CB 4.09Å; L276-F304 HydrophobicContact CD2-CD1 3.92Å; L276-F304 HydrophobicContact CD2-CD2 3.58Å; L276-F304 HydrophobicContact CD2-CE1 4.15Å; L276-F304 HydrophobicContact CD2-CE2 3.85Å; L276-F304 HydrophobicContact CD2-CG 3.61Å; L276-F304 HydrophobicContact CD2-CZ 4.12Å; I300-F304 HydrophobicContact CG2-CD2 4.04Å; I300-F304 PolarHBondContact O-N 3.3Å; F304-G306 PolarHBondContact O-N 3.05Å; F304-F328 HydrophobicContact CB-CD1 3.86Å; F304-F328 HydrophobicContact CB-CE1 4.34Å; F304-I382 HydrophobicContact CD1-CB 3.85Å; F304-I382 HydrophobicContact CD1-CG2 3.65Å; F304-I382 HydrophobicContact CE1-CB 4.07Å; F304-I382 HydrophobicContact CE1-CG2 3.62Å; F304-I384 HydrophobicContact CD1-CD1 3.78Å; F304-I384 HydrophobicContact CD1-CG1 4.41Å; F304-I384 HydrophobicContact CE1-CD1 4.23Å
305	G	96.1	Very high	96.2	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.102	C	C	.	.			trans	-80.8	108.7	-172.5	0	0	0	0	0	112.3	R301 C327 R378	R301-G305 WeakPolarHBondContact O-CA 3.41Å; R301-G305 PolarHBondContact O-N 3.37Å; G305-C327 CarbonylContact C-O 3.54Å; G305-C327 WeakPolarHBondContact CA-O 3.43Å; G305-R378 PolarHBondContact O-NH1 3.37Å; G305-R378 PolarHBondContact O-NH2 3.26Å
306	G	95.9	Very high	96.4	Very high	3 Å²	3	21.9 Å²	21.9	3%	0.031	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	175.2	166.1	0	0	0	0	0	112.7	F304 Q326 C327 R378	F304-G306 PolarHBondContact O-N 3.05Å; G306-Q326 WeakPolarHBondContact O-CA 3.35Å; G306-C327 PolarHBondContact N-O 3.32Å; G306-C327 PolarHBondContact O-N 3.22Å; G306-R378 CarbonylContact C-O 3.55Å; G306-R378 WeakPolarHBondContact CA-O 3.45Å
307	V	96.9	Very high	96.6	Very high	15 Å²	15	21.9 Å²	21.9	9%	0.091	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	128.9	171.3	-173.7	0	0	0	0	109.6	D324 E325 Q326 Y377 R378	V307-D324 HydrophobicContact CG1-CB 3.82Å; V307-E325 CarbonylContact C-O 3.46Å; V307-E325 WeakPolarHBondContact CA-O 3.5Å; V307-Q326 HydrophobicContact CG2-CG 4.33Å; V307-Y377 HydrophobicContact CB-CD1 4.35Å; V307-Y377 HydrophobicContact CG1-CD1 4Å; V307-Y377 PolarHBondContact O-N 2.88Å; V307-R378 HydrophobicContact CB-CB 3.94Å; V307-R378 HydrophobicContact CG2-CB 3.94Å; V307-R378 PolarHBondContact N-O 3.09Å; V307-R378 PolarHBondContact O-N 3.4Å; V307-R378 VanDerWaalsContact O-N 3.1Å
308	I	97.3	Very high	96.7	Very high	13 Å²	13	26.8 Å²	26.8	7%	0.067	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	134.6	173.4	-55.4	-53.9	0	0	0	108.9	D324 E325 C327 L330 Y347 C374 T375 I376	I308-D324 CarbonylContact O-C 3.6Å; I308-D324 WeakPolarHBondContact O-CA 3.5Å; I308-E325 PolarHBondContact N-O 2.79Å; I308-E325 PolarHBondContact O-N 3.48Å; I308-C327 HydrophobicContact CG1-CB 4.47Å; I308-L330 HydrophobicContact CD1-CD2 3.62Å; I308-L330 HydrophobicContact CG1-CD2 4.47Å; I308-Y347 HydrophobicContact CD1-CE1 4.34Å; I308-C374 HydrophobicContact CG2-CB 4.34Å; I308-T375 WeakPolarHBondContact CA-O 3.14Å; I308-I376 HydrophobicContact CD1-CB 4.42Å; I308-I376 HydrophobicContact CD1-CG1 3.95Å
309	R	97.2	Very high	96.7	Very high	47 Å²	47	30.2 Å²	30.2	18%	0.177	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	121.6	168.8	179	161.6	-64.5	172.4	0.9	109.7	E311 R323 D324 C374 T375 Y377	R309-E311 WeakPolarHBondContact CD-OE1 3.3Å; R309-E311 HydrophobicContact CG-CG 3.98Å; R309-R323 WeakPolarHBondContact CA-O 3.25Å; R309-D324 WeakPolarHBondContact CB-OD1 3.31Å; R309-D324 WeakPolarHBondContact CG-OD1 3.28Å; R309-D324 IonicContact CZ-OD1 3.39Å; R309-D324 IonicContact CZ-OD2 3.16Å; R309-D324 IonicContact NE-OD1 2.72Å; R309-D324 PolarHBondContact NE-OD1 3.03Å; R309-D324 IonicContact NE-OD2 2.79Å; R309-D324 IonicContact NH2-OD1 3.23Å; R309-D324 PolarHBondContact NH2-OD1 3.09Å; R309-D324 IonicContact NH2-OD2 2.7Å; R309-D324 PolarHBondContact NH2-OD2 3.11Å; R309-C374 CarbonylContact O-C 3.6Å; R309-C374 WeakPolarHBondContact O-CA 3.31Å; R309-T375 PolarHBondContact N-O 3.29Å; R309-T375 PolarHBondContact O-N 2.96Å; R309-Y377 VanDerWaalsContact NH2-CZ 3.34Å
310	S	96.1	Very high	96.6	Very high	18 Å²	18	33.8 Å²	33.8	13%	0.126	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	117.8	164.9	-170	0	0	0	0	108.9	A322 R323 R372 K373	S310-A322 CarbonylContact O-C 3.32Å; S310-A322 WeakPolarHBondContact O-CA 3.41Å; S310-R323 PolarHBondContact N-O 3.3Å; S310-R323 PolarHBondContact O-N 3.49Å; S310-R372 PolarHBondContact OG-NE 3.31Å; S310-K373 WeakPolarHBondContact CA-O 3.33Å
311	E	96.4	Very high	96.5	Very high	50 Å²	50	34.9 Å²	34.9	23%	0.234	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	136.8	172.7	-79.3	156	-168.8	0	0	109.1	R309 V320 A322 R372 K373	R309-E311 WeakPolarHBondContact CD-OE1 3.3Å; R309-E311 HydrophobicContact CG-CG 3.98Å; E311-V320 HydrophobicContact CB-CG1 4.37Å; E311-V320 HydrophobicContact CG-CG1 4.34Å; E311-A322 HydrophobicContact CG-CB 3.94Å; E311-R372 CarbonylContact O-C 3.59Å; E311-R372 VanDerWaalsContact O-CA 3.3Å; E311-R372 WeakPolarHBondContact O-CA 3.44Å; E311-K373 PolarHBondContact N-O 2.93Å; E311-K373 PolarHBondContact O-N 2.99Å
312	V	96.7	Very high	96.4	Very high	14 Å²	14	37.6 Å²	37.6	9%	0.085	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	114.3	176.7	-176	0	0	0	0	109.5	S321 L353 Y359 A370 M371 R372	V312-S321 PolarHBondContact N-O 3.48Å; V312-S321 PolarHBondContact O-N 3.43Å; V312-L353 HydrophobicContact CG1-CD1 4.15Å; V312-Y359 HydrophobicContact CG1-CD1 3.62Å; V312-Y359 HydrophobicContact CG1-CD2 3.95Å; V312-Y359 HydrophobicContact CG1-CE1 3.89Å; V312-Y359 HydrophobicContact CG1-CE2 4.24Å; V312-Y359 HydrophobicContact CG1-CG 3.65Å; V312-A370 HydrophobicContact CG1-CB 3.68Å; V312-M371 CarbonylContact C-O 3.58Å; V312-M371 WeakPolarHBondContact CA-O 3.3Å; V312-R372 HydrophobicContact CG2-CB 4.13Å; V312-R372 HydrophobicContact CG2-CG 4Å
313	T	97.3	Very high	96.4	Very high	45 Å²	45	42 Å²	42	28%	0.276	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	115.8	-179.3	-53.9	0	0	0	0	109.8	H315 V320 A370 M371	T313-H315 PolarHBondContact O-N 3.25Å; T313-V320 HydrophobicContact CG2-CG2 4.19Å; T313-A370 CarbonylContact O-C 3.59Å; T313-A370 WeakPolarHBondContact O-CA 3.33Å; T313-A370 VanDerWaalsContact O-CB 3.31Å; T313-A370 WeakPolarHBondContact O-CB 3.33Å; T313-M371 PolarHBondContact N-O 2.75Å; T313-M371 PolarHBondContact O-N 2.96Å
314	C	97.3	Very high	96.3	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	124.6	177.4	-179.3	0	0	0	0	111.1	S316 L318 K319 C361	C314-S316 VanDerWaalsContact C-N 3.26Å; C314-S316 PolarHBondContact O-N 3.39Å; C314-L318 WeakPolarHBondContact O-CA 3.29Å; C314-L318 PolarHBondContact O-N 3.11Å; C314-K319 PolarHBondContact N-O 3.42Å; C314-K319 VanDerWaalsContact N-O 3.13Å; C314-C361 HydrophobicContact CB-CB 4.23Å; C314-C361 VanDerWaalsContact SG-SG 3.67Å
315	H	96.2	Very high	96.1	Very high	86 Å²	86	46.9 Å²	46.9	40%	0.398	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-28.8	179.3	-71.9	111.1	0	0	0	113.1	T313 A369 A370 M371	T313-H315 PolarHBondContact O-N 3.25Å; H315-A369 HydrophobicContact CB-CB 4.46Å; H315-A369 WeakPolarHBondContact CB-O 3.49Å; H315-A369 PolarHBondContact N-O 2.92Å; H315-A369 VanDerWaalsContact ND1-C 3.26Å; H315-A369 PolarHBondContact ND1-O 3.03Å; H315-A370 VanDerWaalsContact CE1-C 3.44Å; H315-A370 WeakPolarHBondContact ND1-CA 3.5Å; H315-A370 PolarHBondContact ND1-N 3.29Å; H315-M371 PolarHBondContact CE1-N 3.48Å
316	S	95.9	Very high	96	Very high	65 Å²	65	50 Å²	50	46%	0.455	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-16.9	-175.4	-56.3	0	0	0	0	115.4	C314 R368	C314-S316 VanDerWaalsContact C-N 3.26Å; C314-S316 PolarHBondContact O-N 3.39Å; S316-R368 WeakPolarHBondContact OG-CD 3.41Å; S316-R368 PolarHBondContact OG-NH1 2.91Å
317	C	96.4	Very high	96	Very high	42 Å²	42	51.2 Å²	51.2	28%	0.284	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.1	6.1	-179.1	77.5	0	0	0	0	114.2	K319 C361 C364	C317-K319 PolarHBondContact O-N 3.05Å; C317-C361 VanDerWaalsContact SG-SG 3.66Å; C317-C364 VanDerWaalsContact SG-SG 3.66Å
318	L	96	Very high	96	Very high	126 Å²	126	50.9 Å²	50.9	66%	0.66	28%	0.275	S	S	*	.			trans	55.7	1.2	177.7	-50.5	-178.4	0	0	0	116.9	C314 V320	C314-L318 WeakPolarHBondContact O-CA 3.29Å; C314-L318 PolarHBondContact O-N 3.11Å; L318-V320 PolarHBondContact O-N 3.24Å; L318-V320 VanDerWaalsContact O-N 3.1Å
319	K	95.4	Very high	96	Very high	75 Å²	75	51.1 Å²	51.1	33%	0.326	28%	0.276	S	S	.	.			trans	-56	117.9	172.9	-178	-177.2	178.4	-173.6	0	109.5	C314 C317 E362 N363	C314-K319 PolarHBondContact N-O 3.42Å; C314-K319 VanDerWaalsContact N-O 3.13Å; C317-K319 PolarHBondContact O-N 3.05Å; K319-E362 IonicContact NZ-OE2 3.6Å; K319-E362 PolarHBondContact NZ-OE2 2.95Å; K319-N363 HydrophobicContact CD-CB 3.99Å
320	V	95.6	Very high	96	Very high	83 Å²	83	49 Å²	49	50%	0.503	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	127.9	167.7	-171.8	0	0	0	0	108.7	E311 T313 L318	E311-V320 HydrophobicContact CB-CG1 4.37Å; E311-V320 HydrophobicContact CG-CG1 4.34Å; T313-V320 HydrophobicContact CG2-CG2 4.19Å; L318-V320 PolarHBondContact O-N 3.24Å; L318-V320 VanDerWaalsContact O-N 3.1Å
321	S	94.8	Very high	96	Very high	22 Å²	22	49.8 Å²	49.8	15%	0.154	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	103	174.4	-63.8	0	0	0	0	108.7	V312 Y359	V312-S321 PolarHBondContact N-O 3.48Å; V312-S321 PolarHBondContact O-N 3.43Å; S321-Y359 WeakPolarHBondContact CB-OH 3.44Å; S321-Y359 PolarHBondContact OG-OH 3.1Å
322	A	95.2	Very high	95.9	Very high	65 Å²	65	47.4 Å²	47.4	54%	0.537	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	140	177.7	0	0	0	0	0	111.6	S310 E311	S310-A322 CarbonylContact O-C 3.32Å; S310-A322 WeakPolarHBondContact O-CA 3.41Å; E311-A322 HydrophobicContact CG-CB 3.94Å
323	R	95.2	Very high	95.8	Very high	113 Å²	113	48.3 Å²	48.3	43%	0.426	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	128.3	174.8	-171.6	-177.1	-169.8	-154.5	-3	110.7	R309 S310 E325	R309-R323 WeakPolarHBondContact CA-O 3.25Å; S310-R323 PolarHBondContact N-O 3.3Å; S310-R323 PolarHBondContact O-N 3.49Å; R323-E325 WeakPolarHBondContact CD-OE1 3.47Å; R323-E325 HydrophobicContact CG-CG 4.18Å; R323-E325 IonicContact CZ-OE1 2.94Å; R323-E325 IonicContact NE-OE1 2.72Å; R323-E325 PolarHBondContact NE-OE1 3.39Å; R323-E325 IonicContact NH1-OE1 3.01Å; R323-E325 PolarHBondContact NH1-OE1 2.7Å; R323-E325 IonicContact NH2-OE1 3.32Å
324	D	95.8	Very high	95.7	Very high	74 Å²	74	46.1 Å²	46.1	40%	0.396	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	128.2	175.1	-69.4	-13.9	0	0	0	110.5	V307 I308 R309	V307-D324 HydrophobicContact CG1-CB 3.82Å; I308-D324 CarbonylContact O-C 3.6Å; I308-D324 WeakPolarHBondContact O-CA 3.5Å; R309-D324 WeakPolarHBondContact CB-OD1 3.31Å; R309-D324 WeakPolarHBondContact CG-OD1 3.28Å; R309-D324 IonicContact CZ-OD1 3.39Å; R309-D324 IonicContact CZ-OD2 3.16Å; R309-D324 IonicContact NE-OD1 2.72Å; R309-D324 PolarHBondContact NE-OD1 3.03Å; R309-D324 IonicContact NE-OD2 2.79Å; R309-D324 IonicContact NH2-OD1 3.23Å; R309-D324 PolarHBondContact NH2-OD1 3.09Å; R309-D324 IonicContact NH2-OD2 2.7Å; R309-D324 PolarHBondContact NH2-OD2 3.11Å
325	E	94.2	Very high	95.4	Very high	29 Å²	29	48.9 Å²	48.9	14%	0.136	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	133.4	-176.7	-59.8	-167.4	151.9	0	0	110.5	H14 V307 I308 R323	H14-E325 IonicContact CD2-OE2 3.16Å; H14-E325 IonicContact CE1-OE2 2.66Å; H14-E325 IonicContact NE2-OE2 2.8Å; H14-E325 PolarHBondContact NE2-OE2 2.93Å; V307-E325 CarbonylContact C-O 3.46Å; V307-E325 WeakPolarHBondContact CA-O 3.5Å; I308-E325 PolarHBondContact N-O 2.79Å; I308-E325 PolarHBondContact O-N 3.48Å; R323-E325 WeakPolarHBondContact CD-OE1 3.47Å; R323-E325 HydrophobicContact CG-CG 4.18Å; R323-E325 IonicContact CZ-OE1 2.94Å; R323-E325 IonicContact NE-OE1 2.72Å; R323-E325 PolarHBondContact NE-OE1 3.39Å; R323-E325 IonicContact NH1-OE1 3.01Å; R323-E325 PolarHBondContact NH1-OE1 2.7Å; R323-E325 IonicContact NH2-OE1 3.32Å
326	Q	94.4	Very high	95.2	Very high	65 Å²	65	49.3 Å²	49.3	30%	0.304	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	132	-176.8	-64.3	178.7	22.3	0	0	111.2	E296 G306 V307	E296-Q326 PolarHBondContact OE2-NE2 3Å; G306-Q326 WeakPolarHBondContact O-CA 3.35Å; V307-Q326 HydrophobicContact CG2-CG 4.33Å
327	C	95.6	Very high	95.1	Very high	28 Å²	28	46.3 Å²	46.3	19%	0.189	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	149	-177.2	63.9	0	0	0	0	111.6	G305 G306 I308	G305-C327 CarbonylContact C-O 3.54Å; G305-C327 WeakPolarHBondContact CA-O 3.43Å; G306-C327 PolarHBondContact N-O 3.32Å; G306-C327 PolarHBondContact O-N 3.22Å; I308-C327 HydrophobicContact CG1-CB 4.47Å
328	F	97.1	Very high	95	Very high	8 Å²	8	52 Å²	52	4%	0.035	28%	0.277	C	S	.	.	S	Bend	trans	-93.8	-18.6	167.3	-76.8	-54.6	0	0	0	113.1	L273 L276 I300 R301 F304	L273-F328 HydrophobicContact CD2-CB 3.75Å; L273-F328 HydrophobicContact CD2-CD2 4.39Å; L276-F328 HydrophobicContact CB-CD2 4.11Å; L276-F328 HydrophobicContact CB-CE2 4.16Å; L276-F328 HydrophobicContact CB-CG 4.29Å; L276-F328 HydrophobicContact CB-CZ 4.38Å; L276-F328 HydrophobicContact CD1-CB 4.07Å; L276-F328 HydrophobicContact CD1-CG 4.27Å; I300-F328 HydrophobicContact CG2-CE1 4.08Å; I300-F328 HydrophobicContact CG2-CZ 4.34Å; R301-F328 VanDerWaalsContact CZ-CZ 3.46Å; R301-F328 VanDerWaalsContact NE-CZ 3.34Å; F304-F328 HydrophobicContact CB-CD1 3.86Å; F304-F328 HydrophobicContact CB-CE1 4.34Å
329	N	97.4	Very high	95.1	Very high	18 Å²	18	47.4 Å²	47.4	10%	0.096	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	163.9	177.1	77.3	-81.3	0	0	0	111.2	H269 S331 I384	H269-N329 VanDerWaalsContact NE2-CG 3.31Å; H269-N329 PolarHBondContact NE2-ND2 2.93Å; H269-N329 PolarHBondContact NE2-OD1 3.39Å; H269-N329 VanDerWaalsContact NE2-OD1 3.08Å; N329-S331 PolarHBondContact ND2-OG 2.93Å; N329-I384 CarbonylContact C-O 3.57Å; N329-I384 WeakPolarHBondContact CA-O 3.3Å; N329-I384 HydrophobicContact CB-CB 3.84Å; N329-I384 HydrophobicContact CB-CG2 3.74Å; N329-I384 WeakPolarHBondContact CB-O 3.06Å
330	L	97.2	Very high	95.2	Very high	3 Å²	3	44 Å²	44	2%	0.016	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	131.3	161.5	-53.2	-178.6	0	0	0	108.8	I308 M332 L344 I376 L383 I384 I385 Q386	I308-L330 HydrophobicContact CD1-CD2 3.62Å; I308-L330 HydrophobicContact CG1-CD2 4.47Å; L330-M332 HydrophobicContact CB-CE 3.84Å; L330-M332 HydrophobicContact CB-CG 4.48Å; L330-M332 HydrophobicContact CD1-CE 3.55Å; L330-M332 HydrophobicContact CG-CE 4.35Å; L330-L344 HydrophobicContact CD1-CD2 4.3Å; L330-I376 HydrophobicContact CD1-CD1 3.77Å; L330-L383 HydrophobicContact CD1-CD1 4.01Å; L330-L383 HydrophobicContact CG-CD1 4.06Å; L330-I384 PolarHBondContact N-O 2.95Å; L330-I385 HydrophobicContact CB-CG1 4.4Å; L330-I385 HydrophobicContact CD1-CG1 4.39Å; L330-I385 WeakPolarHBondContact O-CA 3.38Å; L330-Q386 PolarHBondContact O-N 2.94Å
331	S	95.9	Very high	95.2	Very high	34 Å²	34	44.4 Å²	44.4	24%	0.238	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	110.1	173.1	-65.1	0	0	0	0	108.8	N329 Q386	N329-S331 PolarHBondContact ND2-OG 2.93Å; S331-Q386 PolarHBondContact OG-OE1 2.83Å
332	M	94.7	Very high	95.3	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	138.9	-169	-65	-170.3	-174.2	0	0	112.6	L330 L340 C343 L344 I385 Q386 L387 N388	L330-M332 HydrophobicContact CB-CE 3.84Å; L330-M332 HydrophobicContact CB-CG 4.48Å; L330-M332 HydrophobicContact CD1-CE 3.55Å; L330-M332 HydrophobicContact CG-CE 4.35Å; M332-L340 HydrophobicContact CE-CD1 4.3Å; M332-L340 HydrophobicContact SD-CD1 3.72Å; M332-C343 HydrophobicContact CB-CB 4.18Å; M332-C343 HydrophobicContact CG-CB 4.45Å; M332-C343 HydrophobicContact SD-CB 3.59Å; M332-C343 VanDerWaalsContact SD-CB 3.59Å; M332-L344 HydrophobicContact CE-CD2 3.38Å; M332-L344 HydrophobicContact CE-CG 3.67Å; M332-L344 HydrophobicContact SD-CG 4.28Å; M332-I385 HydrophobicContact CE-CD1 3.91Å; M332-I385 HydrophobicContact CE-CG1 4.22Å; M332-I385 HydrophobicContact CE-CG2 3.63Å; M332-I385 HydrophobicContact CG-CG2 3.95Å; M332-I385 HydrophobicContact SD-CG2 3.61Å; M332-Q386 PolarHBondContact N-O 3.35Å; M332-L387 HydrophobicContact CB-CD2 4.22Å; M332-N388 PolarHBondContact N-OD1 2.88Å; M332-N388 WeakPolarHBondContact O-CB 3.3Å; M332-N388 PolarHBondContact O-N 3.03Å; M332-N388 PolarHBondContact O-OD1 2.89Å
333	D	93.7	Very high	95.4	Very high	33 Å²	33	44.7 Å²	44.7	18%	0.176	23%	0.225	C	C	.	.			trans	-85.9	130.9	174.8	-170.2	-15.4	0	0	0	110	T335 K586	D333-T335 WeakPolarHBondContact OD1-CB 3.46Å; D333-T335 WeakPolarHBondContact OD1-CG2 3.35Å; D333-T335 PolarHBondContact OD1-N 3.4Å; D333-T335 PolarHBondContact OD1-OG1 2.92Å; D333-K586 WeakPolarHBondContact OD2-CE 3.48Å; D333-K586 IonicContact OD2-NZ 3.91Å
334	I	94.7	Very high	95.4	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.205	C	C	.	.			trans	-114.9	2.7	-174.3	64.7	173.1	0	0	0	113.1	C336 L387 R389 L396 V400	I334-C336 PolarHBondContact O-N 3.35Å; I334-L387 HydrophobicContact CG2-CB 3.94Å; I334-L387 HydrophobicContact CG2-CD2 3.95Å; I334-L387 HydrophobicContact CG2-CG 4.36Å; I334-R389 HydrophobicContact CD1-CG 3.76Å; I334-L396 HydrophobicContact CD1-CB 4.01Å; I334-L396 HydrophobicContact CG1-CB 4.38Å; I334-L396 HydrophobicContact CG1-CD1 4.04Å; I334-V400 HydrophobicContact CB-CG2 3.93Å; I334-V400 HydrophobicContact CD1-CG2 4.49Å; I334-V400 HydrophobicContact CG2-CG2 3.95Å
335	T	92.7	Very high	95.5	Very high	57 Å²	57	38.6 Å²	38.6	35%	0.35	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-46.5	179.4	50	0	0	0	0	111.9	D333 L396	D333-T335 WeakPolarHBondContact OD1-CB 3.46Å; D333-T335 WeakPolarHBondContact OD1-CG2 3.35Å; D333-T335 PolarHBondContact OD1-N 3.4Å; D333-T335 PolarHBondContact OD1-OG1 2.92Å; T335-L396 HydrophobicContact CG2-CD1 3.94Å
336	C	91.4	Very high	95.5	Very high	96 Å²	96	39.8 Å²	39.8	65%	0.649	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-113.5	35.9	-177.9	-60	0	0	0	0	112.8	I334 N346	I334-C336 PolarHBondContact O-N 3.35Å; C336-N346 PolarHBondContact O-ND2 3.07Å
337	A	92.7	Very high	95.6	Very high	2 Å²	2	38.9 Å²	38.9	2%	0.017	21%	0.206	C	C	.	.			trans	-145.9	139.2	177.2	0	0	0	0	0	112.1	Q342 C343	A337-Q342 HydrophobicContact CB-CB 3.84Å; A337-C343 HydrophobicContact CB-CB 4.47Å; A337-C343 VanDerWaalsContact CB-SG 3.51Å
338	R	95.2	Very high	95.6	Very high	162 Å²	162	38.7 Å²	38.7	61%	0.611	20%	0.204	S	C	*	.	S	Bend	trans	-113.8	-0.4	176	-58.5	-57.9	-179.7	91.1	0.4	113.4	V400 D401	R338-V400 CarbonylContact O-C 3.56Å; R338-V400 WeakPolarHBondContact O-CA 3.28Å; R338-D401 PolarHBondContact O-N 2.86Å
339	S	97.3	Very high	95.5	Very high	29 Å²	29	47.2 Å²	47.2	20%	0.203	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-144	157.8	170.4	70.9	0	0	0	0	112.6	Q341 Q342 C343 D401	S339-Q341 PolarHBondContact O-N 3.15Å; S339-Q342 WeakPolarHBondContact O-CA 3.36Å; S339-Q342 WeakPolarHBondContact O-CB 3.32Å; S339-Q342 PolarHBondContact O-N 3.05Å; S339-Q342 PolarHBondContact OG-N 3.04Å; S339-C343 PolarHBondContact O-N 3.28Å; S339-C343 PolarHBondContact O-SG 3.29Å; S339-D401 CarbonylContact C-O 3.59Å; S339-D401 WeakPolarHBondContact CA-O 3.3Å; S339-D401 WeakPolarHBondContact CB-O 3.49Å
340	L	97.3	Very high	95.4	Very high	2 Å²	2	49 Å²	49	1%	0.01	25%	0.25	C	S	.	.	H	α-helix	trans	-57	-35.2	175.9	-176.9	63.9	0	0	0	111.8	M332 C343 L344 I385 L387 D401 F402 F406 L474 Y476	M332-L340 HydrophobicContact CE-CD1 4.3Å; M332-L340 HydrophobicContact SD-CD1 3.72Å; L340-C343 WeakPolarHBondContact O-CB 3.33Å; L340-C343 PolarHBondContact O-N 2.65Å; L340-L344 HydrophobicContact CG-CD1 4.14Å; L340-L344 WeakPolarHBondContact O-CB 3.38Å; L340-L344 WeakPolarHBondContact O-CG 3.32Å; L340-L344 PolarHBondContact O-N 3.27Å; L340-I385 HydrophobicContact CD1-CD1 4.02Å; L340-I385 HydrophobicContact CD1-CG2 4.16Å; L340-I385 HydrophobicContact CD2-CD1 4.27Å; L340-L387 HydrophobicContact CD1-CD2 4.49Å; L340-D401 PolarHBondContact N-O 3.46Å; L340-F402 HydrophobicContact CB-CB 4.17Å; L340-F402 HydrophobicContact CD2-CB 4.35Å; L340-F406 HydrophobicContact CD2-CD1 4.42Å; L340-F406 HydrophobicContact CD2-CE1 4.19Å; L340-L474 HydrophobicContact CD1-CD1 4.04Å; L340-L474 HydrophobicContact CD2-CD1 4.11Å; L340-Y476 HydrophobicContact CD2-CE2 3.89Å
341	Q	96.2	Very high	95.2	Very high	93 Å²	93	50.9 Å²	50.9	44%	0.435	26%	0.258	S	S	.	.	H	α-helix	trans	-61.4	-43.9	174	-173	70.9	1.2	0	0	111.2	S339 L344 C345	S339-Q341 PolarHBondContact O-N 3.15Å; Q341-L344 PolarHBondContact O-N 3.07Å; Q341-C345 PolarHBondContact O-N 2.95Å; Q341-C345 PolarHBondContact O-SG 2.87Å
342	Q	97.1	Very high	95.2	Very high	91 Å²	91	54.2 Å²	54.2	43%	0.425	27%	0.27	S	S	.	.	H	α-helix	trans	-68.3	-38.7	174.5	-70.2	174.3	-6.6	0	0	112	A337 S339 L344 C345 N346	A337-Q342 HydrophobicContact CB-CB 3.84Å; S339-Q342 WeakPolarHBondContact O-CA 3.36Å; S339-Q342 WeakPolarHBondContact O-CB 3.32Å; S339-Q342 PolarHBondContact O-N 3.05Å; S339-Q342 PolarHBondContact OG-N 3.04Å; Q342-L344 VanDerWaalsContact C-N 3.32Å; Q342-L344 PolarHBondContact O-N 3.22Å; Q342-C345 PolarHBondContact O-N 2.89Å; Q342-N346 WeakPolarHBondContact O-CB 3.48Å; Q342-N346 VanDerWaalsContact O-CG 3.29Å; Q342-N346 PolarHBondContact O-N 2.76Å
343	C	97.2	Very high	95.2	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.014	28%	0.276	C	S	.	.	H	α-helix	trans	-58.3	-44.5	173.5	-62.2	0	0	0	0	111.5	M332 A337 S339 L340 N346 Y347	M332-C343 HydrophobicContact CB-CB 4.18Å; M332-C343 HydrophobicContact CG-CB 4.45Å; M332-C343 HydrophobicContact SD-CB 3.59Å; M332-C343 VanDerWaalsContact SD-CB 3.59Å; A337-C343 HydrophobicContact CB-CB 4.47Å; A337-C343 VanDerWaalsContact CB-SG 3.51Å; S339-C343 PolarHBondContact O-N 3.28Å; S339-C343 PolarHBondContact O-SG 3.29Å; L340-C343 WeakPolarHBondContact O-CB 3.33Å; L340-C343 PolarHBondContact O-N 2.65Å; C343-N346 PolarHBondContact O-N 3.1Å; C343-Y347 WeakPolarHBondContact O-CB 3.48Å; C343-Y347 PolarHBondContact O-N 3.28Å
344	L	96.6	Very high	95.2	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-66.9	-43.6	176	-79.3	161.1	0	0	0	112.3	L330 M332 L340 Q341 Q342 N346 Y347 V348 I376 F406 L408 F411	L330-L344 HydrophobicContact CD1-CD2 4.3Å; M332-L344 HydrophobicContact CE-CD2 3.38Å; M332-L344 HydrophobicContact CE-CG 3.67Å; M332-L344 HydrophobicContact SD-CG 4.28Å; L340-L344 HydrophobicContact CG-CD1 4.14Å; L340-L344 WeakPolarHBondContact O-CB 3.38Å; L340-L344 WeakPolarHBondContact O-CG 3.32Å; L340-L344 PolarHBondContact O-N 3.27Å; Q341-L344 PolarHBondContact O-N 3.07Å; Q342-L344 VanDerWaalsContact C-N 3.32Å; Q342-L344 PolarHBondContact O-N 3.22Å; L344-N346 VanDerWaalsContact C-N 3.35Å; L344-N346 PolarHBondContact O-N 2.77Å; L344-Y347 WeakPolarHBondContact O-CB 3.39Å; L344-Y347 PolarHBondContact O-N 3.16Å; L344-Y347 VanDerWaalsContact O-N 3.16Å; L344-V348 PolarHBondContact O-N 3Å; L344-V348 VanDerWaalsContact O-N 3.1Å; L344-I376 HydrophobicContact CD2-CD1 4.39Å; L344-F406 HydrophobicContact CD1-CD2 4.08Å; L344-F406 HydrophobicContact CD1-CE2 3.55Å; L344-F406 HydrophobicContact CD1-CZ 4.21Å; L344-L408 HydrophobicContact CD2-CD1 4.28Å; L344-F411 HydrophobicContact CB-CD1 3.7Å; L344-F411 HydrophobicContact CB-CD2 3.9Å; L344-F411 HydrophobicContact CB-CE1 3.51Å; L344-F411 HydrophobicContact CB-CE2 3.7Å; L344-F411 HydrophobicContact CB-CG 3.88Å; L344-F411 HydrophobicContact CB-CZ 3.48Å; L344-F411 VanDerWaalsContact CB-CZ 3.48Å; L344-F411 HydrophobicContact CD1-CD2 3.91Å; L344-F411 HydrophobicContact CD1-CE2 3.71Å; L344-F411 HydrophobicContact CD1-CZ 4.28Å; L344-F411 HydrophobicContact CD2-CB 4.41Å; L344-F411 HydrophobicContact CD2-CD2 4.14Å; L344-F411 HydrophobicContact CD2-CG 4.15Å; L344-F411 HydrophobicContact CG-CD2 4.21Å; L344-F411 HydrophobicContact CG-CE2 4.21Å; L344-F411 HydrophobicContact CG-CG 4.45Å; L344-F411 HydrophobicContact CG-CZ 4.46Å
345	C	96.3	Very high	95	Very high	58 Å²	58	59.2 Å²	59.2	39%	0.392	32%	0.316	S	S	.	.	H	α-helix	trans	-56.7	-47.3	172.1	-72.3	0	0	0	0	111.7	Q341 Q342 Y347 V348 R349	Q341-C345 PolarHBondContact O-N 2.95Å; Q341-C345 PolarHBondContact O-SG 2.87Å; Q342-C345 PolarHBondContact O-N 2.89Å; C345-Y347 VanDerWaalsContact C-N 3.28Å; C345-Y347 PolarHBondContact O-N 2.66Å; C345-V348 PolarHBondContact O-N 2.88Å; C345-R349 WeakPolarHBondContact O-CB 3.3Å; C345-R349 PolarHBondContact O-N 3.07Å
346	N	95.6	Very high	94.9	Very high	54 Å²	54	66.1 Å²	66.1	29%	0.289	35%	0.345	S	S	.	.	H	α-helix	trans	-69	-24.7	177.9	-72.1	-16.1	0	0	0	112.9	C336 Q342 C343 L344	C336-N346 PolarHBondContact O-ND2 3.07Å; Q342-N346 WeakPolarHBondContact O-CB 3.48Å; Q342-N346 VanDerWaalsContact O-CG 3.29Å; Q342-N346 PolarHBondContact O-N 2.76Å; C343-N346 PolarHBondContact O-N 3.1Å; L344-N346 VanDerWaalsContact C-N 3.35Å; L344-N346 PolarHBondContact O-N 2.77Å
347	Y	95.2	Very high	94.9	Very high	46 Å²	46	63.9 Å²	63.9	18%	0.18	33%	0.326	C	S	.	.	H	α-helix	trans	-74	-32.9	174.4	-172.2	-86.2	0	0	0	112.4	I308 C343 L344 C345 C374	I308-Y347 HydrophobicContact CD1-CE1 4.34Å; C343-Y347 WeakPolarHBondContact O-CB 3.48Å; C343-Y347 PolarHBondContact O-N 3.28Å; L344-Y347 WeakPolarHBondContact O-CB 3.39Å; L344-Y347 PolarHBondContact O-N 3.16Å; L344-Y347 VanDerWaalsContact O-N 3.16Å; C345-Y347 VanDerWaalsContact C-N 3.28Å; C345-Y347 PolarHBondContact O-N 2.66Å; Y347-C374 HydrophobicContact CE1-CB 4.46Å
348	V	95.7	Very high	94.9	Very high	25 Å²	25	64.8 Å²	64.8	15%	0.152	33%	0.334	C	S	.	.	H	α-helix	trans	-100.8	0.2	179.7	-51.6	0	0	0	0	115.2	L344 C345 K373 C374 F411	L344-V348 PolarHBondContact O-N 3Å; L344-V348 VanDerWaalsContact O-N 3.1Å; C345-V348 PolarHBondContact O-N 2.88Å; V348-K373 WeakPolarHBondContact O-CE 3.5Å; V348-C374 VanDerWaalsContact CA-O 3.25Å; V348-C374 WeakPolarHBondContact CA-O 3.25Å; V348-C374 WeakPolarHBondContact CB-O 3.49Å; V348-F411 HydrophobicContact CG1-CB 4Å; V348-F411 HydrophobicContact CG1-CD1 4.3Å; V348-F411 HydrophobicContact CG2-CD1 3.89Å
349	R	95.3	Very high	94.8	Very high	187 Å²	187	58.4 Å²	58.4	71%	0.706	31%	0.31	S	S	*	.	S	Bend	trans	-64.5	141.9	173.2	-176	173.8	178.6	159.7	1.1	109.9	C345	C345-R349 WeakPolarHBondContact O-CB 3.3Å; C345-R349 PolarHBondContact O-N 3.07Å
350	S	95.2	Very high	94.6	Very high	56 Å²	56	62.8 Å²	62.8	39%	0.392	33%	0.325	S	S	.	.			trans	-72.9	137.5	172.2	-46.6	0	0	0	0	110.9	M371 R372	S350-M371 VanDerWaalsContact CB-SD 3.53Å; S350-R372 CarbonylContact C-O 3.5Å; S350-R372 WeakPolarHBondContact CA-O 3.33Å
351	E	93.7	Very high	94.5	Very high	41 Å²	41	62.7 Å²	62.7	19%	0.192	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	143.8	175.4	69.6	-175.4	145.9	0	0	110.7	R372 K586	E351-R372 HydrophobicContact CG-CB 4.09Å; E351-R372 HydrophobicContact CG-CG 4.39Å; E351-R372 PolarHBondContact N-O 3.41Å; E351-R372 PolarHBondContact O-N 3.33Å; E351-R372 IonicContact OE1-CZ 2.65Å; E351-R372 IonicContact OE1-NE 2.66Å; E351-R372 IonicContact OE1-NH1 2.64Å; E351-R372 PolarHBondContact OE1-NH1 3.2Å; E351-R372 IonicContact OE1-NH2 2.67Å; E351-K586 PolarHBondContact OE2-N 3.09Å
352	E	96	Very high	94.4	Very high	104 Å²	104	62.1 Å²	62.1	49%	0.486	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	129.7	176.3	-160.9	-168.9	133.2	0	0	111.2	S354 M371	E352-S354 VanDerWaalsContact OE1-CB 3.22Å; E352-S354 WeakPolarHBondContact OE1-CB 3.46Å; E352-S354 PolarHBondContact OE1-OG 3.22Å; E352-M371 HydrophobicContact CB-CE 4.37Å; E352-M371 HydrophobicContact CG-CE 4.44Å
353	L	94.2	Very high	94.2	Very high	21 Å²	21	62.6 Å²	62.6	11%	0.11	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	94.2	173.7	-62.5	-173.8	0	0	0	109.5	V312 N357 A369 A370 R372	V312-L353 HydrophobicContact CG1-CD1 4.15Å; L353-N357 WeakPolarHBondContact CB-O 3.08Å; L353-A369 VanDerWaalsContact O-CA 3.3Å; L353-A369 WeakPolarHBondContact O-CA 3.43Å; L353-A370 HydrophobicContact CB-CB 4.39Å; L353-A370 WeakPolarHBondContact CB-O 3.35Å; L353-A370 PolarHBondContact N-O 3.33Å; L353-A370 PolarHBondContact O-N 3.45Å; L353-R372 HydrophobicContact CD1-CB 3.75Å; L353-R372 HydrophobicContact CD1-CG 4.44Å; L353-R372 HydrophobicContact CD2-CB 4.4Å; L353-R372 HydrophobicContact CG-CB 3.83Å
354	S	92.8	Very high	94.1	Very high	52 Å²	52	64 Å²	64	36%	0.364	34%	0.337	S	S	.	.			trans	-136.2	174.3	-179.7	60.4	0	0	0	0	112.6	E352 Q356 N357 A358	E352-S354 VanDerWaalsContact OE1-CB 3.22Å; E352-S354 WeakPolarHBondContact OE1-CB 3.46Å; E352-S354 PolarHBondContact OE1-OG 3.22Å; S354-Q356 PolarHBondContact O-N 2.99Å; S354-N357 CarbonylContact O-C 3.53Å; S354-N357 WeakPolarHBondContact O-CA 3.31Å; S354-N357 PolarHBondContact O-N 3.27Å; S354-A358 PolarHBondContact O-N 3.04Å
355	G	91.9	Very high	94	Very high	65 Å²	65	70.9 Å²	70.9	67%	0.67	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	56.4	-129.6	-176.2	0	0	0	0	0	112.7	N357 A358	G355-N357 PolarHBondContact O-N 3.06Å; G355-A358 VanDerWaalsContact O-CB 3.22Å; G355-A358 WeakPolarHBondContact O-CB 3.46Å; G355-A358 PolarHBondContact O-N 2.99Å; G355-A358 VanDerWaalsContact O-N 3.15Å
356	Q	90.9	Very high	93.9	Very high	203 Å²	203	72.8 Å²	72.8	95%	0.949	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-64.8	-18.7	176.9	-61.4	-177.5	12.8	0	0	113.6	S354	S354-Q356 PolarHBondContact O-N 2.99Å
357	N	90.6	Very high	93.9	Very high	49 Å²	49	75.6 Å²	75.6	26%	0.262	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-96.9	8.5	177.8	-64.8	-41.7	0	0	0	113	L353 S354 G355	L353-N357 WeakPolarHBondContact CB-O 3.08Å; S354-N357 CarbonylContact O-C 3.53Å; S354-N357 WeakPolarHBondContact O-CA 3.31Å; S354-N357 PolarHBondContact O-N 3.27Å; G355-N357 PolarHBondContact O-N 3.06Å
358	A	92.6	Very high	93.9	Very high	21 Å²	21	77.3 Å²	77.3	17%	0.174	39%	0.393	C	S	.	.			trans	-56.6	144.8	-178.3	0	0	0	0	0	113.2	S354 G355 L367	S354-A358 PolarHBondContact O-N 3.04Å; G355-A358 VanDerWaalsContact O-CB 3.22Å; G355-A358 WeakPolarHBondContact O-CB 3.46Å; G355-A358 PolarHBondContact O-N 2.99Å; G355-A358 VanDerWaalsContact O-N 3.15Å; A358-L367 HydrophobicContact CB-CB 4.14Å; A358-L367 WeakPolarHBondContact O-CD2 3.48Å
359	Y	92.3	Very high	93.9	Very high	27 Å²	27	77.9 Å²	77.9	11%	0.106	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	126.2	-177.8	172.3	-122.7	0	0	0	111.3	V312 S321 C361 L367 R368 A370	V312-Y359 HydrophobicContact CG1-CD1 3.62Å; V312-Y359 HydrophobicContact CG1-CD2 3.95Å; V312-Y359 HydrophobicContact CG1-CE1 3.89Å; V312-Y359 HydrophobicContact CG1-CE2 4.24Å; V312-Y359 HydrophobicContact CG1-CG 3.65Å; S321-Y359 WeakPolarHBondContact CB-OH 3.44Å; S321-Y359 PolarHBondContact OG-OH 3.1Å; Y359-C361 HydrophobicContact CD1-CB 4.13Å; Y359-C361 HydrophobicContact CE1-CB 4.06Å; Y359-C361 PolarHBondContact O-N 2.87Å; Y359-L367 WeakPolarHBondContact O-CA 3.37Å; Y359-R368 PolarHBondContact N-O 2.74Å; Y359-R368 PolarHBondContact O-N 3.33Å; Y359-A370 HydrophobicContact CD1-CB 3.93Å; Y359-A370 HydrophobicContact CG-CB 4.14Å
360	K	95	Very high	94	Very high	122 Å²	122	69 Å²	69	53%	0.53	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	97.2	167.4	-169.9	174.7	-177.4	177.4	0	109.2	H365 Q366 L367	K360-H365 WeakPolarHBondContact CE-O 3.44Å; K360-Q366 WeakPolarHBondContact CA-O 3.44Å; K360-L367 HydrophobicContact CB-CD2 3.96Å
361	C	95.1	Very high	94.1	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	36%	0.362	C	S	.	.			trans	-70.9	130.3	-178.5	-178.9	0	0	0	0	110.8	C314 C317 Y359 N363 C364 H365 Q366 R368	C314-C361 HydrophobicContact CB-CB 4.23Å; C314-C361 VanDerWaalsContact SG-SG 3.67Å; C317-C361 VanDerWaalsContact SG-SG 3.66Å; Y359-C361 HydrophobicContact CD1-CB 4.13Å; Y359-C361 HydrophobicContact CE1-CB 4.06Å; Y359-C361 PolarHBondContact O-N 2.87Å; C361-N363 PolarHBondContact O-N 3.25Å; C361-N363 PolarHBondContact SG-N 3.07Å; C361-N363 VanDerWaalsContact SG-N 3.43Å; C361-C364 HydrophobicContact CB-CB 4.07Å; C361-H365 VanDerWaalsContact O-CA 3.3Å; C361-H365 WeakPolarHBondContact O-CA 3.48Å; C361-H365 PolarHBondContact O-N 3.08Å; C361-Q366 PolarHBondContact N-O 2.73Å; C361-R368 HydrophobicContact CB-CG 4.44Å
362	E	93.1	Very high	94.2	Very high	81 Å²	81	68.4 Å²	68.4	38%	0.379	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-23.6	177.6	-62.1	-178	151	0	0	113.7	K319 H365 K592	K319-E362 IonicContact NZ-OE2 3.6Å; K319-E362 PolarHBondContact NZ-OE2 2.95Å; E362-H365 PolarHBondContact O-CE1 3.06Å; E362-H365 PolarHBondContact O-ND1 2.83Å; E362-K592 IonicContact OE1-NZ 3.08Å; E362-K592 PolarHBondContact OE1-NZ 3.15Å
363	N	93.8	Very high	94.2	Very high	100 Å²	100	67.3 Å²	67.3	54%	0.535	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-27.6	-177	-158.9	95.5	0	0	0	113.1	K319 C361	K319-N363 HydrophobicContact CD-CB 3.99Å; C361-N363 PolarHBondContact O-N 3.25Å; C361-N363 PolarHBondContact SG-N 3.07Å; C361-N363 VanDerWaalsContact SG-N 3.43Å
364	C	95.1	Very high	94.2	Very high	31 Å²	31	67 Å²	67	21%	0.209	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-5.1	173.2	-51.9	0	0	0	0	112.4	C317 C361 Q366 R368	C317-C364 VanDerWaalsContact SG-SG 3.66Å; C361-C364 HydrophobicContact CB-CB 4.07Å; C364-Q366 HydrophobicContact CB-CG 4.14Å; C364-Q366 WeakPolarHBondContact O-CG 3.4Å; C364-Q366 PolarHBondContact O-N 3.4Å; C364-R368 HydrophobicContact CB-CG 4.04Å
365	H	93.4	Very high	94.4	Very high	146 Å²	146	64.9 Å²	64.9	68%	0.676	34%	0.335	S	S	*	.	S	Bend	trans	53.4	-1.6	-173.8	-58.6	-72.6	0	0	0	117.5	K360 C361 E362	K360-H365 WeakPolarHBondContact CE-O 3.44Å; C361-H365 VanDerWaalsContact O-CA 3.3Å; C361-H365 WeakPolarHBondContact O-CA 3.48Å; C361-H365 PolarHBondContact O-N 3.08Å; E362-H365 PolarHBondContact O-CE1 3.06Å; E362-H365 PolarHBondContact O-ND1 2.83Å
366	Q	93.9	Very high	94.7	Very high	97 Å²	97	62 Å²	62	45%	0.453	30%	0.304	S	S	.	.	S	Bend	trans	-121.2	170.8	-176.4	72.8	-172.6	111.7	0	0	112.9	K360 C361 C364 R368	K360-Q366 WeakPolarHBondContact CA-O 3.44Å; C361-Q366 PolarHBondContact N-O 2.73Å; C364-Q366 HydrophobicContact CB-CG 4.14Å; C364-Q366 WeakPolarHBondContact O-CG 3.4Å; C364-Q366 PolarHBondContact O-N 3.4Å; Q366-R368 HydrophobicContact CG-CG 4.01Å
367	L	95.6	Very high	95	Very high	113 Å²	113	57.7 Å²	57.7	59%	0.592	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.4	129.1	168	-62.5	173.9	0	0	0	110.3	A358 Y359 K360	A358-L367 HydrophobicContact CB-CB 4.14Å; A358-L367 WeakPolarHBondContact O-CD2 3.48Å; Y359-L367 WeakPolarHBondContact O-CA 3.37Å; K360-L367 HydrophobicContact CB-CD2 3.96Å
368	R	95.1	Very high	95.2	Very high	83 Å²	83	59 Å²	59	31%	0.313	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	154.6	177.3	-66.7	-61.3	-169.7	149.4	-13.4	109.7	S316 Y359 C361 C364 Q366	S316-R368 WeakPolarHBondContact OG-CD 3.41Å; S316-R368 PolarHBondContact OG-NH1 2.91Å; Y359-R368 PolarHBondContact N-O 2.74Å; Y359-R368 PolarHBondContact O-N 3.33Å; C361-R368 HydrophobicContact CB-CG 4.44Å; C364-R368 HydrophobicContact CB-CG 4.04Å; Q366-R368 HydrophobicContact CG-CG 4.01Å
369	A	96.8	Very high	95.3	Very high	36 Å²	36	58.5 Å²	58.5	30%	0.298	28%	0.277	S	S	.	.			trans	-60.9	138.5	164.9	0	0	0	0	0	109.4	H315 L353	H315-A369 HydrophobicContact CB-CB 4.46Å; H315-A369 WeakPolarHBondContact CB-O 3.49Å; H315-A369 PolarHBondContact N-O 2.92Å; H315-A369 VanDerWaalsContact ND1-C 3.26Å; H315-A369 PolarHBondContact ND1-O 3.03Å; L353-A369 VanDerWaalsContact O-CA 3.3Å; L353-A369 WeakPolarHBondContact O-CA 3.43Å
370	A	96.9	Very high	95.5	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	149.4	177.6	0	0	0	0	0	111.9	V312 T313 H315 L353 Y359	V312-A370 HydrophobicContact CG1-CB 3.68Å; T313-A370 CarbonylContact O-C 3.59Å; T313-A370 WeakPolarHBondContact O-CA 3.33Å; T313-A370 VanDerWaalsContact O-CB 3.31Å; T313-A370 WeakPolarHBondContact O-CB 3.33Å; H315-A370 VanDerWaalsContact CE1-C 3.44Å; H315-A370 WeakPolarHBondContact ND1-CA 3.5Å; H315-A370 PolarHBondContact ND1-N 3.29Å; L353-A370 HydrophobicContact CB-CB 4.39Å; L353-A370 WeakPolarHBondContact CB-O 3.35Å; L353-A370 PolarHBondContact N-O 3.33Å; L353-A370 PolarHBondContact O-N 3.45Å; Y359-A370 HydrophobicContact CD1-CB 3.93Å; Y359-A370 HydrophobicContact CG-CB 4.14Å
371	M	97.3	Very high	95.6	Very high	63 Å²	63	51.9 Å²	51.9	31%	0.31	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	120.4	171.3	-170.5	58.3	59.7	0	0	108.7	V312 T313 H315 S350 E352	V312-M371 CarbonylContact C-O 3.58Å; V312-M371 WeakPolarHBondContact CA-O 3.3Å; T313-M371 PolarHBondContact N-O 2.75Å; T313-M371 PolarHBondContact O-N 2.96Å; H315-M371 PolarHBondContact CE1-N 3.48Å; S350-M371 VanDerWaalsContact CB-SD 3.53Å; E352-M371 HydrophobicContact CB-CE 4.37Å; E352-M371 HydrophobicContact CG-CE 4.44Å
372	R	95.9	Very high	95.8	Very high	22 Å²	22	51.9 Å²	51.9	8%	0.083	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	143.7	176.6	173.1	167.1	166	-113	-20.9	110.5	S310 E311 V312 S350 E351 L353 C374 K586	S310-R372 PolarHBondContact OG-NE 3.31Å; E311-R372 CarbonylContact O-C 3.59Å; E311-R372 VanDerWaalsContact O-CA 3.3Å; E311-R372 WeakPolarHBondContact O-CA 3.44Å; V312-R372 HydrophobicContact CG2-CB 4.13Å; V312-R372 HydrophobicContact CG2-CG 4Å; S350-R372 CarbonylContact C-O 3.5Å; S350-R372 WeakPolarHBondContact CA-O 3.33Å; E351-R372 HydrophobicContact CG-CB 4.09Å; E351-R372 HydrophobicContact CG-CG 4.39Å; E351-R372 PolarHBondContact N-O 3.41Å; E351-R372 PolarHBondContact O-N 3.33Å; E351-R372 IonicContact OE1-CZ 2.65Å; E351-R372 IonicContact OE1-NE 2.66Å; E351-R372 IonicContact OE1-NH1 2.64Å; E351-R372 PolarHBondContact OE1-NH1 3.2Å; E351-R372 IonicContact OE1-NH2 2.67Å; L353-R372 HydrophobicContact CD1-CB 3.75Å; L353-R372 HydrophobicContact CD1-CG 4.44Å; L353-R372 HydrophobicContact CD2-CB 4.4Å; L353-R372 HydrophobicContact CG-CB 3.83Å; R372-C374 PolarHBondContact NH2-SG 2.89Å; R372-K586 PolarHBondContact NH1-O 3.48Å; R372-K586 VanDerWaalsContact NH1-O 3.17Å
373	K	95.4	Very high	96	Very high	82 Å²	82	48.3 Å²	48.3	36%	0.357	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	140.9	173.9	-171.7	-178.9	178.5	-174.1	0	110.2	S310 E311 V348 T375	S310-K373 WeakPolarHBondContact CA-O 3.33Å; E311-K373 PolarHBondContact N-O 2.93Å; E311-K373 PolarHBondContact O-N 2.99Å; V348-K373 WeakPolarHBondContact O-CE 3.5Å; K373-T375 HydrophobicContact CD-CG2 4.28Å; K373-T375 HydrophobicContact CG-CG2 4.33Å
374	C	95.8	Very high	96.2	Very high	15 Å²	15	43.6 Å²	43.6	10%	0.101	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	140.5	170.4	-67.5	0	0	0	0	110.1	I308 R309 Y347 V348 R372	I308-C374 HydrophobicContact CG2-CB 4.34Å; R309-C374 CarbonylContact O-C 3.6Å; R309-C374 WeakPolarHBondContact O-CA 3.31Å; Y347-C374 HydrophobicContact CE1-CB 4.46Å; V348-C374 VanDerWaalsContact CA-O 3.25Å; V348-C374 WeakPolarHBondContact CA-O 3.25Å; V348-C374 WeakPolarHBondContact CB-O 3.49Å; R372-C374 PolarHBondContact NH2-SG 2.89Å
375	T	97	Very high	96.4	Very high	6 Å²	6	42.1 Å²	42.1	4%	0.037	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	155	174.9	56.8	0	0	0	0	111	I308 R309 K373 Y377 T413	I308-T375 WeakPolarHBondContact CA-O 3.14Å; R309-T375 PolarHBondContact N-O 3.29Å; R309-T375 PolarHBondContact O-N 2.96Å; K373-T375 HydrophobicContact CD-CG2 4.28Å; K373-T375 HydrophobicContact CG-CG2 4.33Å; T375-Y377 PolarHBondContact O-N 2.71Å; T375-T413 PolarHBondContact OG1-OG1 2.72Å
376	I	97.1	Very high	96.6	Very high	4 Å²	4	35.7 Å²	35.7	2%	0.021	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	109.5	178.3	-57.4	171.7	0	0	0	108.5	I308 L330 L344 L408 F411 M412 T413	I308-I376 HydrophobicContact CD1-CB 4.42Å; I308-I376 HydrophobicContact CD1-CG1 3.95Å; L330-I376 HydrophobicContact CD1-CD1 3.77Å; L344-I376 HydrophobicContact CD2-CD1 4.39Å; I376-L408 HydrophobicContact CD1-CD1 3.65Å; I376-L408 HydrophobicContact CD1-CD2 4.25Å; I376-L408 HydrophobicContact CD1-CG 4.11Å; I376-L408 HydrophobicContact CG2-CD2 4.35Å; I376-F411 HydrophobicContact CD1-CB 4.29Å; I376-F411 PolarHBondContact N-O 2.73Å; I376-F411 VanDerWaalsContact N-O 3.12Å; I376-M412 HydrophobicContact CB-CG 4.21Å; I376-M412 HydrophobicContact CG2-CE 4.46Å; I376-M412 HydrophobicContact CG2-CG 4.4Å; I376-M412 CarbonylContact O-C 3.57Å; I376-M412 WeakPolarHBondContact O-CA 3.48Å; I376-M412 VanDerWaalsContact O-CB 3.25Å; I376-M412 WeakPolarHBondContact O-CB 3.26Å; I376-T413 PolarHBondContact O-N 3.48Å
377	Y	96.6	Very high	96.8	Very high	113 Å²	113	31.1 Å²	31.1	44%	0.443	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	-46.8	-177.2	-179.4	-120.8	0	0	0	112.1	V307 R309 T375 T413	V307-Y377 HydrophobicContact CB-CD1 4.35Å; V307-Y377 HydrophobicContact CG1-CD1 4Å; V307-Y377 PolarHBondContact O-N 2.88Å; R309-Y377 VanDerWaalsContact NH2-CZ 3.34Å; T375-Y377 PolarHBondContact O-N 2.71Å; Y377-T413 WeakPolarHBondContact CA-OG1 3.44Å; Y377-T413 HydrophobicContact CD2-CG2 4.37Å
378	R	95.2	Very high	96.8	Very high	78 Å²	78	27.1 Å²	27.1	29%	0.294	13%	0.126	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	126.3	173.7	-172.6	175.2	65	72.9	0.5	110	G305 G306 V307	G305-R378 PolarHBondContact O-NH1 3.37Å; G305-R378 PolarHBondContact O-NH2 3.26Å; G306-R378 CarbonylContact C-O 3.55Å; G306-R378 WeakPolarHBondContact CA-O 3.45Å; V307-R378 HydrophobicContact CB-CB 3.94Å; V307-R378 HydrophobicContact CG2-CB 3.94Å; V307-R378 PolarHBondContact N-O 3.09Å; V307-R378 PolarHBondContact O-N 3.4Å; V307-R378 VanDerWaalsContact O-N 3.1Å
379	A	95.4	Very high	96.8	Very high	9 Å²	9	23.2 Å²	23.2	7%	0.074	11%	0.111	C	C	.	.			trans	-89.7	139.7	176.7	0	0	0	0	0	110.9	L408 M412 Y422	A379-L408 HydrophobicContact CB-CD2 3.58Å; A379-M412 HydrophobicContact CB-CE 4.12Å; A379-Y422 VanDerWaalsContact CB-OH 3.29Å; A379-Y422 WeakPolarHBondContact CB-OH 3.23Å
380	P	96.7	Very high	96.4	Very high	6 Å²	6	24 Å²	24	4%	0.039	11%	0.108	C	C	.	.			trans	-84.4	152.7	175.2	33.6	-34	0	0	0	112	I382 L383 Y422	P380-I382 WeakPolarHBondContact CB-O 3.24Å; P380-I382 VanDerWaalsContact CG-O 3.22Å; P380-I382 WeakPolarHBondContact CG-O 3.38Å; P380-I382 PolarHBondContact O-N 2.95Å; P380-L383 HydrophobicContact CG-CB 4.32Å; P380-L383 HydrophobicContact CG-CD1 4.26Å; P380-Y422 WeakPolarHBondContact O-CE1 3.42Å; P380-Y422 PolarHBondContact O-OH 2.77Å
381	P	97	Very high	95.8	Very high	4 Å²	4	25.8 Å²	25.8	3%	0.026	12%	0.121	C	C	.	.	S	Bend	trans	-49.6	-43.3	167.9	-25.8	31	0	0	0	113.1	L153 R302 I303 E477 A478 Y481	L153-P381 HydrophobicContact CD1-CG 4.18Å; L153-P381 HydrophobicContact CD2-CG 3.96Å; L153-P381 HydrophobicContact CG-CG 4.32Å; R302-P381 WeakPolarHBondContact O-CD 3.48Å; I303-P381 VanDerWaalsContact O-CD 3.3Å; I303-P381 WeakPolarHBondContact O-CD 3.45Å; P381-E477 WeakPolarHBondContact O-CA 3.16Å; P381-A478 PolarHBondContact O-N 2.86Å; P381-Y481 HydrophobicContact CB-CD2 4.15Å; P381-Y481 HydrophobicContact CB-CE2 4.46Å; P381-Y481 HydrophobicContact CB-CG 4.31Å; P381-Y481 HydrophobicContact CG-CD1 4.03Å; P381-Y481 HydrophobicContact CG-CD2 3.77Å; P381-Y481 HydrophobicContact CG-CE1 3.9Å; P381-Y481 HydrophobicContact CG-CE2 3.64Å; P381-Y481 HydrophobicContact CG-CG 3.97Å
382	I	98.2	Very high	94.9	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	109.9	175	-56.3	-62.4	0	0	0	109.5	T190 P192 I303 F304 P380 I384 Y425 Y476 E477	T190-I382 HydrophobicContact CG2-CB 4.5Å; T190-I382 HydrophobicContact CG2-CD1 3.92Å; T190-I382 HydrophobicContact CG2-CG1 3.73Å; T190-I382 HydrophobicContact CG2-CG2 4.15Å; P192-I382 HydrophobicContact CG-CD1 4.24Å; P192-I382 HydrophobicContact CG-CG1 4.45Å; I303-I382 HydrophobicContact CG2-CB 4.18Å; I303-I382 HydrophobicContact CG2-CG1 3.61Å; I303-I382 PolarHBondContact O-N 2.75Å; F304-I382 HydrophobicContact CD1-CB 3.85Å; F304-I382 HydrophobicContact CD1-CG2 3.65Å; F304-I382 HydrophobicContact CE1-CB 4.07Å; F304-I382 HydrophobicContact CE1-CG2 3.62Å; P380-I382 WeakPolarHBondContact CB-O 3.24Å; P380-I382 VanDerWaalsContact CG-O 3.22Å; P380-I382 WeakPolarHBondContact CG-O 3.38Å; P380-I382 PolarHBondContact O-N 2.95Å; I382-I384 HydrophobicContact CG2-CG1 4.47Å; I382-Y425 HydrophobicContact CD1-CE1 4.08Å; I382-Y425 HydrophobicContact CG2-CE1 4.2Å; I382-Y425 VanDerWaalsContact CG2-OH 3.24Å; I382-Y425 WeakPolarHBondContact CG2-OH 3.28Å; I382-Y476 CarbonylContact C-O 3.51Å; I382-Y476 WeakPolarHBondContact CA-O 3.49Å; I382-E477 HydrophobicContact CD1-CB 3.89Å; I382-E477 HydrophobicContact CD1-CG 3.79Å
383	L	98.3	Very high	94.2	Very high	6 Å²	6	38 Å²	38	3%	0.031	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	114	179.5	177	63.2	0	0	0	110.5	L330 P380 I385 F406 L408 Y422 Y476	L330-L383 HydrophobicContact CD1-CD1 4.01Å; L330-L383 HydrophobicContact CG-CD1 4.06Å; P380-L383 HydrophobicContact CG-CB 4.32Å; P380-L383 HydrophobicContact CG-CD1 4.26Å; L383-I385 HydrophobicContact CD1-CG1 4.49Å; L383-I385 HydrophobicContact CD2-CD1 4.16Å; L383-I385 HydrophobicContact CD2-CG1 4.47Å; L383-I385 HydrophobicContact CG-CD1 4.32Å; L383-I385 HydrophobicContact CG-CG1 4.1Å; L383-F406 HydrophobicContact CD2-CZ 3.9Å; L383-L408 HydrophobicContact CD2-CD1 4.01Å; L383-L408 HydrophobicContact CD2-CD2 4.14Å; L383-Y422 HydrophobicContact CB-CD1 3.93Å; L383-Y422 HydrophobicContact CB-CE1 3.53Å; L383-Y422 HydrophobicContact CD2-CD1 4.37Å; L383-Y422 HydrophobicContact CD2-CD2 4.42Å; L383-Y422 HydrophobicContact CD2-CE1 4.3Å; L383-Y422 HydrophobicContact CD2-CE2 4.34Å; L383-Y422 HydrophobicContact CD2-CG 4.43Å; L383-Y476 PolarHBondContact N-O 3.29Å; L383-Y476 PolarHBondContact O-N 2.97Å
384	I	98.7	Very high	93.8	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.005	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	132.5	174.2	-56.6	174.3	0	0	0	109	L272 L276 F304 N329 L330 I382 L474 F475	L272-I384 HydrophobicContact CD1-CD1 4.41Å; L272-I384 HydrophobicContact CD2-CD1 4.34Å; L272-I384 HydrophobicContact CD2-CG2 3.95Å; L276-I384 HydrophobicContact CD1-CD1 3.85Å; F304-I384 HydrophobicContact CD1-CD1 3.78Å; F304-I384 HydrophobicContact CD1-CG1 4.41Å; F304-I384 HydrophobicContact CE1-CD1 4.23Å; N329-I384 CarbonylContact C-O 3.57Å; N329-I384 WeakPolarHBondContact CA-O 3.3Å; N329-I384 HydrophobicContact CB-CB 3.84Å; N329-I384 HydrophobicContact CB-CG2 3.74Å; N329-I384 WeakPolarHBondContact CB-O 3.06Å; L330-I384 PolarHBondContact N-O 2.95Å; I382-I384 HydrophobicContact CG2-CG1 4.47Å; I384-L474 WeakPolarHBondContact CA-O 3.44Å; I384-F475 HydrophobicContact CD1-CD1 4.22Å; I384-F475 HydrophobicContact CD1-CE1 3.82Å; I384-F475 HydrophobicContact CG1-CD1 3.82Å; I384-F475 HydrophobicContact CG1-CE1 3.89Å; I384-F475 HydrophobicContact CG2-CE1 4.46Å
385	I	98.5	Very high	93.7	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	125.7	175.8	-54.8	176.4	0	0	0	109.1	L330 M332 L340 L383 L387 F406 L473 L474 Y476	L330-I385 HydrophobicContact CB-CG1 4.4Å; L330-I385 HydrophobicContact CD1-CG1 4.39Å; L330-I385 WeakPolarHBondContact O-CA 3.38Å; M332-I385 HydrophobicContact CE-CD1 3.91Å; M332-I385 HydrophobicContact CE-CG1 4.22Å; M332-I385 HydrophobicContact CE-CG2 3.63Å; M332-I385 HydrophobicContact CG-CG2 3.95Å; M332-I385 HydrophobicContact SD-CG2 3.61Å; L340-I385 HydrophobicContact CD1-CD1 4.02Å; L340-I385 HydrophobicContact CD1-CG2 4.16Å; L340-I385 HydrophobicContact CD2-CD1 4.27Å; L383-I385 HydrophobicContact CD1-CG1 4.49Å; L383-I385 HydrophobicContact CD2-CD1 4.16Å; L383-I385 HydrophobicContact CD2-CG1 4.47Å; L383-I385 HydrophobicContact CG-CD1 4.32Å; L383-I385 HydrophobicContact CG-CG1 4.1Å; I385-L387 HydrophobicContact CG2-CD2 4.35Å; I385-F406 HydrophobicContact CD1-CZ 4.3Å; I385-L473 CarbonylContact O-C 3.5Å; I385-L473 WeakPolarHBondContact O-CA 3.31Å; I385-L474 HydrophobicContact CB-CB 4.25Å; I385-L474 HydrophobicContact CB-CD1 4.44Å; I385-L474 HydrophobicContact CG2-CD1 4.49Å; I385-L474 PolarHBondContact N-O 2.93Å; I385-L474 PolarHBondContact O-N 2.82Å; I385-Y476 HydrophobicContact CD1-CD2 4.28Å; I385-Y476 HydrophobicContact CD1-CE2 4.38Å
386	Q	98.1	Very high	93.4	Very high	11 Å²	11	40.5 Å²	40.5	5%	0.051	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	129.1	168.5	176.9	-168.7	29.2	0	0	108.3	H269 L330 S331 M332 N388 Y472 L473	H269-Q386 PolarHBondContact CE1-OE1 2.89Å; H269-Q386 VanDerWaalsContact CG-NE2 3.26Å; H269-Q386 PolarHBondContact ND1-NE2 3.03Å; H269-Q386 VanDerWaalsContact ND1-NE2 3.11Å; H269-Q386 PolarHBondContact ND1-OE1 2.86Å; H269-Q386 PolarHBondContact NE2-OE1 2.81Å; L330-Q386 PolarHBondContact O-N 2.94Å; S331-Q386 PolarHBondContact OG-OE1 2.83Å; M332-Q386 PolarHBondContact N-O 3.35Å; Q386-N388 PolarHBondContact OE1-OD1 2.85Å; Q386-Y472 HydrophobicContact CG-CE2 3.91Å; Q386-Y472 PolarHBondContact NE2-OH 2.8Å; Q386-L473 HydrophobicContact CB-CD2 3.87Å; Q386-L473 HydrophobicContact CG-CD2 4.05Å
387	L	97.4	Very high	93.1	Very high	1 Å²	1	44 Å²	44	1%	0.005	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	119.9	164	-61	-172.3	0	0	0	107.4	M332 I334 L340 I385 R389 V400 Y472	M332-L387 HydrophobicContact CB-CD2 4.22Å; I334-L387 HydrophobicContact CG2-CB 3.94Å; I334-L387 HydrophobicContact CG2-CD2 3.95Å; I334-L387 HydrophobicContact CG2-CG 4.36Å; L340-L387 HydrophobicContact CD1-CD2 4.49Å; I385-L387 HydrophobicContact CG2-CD2 4.35Å; L387-R389 PolarHBondContact O-N 3.24Å; L387-V400 HydrophobicContact CD1-CB 4.08Å; L387-V400 HydrophobicContact CD1-CG1 4.1Å; L387-Y472 PolarHBondContact N-O 2.88Å; L387-Y472 WeakPolarHBondContact O-CD2 3.24Å; L387-Y472 WeakPolarHBondContact O-CE2 3.33Å
388	N	95.1	Very high	92.8	Very high	30 Å²	30	40.9 Å²	40.9	16%	0.16	19%	0.19	C	C	.	.			trans	-73.6	71.3	-171.5	-65.7	-1.1	0	0	0	111.7	M332 Q386	M332-N388 PolarHBondContact N-OD1 2.88Å; M332-N388 WeakPolarHBondContact O-CB 3.3Å; M332-N388 PolarHBondContact O-N 3.03Å; M332-N388 PolarHBondContact O-OD1 2.89Å; Q386-N388 PolarHBondContact OE1-OD1 2.85Å
389	R	94.6	Very high	92.8	Very high	1 Å²	1	42 Å²	42	0%	0.004	19%	0.194	C	C	.	.			trans	-73.7	-26.3	-178.9	-67.4	-167.4	-179.2	-77.4	-2.3	113.4	I334 L387 K395 L396 I398 P471 Y472	I334-R389 HydrophobicContact CD1-CG 3.76Å; L387-R389 PolarHBondContact O-N 3.24Å; R389-K395 HydrophobicContact CB-CG 4.48Å; R389-K395 CarbonylContact O-C 3.49Å; R389-K395 WeakPolarHBondContact O-CA 3.21Å; R389-L396 PolarHBondContact NH1-O 3.32Å; R389-L396 PolarHBondContact O-N 3.08Å; R389-I398 PolarHBondContact NH1-O 2.89Å; R389-P471 PolarHBondContact NE-O 3Å; R389-P471 PolarHBondContact NH2-O 3.31Å; R389-Y472 HydrophobicContact CB-CD2 4.18Å; R389-Y472 HydrophobicContact CG-CD2 4.32Å
390	F	90.5	Very high	92.9	Very high	52 Å²	52	41.6 Å²	41.6	23%	0.228	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	-96.8	123.5	-174.1	-56.2	-59.3	0	0	0	112.3	K395 H430 C435 Y472	F390-K395 HydrophobicContact CD1-CB 4.48Å; F390-K395 HydrophobicContact CD1-CG 4.32Å; F390-K395 HydrophobicContact CE1-CG 4.07Å; F390-H430 AromaticContact CE1-ND1 3.93Å; F390-H430 HydrophobicContact CZ-CB 3.91Å; F390-H430 AromaticContact CZ-CD2 3.76Å; F390-H430 AromaticContact CZ-CG 3.59Å; F390-H430 AromaticContact CZ-ND1 3.9Å; F390-C435 HydrophobicContact CD1-CB 3.85Å; F390-Y472 HydrophobicContact CD2-CD2 4.33Å; F390-Y472 HydrophobicContact CD2-CE1 4.38Å; F390-Y472 AromaticContact CD2-CE2 3.66Å; F390-Y472 HydrophobicContact CD2-CE2 3.66Å; F390-Y472 AromaticContact CD2-CZ 3.66Å; F390-Y472 HydrophobicContact CE2-CD1 4.13Å; F390-Y472 AromaticContact CE2-CD2 3.94Å; F390-Y472 HydrophobicContact CE2-CD2 3.94Å; F390-Y472 AromaticContact CE2-CE1 3.79Å; F390-Y472 HydrophobicContact CE2-CE1 3.79Å; F390-Y472 AromaticContact CE2-CE2 3.62Å; F390-Y472 HydrophobicContact CE2-CE2 3.62Å; F390-Y472 HydrophobicContact CE2-CG 4.18Å; F390-Y472 AromaticContact CE2-CZ 3.51Å
391	S	83.7	Confident	92.9	Very high	38 Å²	38	44.9 Å²	44.9	27%	0.266	21%	0.208	S	C	.	.			trans	-109.3	169.3	160.6	179.2	0	0	0	0	108.9	H393 Q394	S391-H393 PolarHBondContact O-N 3.29Å; S391-Q394 PolarHBondContact N-O 3.42Å
392	R	78.5	Confident	93	Very high	185 Å²	185	45.1 Å²	45.1	70%	0.698	21%	0.209	S	C	*	.	S	Bend	trans	-55.4	-23.4	-176.6	-71.6	179.3	169.7	-158.4	-6.8	115
393	H	80.3	Confident	92.9	Very high	156 Å²	156	47.5 Å²	47.5	72%	0.722	23%	0.225	S	C	*	.	S	Bend	trans	-128.1	-13.8	-171	-54.1	-78.2	0	0	0	113.8	S391	S391-H393 PolarHBondContact O-N 3.29Å
394	Q	87.3	Confident	92.9	Very high	108 Å²	108	49.9 Å²	49.9	51%	0.505	24%	0.242	S	C	.	.			trans	-149.7	154.4	-171.3	67.9	-169.9	65.6	0	0	112.8	S391	S391-Q394 PolarHBondContact N-O 3.42Å
395	K	92.6	Very high	92.8	Very high	21 Å²	21	53 Å²	53	9%	0.091	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-96.7	129.9	164	-176.1	-163.5	179.4	-159	0	109	R389 F390 D397 H430 G432 Y433	R389-K395 HydrophobicContact CB-CG 4.48Å; R389-K395 CarbonylContact O-C 3.49Å; R389-K395 WeakPolarHBondContact O-CA 3.21Å; F390-K395 HydrophobicContact CD1-CB 4.48Å; F390-K395 HydrophobicContact CD1-CG 4.32Å; F390-K395 HydrophobicContact CE1-CG 4.07Å; K395-D397 WeakPolarHBondContact CE-OD1 3.46Å; K395-D397 IonicContact NZ-OD1 3.07Å; K395-D397 PolarHBondContact NZ-OD1 3.31Å; K395-D397 IonicContact NZ-OD2 3.65Å; K395-D397 PolarHBondContact O-N 2.81Å; K395-H430 WeakPolarHBondContact CE-O 3.44Å; K395-H430 PolarHBondContact NZ-O 2.78Å; K395-G432 WeakPolarHBondContact CD-O 3.48Å; K395-G432 WeakPolarHBondContact CE-O 3.4Å; K395-G432 PolarHBondContact NZ-O 3.27Å; K395-Y433 WeakPolarHBondContact CB-O 3.44Å
396	L	92	Very high	92.7	Very high	27 Å²	27	53.7 Å²	53.7	14%	0.141	27%	0.267	C	S	.	.			trans	-82.2	94.5	169.1	-61.7	177.9	0	0	0	109	I334 T335 R389 I398	I334-L396 HydrophobicContact CD1-CB 4.01Å; I334-L396 HydrophobicContact CG1-CB 4.38Å; I334-L396 HydrophobicContact CG1-CD1 4.04Å; T335-L396 HydrophobicContact CG2-CD1 3.94Å; R389-L396 PolarHBondContact NH1-O 3.32Å; R389-L396 PolarHBondContact O-N 3.08Å; L396-I398 HydrophobicContact CD2-CD1 4.44Å; L396-I398 PolarHBondContact O-N 3.07Å
397	D	89.6	Confident	92.7	Very high	78 Å²	78	55.8 Å²	55.8	42%	0.417	28%	0.278	S	S	.	.			trans	-84.7	22.7	177.3	-131.5	24.4	0	0	0	113.5	K395 R399	K395-D397 WeakPolarHBondContact CE-OD1 3.46Å; K395-D397 IonicContact NZ-OD1 3.07Å; K395-D397 PolarHBondContact NZ-OD1 3.31Å; K395-D397 IonicContact NZ-OD2 3.65Å; K395-D397 PolarHBondContact O-N 2.81Å; D397-R399 PolarHBondContact O-N 2.9Å
398	I	92.1	Very high	92.6	Very high	46 Å²	46	55.7 Å²	55.7	24%	0.236	28%	0.278	C	S	.	.			trans	-61.7	129.7	177.2	-58.3	172.6	0	0	0	109.3	R389 L396 V400	R389-I398 PolarHBondContact NH1-O 2.89Å; L396-I398 HydrophobicContact CD2-CD1 4.44Å; L396-I398 PolarHBondContact O-N 3.07Å; I398-V400 PolarHBondContact O-N 3.24Å
399	R	94.2	Very high	92.7	Very high	101 Å²	101	55.7 Å²	55.7	38%	0.381	28%	0.275	S	S	.	.			trans	-64.7	128.8	170	-175.1	177.7	-179.7	76.1	19.7	109.7	D397 D401 L467 R468	D397-R399 PolarHBondContact O-N 2.9Å; R399-D401 IonicContact CZ-OD1 2.64Å; R399-D401 IonicContact NE-OD1 3.43Å; R399-D401 PolarHBondContact NE-OD1 3.3Å; R399-D401 IonicContact NE-OD2 3.66Å; R399-D401 IonicContact NH2-OD1 3.89Å; R399-D401 PolarHBondContact NH2-OD1 3.45Å; R399-L467 PolarHBondContact NH2-O 2.94Å; R399-L467 VanDerWaalsContact NH2-O 3.13Å; R399-R468 PolarHBondContact NH1-O 2.63Å
400	V	96.9	Very high	92.8	Very high	1 Å²	1	59 Å²	59	1%	0.006	30%	0.297	C	S	.	.			trans	-129	110.7	174.2	179.3	0	0	0	0	107	I334 R338 L387 I398 F402	I334-V400 HydrophobicContact CB-CG2 3.93Å; I334-V400 HydrophobicContact CD1-CG2 4.49Å; I334-V400 HydrophobicContact CG2-CG2 3.95Å; R338-V400 CarbonylContact O-C 3.56Å; R338-V400 WeakPolarHBondContact O-CA 3.28Å; L387-V400 HydrophobicContact CD1-CB 4.08Å; L387-V400 HydrophobicContact CD1-CG1 4.1Å; I398-V400 PolarHBondContact O-N 3.24Å; V400-F402 WeakPolarHBondContact O-CD1 3.47Å
401	D	97.6	Very high	93	Very high	75 Å²	75	56.9 Å²	56.9	40%	0.401	29%	0.288	S	S	.	.	B	Isolated β-bridge	trans	-73.9	130.5	-179.5	-66	-59.4	0	0	0	111.5	R338 S339 L340 R399	R338-D401 PolarHBondContact O-N 2.86Å; S339-D401 CarbonylContact C-O 3.59Å; S339-D401 WeakPolarHBondContact CA-O 3.3Å; S339-D401 WeakPolarHBondContact CB-O 3.49Å; L340-D401 PolarHBondContact N-O 3.46Å; R399-D401 IonicContact CZ-OD1 2.64Å; R399-D401 IonicContact NE-OD1 3.43Å; R399-D401 PolarHBondContact NE-OD1 3.3Å; R399-D401 IonicContact NE-OD2 3.66Å; R399-D401 IonicContact NH2-OD1 3.89Å; R399-D401 PolarHBondContact NH2-OD1 3.45Å
402	F	98	Very high	93.7	Very high	9 Å²	9	55.9 Å²	55.9	4%	0.039	28%	0.279	C	S	.	.			trans	-127.7	134.6	-177.7	57.7	-75.6	0	0	0	108.8	L340 V400 L424 I427 V466 L467 P471 L474	L340-F402 HydrophobicContact CB-CB 4.17Å; L340-F402 HydrophobicContact CD2-CB 4.35Å; V400-F402 WeakPolarHBondContact O-CD1 3.47Å; F402-L424 HydrophobicContact CD2-CD2 3.94Å; F402-L424 HydrophobicContact CE2-CD2 3.7Å; F402-I427 HydrophobicContact CE2-CG2 4.1Å; F402-I427 HydrophobicContact CZ-CD1 4.37Å; F402-V466 VanDerWaalsContact CZ-O 3.28Å; F402-V466 WeakPolarHBondContact CZ-O 3.33Å; F402-L467 HydrophobicContact CD2-CD2 4.24Å; F402-L467 HydrophobicContact CE2-CD2 4.02Å; F402-L467 WeakPolarHBondContact O-CD2 3.42Å; F402-P471 HydrophobicContact CD1-CG 3.7Å; F402-P471 HydrophobicContact CE1-CG 3.38Å; F402-P471 HydrophobicContact CE2-CG 4.27Å; F402-P471 HydrophobicContact CG-CG 4.3Å; F402-P471 HydrophobicContact CZ-CG 3.68Å; F402-L474 HydrophobicContact CB-CD1 4.17Å; F402-L474 HydrophobicContact CB-CD2 4.39Å; F402-L474 HydrophobicContact CD1-CD2 4.49Å; F402-L474 HydrophobicContact CD2-CD2 3.62Å; F402-L474 HydrophobicContact CE2-CD2 3.98Å; F402-L474 HydrophobicContact CG-CD2 3.9Å
403	P	97.5	Very high	94.5	Very high	51 Å²	51	49.1 Å²	49.1	33%	0.331	26%	0.259	S	S	.	.			trans	-85.8	155.6	-176.4	35.8	-37	0	0	0	111.8	S405 F406 Y476	P403-S405 VanDerWaalsContact CB-O 3.3Å; P403-S405 WeakPolarHBondContact CB-O 3.2Å; P403-S405 WeakPolarHBondContact CG-O 3.39Å; P403-S405 PolarHBondContact O-N 2.68Å; P403-F406 HydrophobicContact CG-CB 3.88Å; P403-Y476 WeakPolarHBondContact O-CE1 3.32Å; P403-Y476 PolarHBondContact O-OH 3.19Å
404	S	97.2	Very high	95.1	Very high	56 Å²	56	47 Å²	47	39%	0.392	25%	0.249	S	C	.	.	S	Bend	trans	-63.5	-23	171.3	54.9	0	0	0	0	113	K423 L424	S404-K423 WeakPolarHBondContact O-CA 3.47Å; S404-L424 PolarHBondContact O-N 2.91Å
405	S	97.3	Very high	95.3	Very high	65 Å²	65	45.1 Å²	45.1	46%	0.455	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	154	169	65	0	0	0	0	112.2	P403 Y422	P403-S405 VanDerWaalsContact CB-O 3.3Å; P403-S405 WeakPolarHBondContact CB-O 3.2Å; P403-S405 WeakPolarHBondContact CG-O 3.39Å; P403-S405 PolarHBondContact O-N 2.68Å; S405-Y422 CarbonylContact C-O 3.57Å; S405-Y422 WeakPolarHBondContact CA-O 3.49Å; S405-Y422 WeakPolarHBondContact CB-O 3.31Å
406	F	97.2	Very high	95.3	Very high	16 Å²	16	52.7 Å²	52.7	7%	0.07	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	165.4	175	74.5	-76.8	0	0	0	112.8	L340 L344 L383 I385 P403 L408 L421 Y422 Y476	L340-F406 HydrophobicContact CD2-CD1 4.42Å; L340-F406 HydrophobicContact CD2-CE1 4.19Å; L344-F406 HydrophobicContact CD1-CD2 4.08Å; L344-F406 HydrophobicContact CD1-CE2 3.55Å; L344-F406 HydrophobicContact CD1-CZ 4.21Å; L383-F406 HydrophobicContact CD2-CZ 3.9Å; I385-F406 HydrophobicContact CD1-CZ 4.3Å; P403-F406 HydrophobicContact CG-CB 3.88Å; F406-L408 HydrophobicContact CE2-CB 4.25Å; F406-L408 HydrophobicContact CE2-CD1 3.62Å; F406-L408 HydrophobicContact CZ-CD1 4.05Å; F406-L421 WeakPolarHBondContact O-CA 3.04Å; F406-Y422 PolarHBondContact N-O 3.07Å; F406-Y422 PolarHBondContact O-N 2.85Å; F406-Y476 AromaticContact CD1-CD1 3.96Å; F406-Y476 HydrophobicContact CD1-CD1 3.96Å; F406-Y476 AromaticContact CD1-CE1 3.63Å; F406-Y476 HydrophobicContact CD1-CE1 3.63Å; F406-Y476 AromaticContact CD1-CZ 3.96Å; F406-Y476 AromaticContact CE1-CD1 3.68Å; F406-Y476 HydrophobicContact CE1-CD1 3.68Å; F406-Y476 AromaticContact CE1-CD2 3.98Å; F406-Y476 HydrophobicContact CE1-CD2 3.98Å; F406-Y476 AromaticContact CE1-CE1 3.67Å; F406-Y476 HydrophobicContact CE1-CE1 3.67Å; F406-Y476 AromaticContact CE1-CE2 3.93Å; F406-Y476 HydrophobicContact CE1-CE2 3.93Å; F406-Y476 AromaticContact CE1-CG 3.86Å; F406-Y476 HydrophobicContact CE1-CG 3.86Å; F406-Y476 AromaticContact CE1-CZ 3.8Å
407	N	96.8	Very high	95.2	Very high	54 Å²	54	54.3 Å²	54.3	29%	0.289	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	117.2	174.4	-178.2	9.9	0	0	0	110.2	R409 P410 P419 I420 L421	N407-R409 VanDerWaalsContact C-N 3.34Å; N407-R409 WeakPolarHBondContact OD1-CB 3.49Å; N407-R409 PolarHBondContact OD1-N 3.09Å; N407-P410 WeakPolarHBondContact O-CD 3.49Å; N407-P419 WeakPolarHBondContact OD1-CA 3.47Å; N407-I420 WeakPolarHBondContact CA-O 3.11Å; N407-I420 PolarHBondContact OD1-N 2.79Å; N407-I420 PolarHBondContact OD1-O 3.31Å; N407-L421 HydrophobicContact CB-CD2 3.89Å
408	L	96.7	Very high	95.4	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	32%	0.32	C	S	.	.			trans	-77.1	-21	178.7	-166.8	69.7	0	0	0	112.9	L344 I376 A379 L383 F406 P410 F411 I420 Y422	L344-L408 HydrophobicContact CD2-CD1 4.28Å; I376-L408 HydrophobicContact CD1-CD1 3.65Å; I376-L408 HydrophobicContact CD1-CD2 4.25Å; I376-L408 HydrophobicContact CD1-CG 4.11Å; I376-L408 HydrophobicContact CG2-CD2 4.35Å; A379-L408 HydrophobicContact CB-CD2 3.58Å; L383-L408 HydrophobicContact CD2-CD1 4.01Å; L383-L408 HydrophobicContact CD2-CD2 4.14Å; F406-L408 HydrophobicContact CE2-CB 4.25Å; F406-L408 HydrophobicContact CE2-CD1 3.62Å; F406-L408 HydrophobicContact CZ-CD1 4.05Å; L408-P410 VanDerWaalsContact O-N 3.16Å; L408-F411 PolarHBondContact O-N 2.85Å; L408-I420 PolarHBondContact N-O 2.85Å; L408-Y422 HydrophobicContact CB-CD2 3.85Å; L408-Y422 HydrophobicContact CB-CE2 3.76Å; L408-Y422 HydrophobicContact CD2-CD2 4.35Å; L408-Y422 HydrophobicContact CD2-CE2 3.57Å; L408-Y422 HydrophobicContact CG-CE2 4.27Å
409	R	96	Very high	95.4	Very high	29 Å²	29	58.5 Å²	58.5	11%	0.109	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-50.1	-42.4	-169.9	-169.6	61.6	160.4	174.7	-2.4	114.9	N407 F411 M412 Q414 S415 K416 L418	N407-R409 VanDerWaalsContact C-N 3.34Å; N407-R409 WeakPolarHBondContact OD1-CB 3.49Å; N407-R409 PolarHBondContact OD1-N 3.09Å; R409-F411 PolarHBondContact O-N 3.15Å; R409-F411 VanDerWaalsContact O-N 3.14Å; R409-M412 PolarHBondContact O-N 3.35Å; R409-M412 VanDerWaalsContact O-N 3.16Å; R409-Q414 WeakPolarHBondContact CD-O 3.49Å; R409-Q414 PolarHBondContact NE-O 3.15Å; R409-Q414 PolarHBondContact NH1-O 3.26Å; R409-Q414 VanDerWaalsContact NH1-O 3.15Å; R409-Q414 VanDerWaalsContact NH2-CD 3.28Å; R409-S415 WeakPolarHBondContact O-CA 3.4Å; R409-K416 PolarHBondContact NE-O 2.88Å; R409-K416 PolarHBondContact NH2-O 3.32Å; R409-L418 WeakPolarHBondContact CD-O 3.48Å; R409-L418 WeakPolarHBondContact CG-O 3.43Å; R409-L418 PolarHBondContact NE-O 3Å
410	P	96.2	Very high	95.5	Very high	71 Å²	71	56 Å²	56	46%	0.461	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-61	-23.4	179.6	-24.3	36.1	0	0	0	114.7	N407 L408	N407-P410 WeakPolarHBondContact O-CD 3.49Å; L408-P410 VanDerWaalsContact O-N 3.16Å
411	F	96.2	Very high	95.5	Very high	8 Å²	8	59.6 Å²	59.6	4%	0.035	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-93.9	1.1	-177.1	-53.4	-65.6	0	0	0	113.6	L344 V348 I376 L408 R409	L344-F411 HydrophobicContact CB-CD1 3.7Å; L344-F411 HydrophobicContact CB-CD2 3.9Å; L344-F411 HydrophobicContact CB-CE1 3.51Å; L344-F411 HydrophobicContact CB-CE2 3.7Å; L344-F411 HydrophobicContact CB-CG 3.88Å; L344-F411 HydrophobicContact CB-CZ 3.48Å; L344-F411 VanDerWaalsContact CB-CZ 3.48Å; L344-F411 HydrophobicContact CD1-CD2 3.91Å; L344-F411 HydrophobicContact CD1-CE2 3.71Å; L344-F411 HydrophobicContact CD1-CZ 4.28Å; L344-F411 HydrophobicContact CD2-CB 4.41Å; L344-F411 HydrophobicContact CD2-CD2 4.14Å; L344-F411 HydrophobicContact CD2-CG 4.15Å; L344-F411 HydrophobicContact CG-CD2 4.21Å; L344-F411 HydrophobicContact CG-CE2 4.21Å; L344-F411 HydrophobicContact CG-CG 4.45Å; L344-F411 HydrophobicContact CG-CZ 4.46Å; V348-F411 HydrophobicContact CG1-CB 4Å; V348-F411 HydrophobicContact CG1-CD1 4.3Å; V348-F411 HydrophobicContact CG2-CD1 3.89Å; I376-F411 HydrophobicContact CD1-CB 4.29Å; I376-F411 PolarHBondContact N-O 2.73Å; I376-F411 VanDerWaalsContact N-O 3.12Å; L408-F411 PolarHBondContact O-N 2.85Å; R409-F411 PolarHBondContact O-N 3.15Å; R409-F411 VanDerWaalsContact O-N 3.14Å
412	M	96.7	Very high	95.5	Very high	16 Å²	16	56 Å²	56	8%	0.079	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-89.4	156.1	-179.1	-63.4	-168.4	75.1	0	0	112.7	I376 A379 R409 Q414 S415 I420	I376-M412 HydrophobicContact CB-CG 4.21Å; I376-M412 HydrophobicContact CG2-CE 4.46Å; I376-M412 HydrophobicContact CG2-CG 4.4Å; I376-M412 CarbonylContact O-C 3.57Å; I376-M412 WeakPolarHBondContact O-CA 3.48Å; I376-M412 VanDerWaalsContact O-CB 3.25Å; I376-M412 WeakPolarHBondContact O-CB 3.26Å; A379-M412 HydrophobicContact CB-CE 4.12Å; R409-M412 PolarHBondContact O-N 3.35Å; R409-M412 VanDerWaalsContact O-N 3.16Å; M412-Q414 PolarHBondContact O-N 3.24Å; M412-S415 PolarHBondContact O-N 3.41Å; M412-I420 HydrophobicContact CE-CD1 4.49Å; M412-I420 HydrophobicContact SD-CD1 3.68Å
413	T	95.1	Very high	95.5	Very high	44 Å²	44	61.4 Å²	61.4	27%	0.27	35%	0.347	S	S	.	.	S	Bend	trans	-55.2	-39.8	172.8	-43.6	0	0	0	0	111	T375 I376 Y377	T375-T413 PolarHBondContact OG1-OG1 2.72Å; I376-T413 PolarHBondContact O-N 3.48Å; Y377-T413 WeakPolarHBondContact CA-OG1 3.44Å; Y377-T413 HydrophobicContact CD2-CG2 4.37Å
414	Q	92.9	Very high	95.6	Very high	111 Å²	111	59.2 Å²	59.2	52%	0.519	33%	0.332	S	S	.	.	S	Bend	trans	-96.3	85.9	167.3	-169.9	-168.9	47.4	0	0	109.6	R409 M412 K416	R409-Q414 WeakPolarHBondContact CD-O 3.49Å; R409-Q414 PolarHBondContact NE-O 3.15Å; R409-Q414 PolarHBondContact NH1-O 3.26Å; R409-Q414 VanDerWaalsContact NH1-O 3.15Å; R409-Q414 VanDerWaalsContact NH2-CD 3.28Å; M412-Q414 PolarHBondContact O-N 3.24Å; Q414-K416 VanDerWaalsContact C-N 3.35Å; Q414-K416 PolarHBondContact O-N 2.91Å
415	S	92.7	Very high	95.6	Very high	69 Å²	69	57.1 Å²	57.1	48%	0.483	32%	0.316	S	S	.	.			trans	-77.4	-14.5	-176.7	59.3	0	0	0	0	115	R409 M412	R409-S415 WeakPolarHBondContact O-CA 3.4Å; M412-S415 PolarHBondContact O-N 3.41Å
416	K	92.6	Very high	95.7	Very high	179 Å²	179	54 Å²	54	78%	0.778	29%	0.294	S	S	*	.	S	Bend	trans	-96.7	137.4	178.6	-62.4	-174.9	179.9	-177.4	0	111.8	R409 Q414	R409-K416 PolarHBondContact NE-O 2.88Å; R409-K416 PolarHBondContact NH2-O 3.32Å; Q414-K416 VanDerWaalsContact C-N 3.35Å; Q414-K416 PolarHBondContact O-N 2.91Å
417	G	90.5	Very high	95.7	Very high	61 Å²	61	53.3 Å²	53.3	63%	0.629	29%	0.291	S	S	*	.	S	Bend	trans	129.3	-160.9	173.2	0	0	0	0	0	112.8
418	L	92.5	Very high	95.8	Very high	144 Å²	144	50.7 Å²	50.7	75%	0.754	28%	0.277	S	S	*	.	S	Bend	trans	-55.4	144.8	-178.9	-66.7	175.7	0	0	0	112.4	R409	R409-L418 WeakPolarHBondContact CD-O 3.48Å; R409-L418 WeakPolarHBondContact CG-O 3.43Å; R409-L418 PolarHBondContact NE-O 3Å
419	P	93.5	Very high	95.9	Very high	68 Å²	68	51 Å²	51	44%	0.442	28%	0.278	S	S	.	.			trans	-67	144.7	176	30.2	-35.5	0	0	0	110.6	N407 L421	N407-P419 WeakPolarHBondContact OD1-CA 3.47Å; P419-L421 HydrophobicContact CB-CD2 4.09Å; P419-L421 HydrophobicContact CB-CG 4.3Å
420	I	95	Very high	95.9	Very high	49 Å²	49	50.1 Å²	50.1	25%	0.251	28%	0.276	S	S	.	.			trans	-113.3	93	172.7	-58.6	-173.3	0	0	0	106.6	N407 L408 M412 Y422	N407-I420 WeakPolarHBondContact CA-O 3.11Å; N407-I420 PolarHBondContact OD1-N 2.79Å; N407-I420 PolarHBondContact OD1-O 3.31Å; L408-I420 PolarHBondContact N-O 2.85Å; M412-I420 HydrophobicContact CE-CD1 4.49Å; M412-I420 HydrophobicContact SD-CD1 3.68Å; I420-Y422 HydrophobicContact CG2-CD2 4.34Å; I420-Y422 HydrophobicContact CG2-CE2 3.67Å
421	L	97.2	Very high	95.8	Very high	76 Å²	76	50.5 Å²	50.5	40%	0.398	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	134	-174.5	-59.1	-178.6	0	0	0	110.8	F406 N407 P419 A478 V479	F406-L421 WeakPolarHBondContact O-CA 3.04Å; N407-L421 HydrophobicContact CB-CD2 3.89Å; P419-L421 HydrophobicContact CB-CD2 4.09Å; P419-L421 HydrophobicContact CB-CG 4.3Å; L421-A478 WeakPolarHBondContact O-CA 3.44Å; L421-V479 HydrophobicContact CB-CB 4.18Å; L421-V479 HydrophobicContact CB-CG2 3.97Å; L421-V479 WeakPolarHBondContact O-CG2 3.4Å; L421-V479 PolarHBondContact O-N 2.97Å
422	Y	98.1	Very high	95.5	Very high	1 Å²	1	51.7 Å²	51.7	0%	0.004	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	142	174.7	-81.9	-86.2	0	0	0	110.4	A379 P380 L383 S405 F406 L408 I420 E477 A478	A379-Y422 VanDerWaalsContact CB-OH 3.29Å; A379-Y422 WeakPolarHBondContact CB-OH 3.23Å; P380-Y422 WeakPolarHBondContact O-CE1 3.42Å; P380-Y422 PolarHBondContact O-OH 2.77Å; L383-Y422 HydrophobicContact CB-CD1 3.93Å; L383-Y422 HydrophobicContact CB-CE1 3.53Å; L383-Y422 HydrophobicContact CD2-CD1 4.37Å; L383-Y422 HydrophobicContact CD2-CD2 4.42Å; L383-Y422 HydrophobicContact CD2-CE1 4.3Å; L383-Y422 HydrophobicContact CD2-CE2 4.34Å; L383-Y422 HydrophobicContact CD2-CG 4.43Å; S405-Y422 CarbonylContact C-O 3.57Å; S405-Y422 WeakPolarHBondContact CA-O 3.49Å; S405-Y422 WeakPolarHBondContact CB-O 3.31Å; F406-Y422 PolarHBondContact N-O 3.07Å; F406-Y422 PolarHBondContact O-N 2.85Å; L408-Y422 HydrophobicContact CB-CD2 3.85Å; L408-Y422 HydrophobicContact CB-CE2 3.76Å; L408-Y422 HydrophobicContact CD2-CD2 4.35Å; L408-Y422 HydrophobicContact CD2-CE2 3.57Å; L408-Y422 HydrophobicContact CG-CE2 4.27Å; I420-Y422 HydrophobicContact CG2-CD2 4.34Å; I420-Y422 HydrophobicContact CG2-CE2 3.67Å; Y422-E477 CarbonylContact C-O 3.57Å; Y422-E477 VanDerWaalsContact CA-O 3.31Å; Y422-E477 WeakPolarHBondContact CA-O 3.44Å; Y422-A478 HydrophobicContact CD1-CB 4.23Å; Y422-A478 HydrophobicContact CE1-CB 3.76Å
423	K	97.6	Very high	94.8	Very high	122 Å²	122	60.9 Å²	60.9	53%	0.53	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	137.7	171.2	-76.8	172.5	-175	176.5	0	110.4	S404 Y476 E477 V479	S404-K423 WeakPolarHBondContact O-CA 3.47Å; K423-Y476 VanDerWaalsContact C-CD1 3.44Å; K423-Y476 CarbonylContact O-C 2.92Å; K423-Y476 VanDerWaalsContact O-CA 3.26Å; K423-Y476 WeakPolarHBondContact O-CA 3.42Å; K423-E477 PolarHBondContact N-O 3.33Å; K423-E477 PolarHBondContact O-N 2.6Å; K423-V479 HydrophobicContact CB-CG2 4.37Å; K423-V479 HydrophobicContact CD-CG2 3.76Å; K423-V479 HydrophobicContact CG-CG2 3.61Å
424	L	98.5	Very high	94.3	Very high	5 Å²	5	61 Å²	61	3%	0.026	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	128.2	175.2	-173	78	0	0	0	109.2	F402 S404 I427 W450 V466 L467 L474 Y476	F402-L424 HydrophobicContact CD2-CD2 3.94Å; F402-L424 HydrophobicContact CE2-CD2 3.7Å; S404-L424 PolarHBondContact O-N 2.91Å; L424-I427 HydrophobicContact CD1-CG2 3.82Å; L424-I427 HydrophobicContact CD2-CG2 3.99Å; L424-I427 HydrophobicContact CG-CG2 4.27Å; L424-W450 HydrophobicContact CD2-CH2 4Å; L424-W450 HydrophobicContact CD2-CZ2 4.25Å; L424-W450 HydrophobicContact CG-CH2 4.05Å; L424-W450 HydrophobicContact CG-CZ2 4.47Å; L424-V466 HydrophobicContact CD2-CG1 4.35Å; L424-L467 HydrophobicContact CD2-CD2 4.31Å; L424-L474 HydrophobicContact CD1-CB 4.3Å; L424-L474 HydrophobicContact CD1-CD2 4.21Å; L424-Y476 HydrophobicContact CB-CD1 4Å; L424-Y476 HydrophobicContact CB-CE1 3.61Å; L424-Y476 HydrophobicContact CD1-CD1 4.29Å; L424-Y476 HydrophobicContact CD1-CD2 4.03Å; L424-Y476 HydrophobicContact CD1-CE1 3.89Å; L424-Y476 HydrophobicContact CD1-CE2 3.64Å; L424-Y476 HydrophobicContact CD1-CG 4.34Å; L424-Y476 HydrophobicContact CG-CE1 4.37Å; L424-Y476 VanDerWaalsContact N-CD1 3.35Å
425	Y	98.3	Very high	93.9	Very high	12 Å²	12	57.6 Å²	57.6	5%	0.047	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	-17.6	175.9	76.9	-87.9	0	0	0	113.9	A189 T190 I382 T444 L445 W450 F475 E477	A189-Y425 HydrophobicContact CB-CD2 4.05Å; A189-Y425 HydrophobicContact CB-CE2 4.15Å; A189-Y425 WeakPolarHBondContact O-CE2 3.34Å; T190-Y425 WeakPolarHBondContact CG2-OH 3.4Å; T190-Y425 PolarHBondContact OG1-OH 3.23Å; I382-Y425 HydrophobicContact CD1-CE1 4.08Å; I382-Y425 HydrophobicContact CG2-CE1 4.2Å; I382-Y425 VanDerWaalsContact CG2-OH 3.24Å; I382-Y425 WeakPolarHBondContact CG2-OH 3.28Å; Y425-T444 CarbonylContact O-C 3.6Å; Y425-T444 WeakPolarHBondContact O-CA 3.41Å; Y425-L445 WeakPolarHBondContact O-CB 3.42Å; Y425-L445 PolarHBondContact O-N 3.41Å; Y425-W450 WeakPolarHBondContact O-CZ3 3.28Å; Y425-F475 HydrophobicContact CD1-CB 4.3Å; Y425-F475 WeakPolarHBondContact CD1-O 3.17Å; Y425-F475 HydrophobicContact CE1-CB 3.72Å; Y425-F475 HydrophobicContact CE2-CB 4.24Å; Y425-F475 PolarHBondContact N-O 2.87Å; Y425-E477 HydrophobicContact CD1-CB 3.76Å; Y425-E477 HydrophobicContact CE1-CB 4.03Å
426	A	98.7	Very high	93.5	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	154.5	170	0	0	0	0	0	113.5	C186 F443 T444 F475	C186-A426 HydrophobicContact CB-CB 3.92Å; A426-F443 CarbonylContact C-O 3.58Å; A426-F443 WeakPolarHBondContact CA-O 3.49Å; A426-F443 WeakPolarHBondContact CB-O 3.48Å; A426-T444 HydrophobicContact CB-CG2 3.89Å; A426-F475 HydrophobicContact CB-CB 3.99Å; A426-F475 HydrophobicContact CB-CD2 4.22Å; A426-F475 HydrophobicContact CB-CG 4.29Å; A426-F475 PolarHBondContact N-O 3.46Å; A426-F475 PolarHBondContact O-N 3.42Å
427	I	98.7	Very high	93.2	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	155	169.9	60.5	161.1	0	0	0	111.1	F402 L424 S442 F443 V466 Q469 P471 L473 L474	F402-I427 HydrophobicContact CE2-CG2 4.1Å; F402-I427 HydrophobicContact CZ-CD1 4.37Å; L424-I427 HydrophobicContact CD1-CG2 3.82Å; L424-I427 HydrophobicContact CD2-CG2 3.99Å; L424-I427 HydrophobicContact CG-CG2 4.27Å; I427-S442 CarbonylContact O-C 3.54Å; I427-S442 VanDerWaalsContact O-CA 3.28Å; I427-S442 WeakPolarHBondContact O-CA 3.37Å; I427-F443 HydrophobicContact CD1-CB 4.38Å; I427-F443 HydrophobicContact CD1-CD2 3.8Å; I427-F443 HydrophobicContact CD1-CG 4.35Å; I427-F443 HydrophobicContact CG1-CB 3.77Å; I427-F443 HydrophobicContact CG1-CD2 3.86Å; I427-F443 HydrophobicContact CG1-CG 4.21Å; I427-F443 PolarHBondContact N-O 3.16Å; I427-F443 PolarHBondContact O-N 3.19Å; I427-V466 HydrophobicContact CD1-CG1 3.87Å; I427-V466 HydrophobicContact CG1-CG1 4.16Å; I427-Q469 HydrophobicContact CD1-CB 3.84Å; I427-Q469 HydrophobicContact CD1-CG 3.95Å; I427-P471 HydrophobicContact CB-CB 4.1Å; I427-P471 HydrophobicContact CD1-CB 4.28Å; I427-P471 HydrophobicContact CG2-CB 4.32Å; I427-L473 CarbonylContact C-O 3.59Å; I427-L473 VanDerWaalsContact CA-O 3.3Å; I427-L473 WeakPolarHBondContact CA-O 3.36Å; I427-L474 HydrophobicContact CB-CD2 4.5Å; I427-L474 HydrophobicContact CG2-CD2 3.53Å
428	V	98.7	Very high	93.4	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	122.7	167.6	179.8	0	0	0	0	108.7	C186 Y440 V441 Y472 L473 F475	C186-V428 WeakPolarHBondContact SG-CG2 3.37Å; V428-Y440 HydrophobicContact CG1-CD1 3.8Å; V428-V441 WeakPolarHBondContact CA-O 3.46Å; V428-Y472 PolarHBondContact O-N 2.9Å; V428-L473 HydrophobicContact CB-CB 4.05Å; V428-L473 HydrophobicContact CB-CD1 4.26Å; V428-L473 HydrophobicContact CB-CG 4.38Å; V428-L473 HydrophobicContact CG2-CB 4.37Å; V428-L473 HydrophobicContact CG2-CD1 4.28Å; V428-L473 PolarHBondContact N-O 2.98Å; V428-L473 PolarHBondContact O-N 3.33Å; V428-L473 VanDerWaalsContact O-N 3.09Å; V428-F475 HydrophobicContact CG2-CE2 4.25Å
429	N	97.5	Very high	93.6	Very high	6 Å²	6	52.3 Å²	52.3	3%	0.032	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	155.7	170.6	-76.2	1.5	0	0	0	111	Y440 V441 Q469 P471	N429-Y440 WeakPolarHBondContact O-CA 3.28Å; N429-Y440 VanDerWaalsContact O-CD1 3.31Å; N429-Y440 WeakPolarHBondContact O-CD1 3.26Å; N429-V441 PolarHBondContact N-O 3.08Å; N429-V441 PolarHBondContact O-N 3.28Å; N429-Q469 PolarHBondContact ND2-OE1 3.1Å; N429-P471 WeakPolarHBondContact OD1-CA 3.33Å
430	H	96.7	Very high	93.8	Very high	11 Å²	11	49.8 Å²	49.8	5%	0.051	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	110.8	158.7	178.2	-83.8	0	0	0	109.7	F390 K395 S434 H439 Y440	F390-H430 AromaticContact CE1-ND1 3.93Å; F390-H430 HydrophobicContact CZ-CB 3.91Å; F390-H430 AromaticContact CZ-CD2 3.76Å; F390-H430 AromaticContact CZ-CG 3.59Å; F390-H430 AromaticContact CZ-ND1 3.9Å; K395-H430 WeakPolarHBondContact CE-O 3.44Å; K395-H430 PolarHBondContact NZ-O 2.78Å; H430-S434 PolarHBondContact CE1-O 3.04Å; H430-H439 CarbonylContact C-O 3.53Å; H430-H439 WeakPolarHBondContact CA-O 3.39Å; H430-Y440 HydrophobicContact CB-CD1 4.03Å; H430-Y440 HydrophobicContact CB-CE1 3.84Å; H430-Y440 AromaticContact CD2-CE1 3.75Å; H430-Y440 AromaticContact CD2-CE2 3.72Å; H430-Y440 AromaticContact CD2-CZ 3.58Å
431	E	93.9	Very high	94	Very high	78 Å²	78	47.5 Å²	47.5	36%	0.364	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	150.5	176.8	-65.8	169.6	-177	0	0	110.3	G438 H439 V441	E431-G438 CarbonylContact O-C 3.53Å; E431-G438 WeakPolarHBondContact O-CA 3.45Å; E431-H439 HydrophobicContact CB-CB 4.39Å; E431-H439 PolarHBondContact N-O 3.34Å; E431-H439 PolarHBondContact O-N 3.19Å; E431-H439 IonicContact OE2-CD2 3.45Å; E431-V441 WeakPolarHBondContact OE1-CG2 3.27Å
432	G	89.6	Confident	94.1	Very high	33 Å²	33	43.9 Å²	43.9	34%	0.34	22%	0.216	S	C	.	.	S	Bend	trans	92.3	157.9	-173	0	0	0	0	0	114.1	K395	K395-G432 WeakPolarHBondContact CD-O 3.48Å; K395-G432 WeakPolarHBondContact CE-O 3.4Å; K395-G432 PolarHBondContact NZ-O 3.27Å
433	Y	81.9	Confident	94.1	Very high	210 Å²	210	44.1 Å²	44.1	82%	0.824	22%	0.217	S	C	*	.	S	Bend	trans	-90.2	-15	-163.8	-56.9	-76	0	0	0	115.4	K395	K395-Y433 WeakPolarHBondContact CB-O 3.44Å
434	S	85.6	Confident	94.1	Very high	46 Å²	46	38.3 Å²	38.3	32%	0.322	19%	0.192	S	C	.	.			trans	-105.5	165.1	-172.1	88	0	0	0	0	113.1	H430 R436 S437	H430-S434 PolarHBondContact CE1-O 3.04Å; S434-R436 VanDerWaalsContact C-N 3.35Å; S434-R436 PolarHBondContact OG-N 3.44Å; S434-S437 WeakPolarHBondContact OG-CA 3.46Å; S434-S437 PolarHBondContact OG-N 2.89Å; S434-S437 PolarHBondContact OG-O 3.04Å
435	C	84.4	Confident	94.1	Very high	39 Å²	39	40.4 Å²	40.4	26%	0.264	20%	0.203	S	C	.	.	S	Bend	trans	-91.7	10.1	169.9	64.1	0	0	0	0	113.5	F390	F390-C435 HydrophobicContact CD1-CB 3.85Å
436	R	83.7	Confident	93.9	Very high	212 Å²	212	40.1 Å²	40.1	80%	0.8	20%	0.201	S	C	*	.	S	Bend	trans	-126.6	-19.1	-176	-74.7	-178.7	171	176	-1.7	114.3	S434	S434-R436 VanDerWaalsContact C-N 3.35Å; S434-R436 PolarHBondContact OG-N 3.44Å
437	S	87.7	Confident	93.7	Very high	71 Å²	71	44.6 Å²	44.6	50%	0.497	22%	0.222	S	C	.	.	S	Bend	trans	-150.8	127	-176	-178.1	0	0	0	0	108.8	Q265 S434	Q265-S437 VanDerWaalsContact OE1-CA 3.26Å; S434-S437 WeakPolarHBondContact OG-CA 3.46Å; S434-S437 PolarHBondContact OG-N 2.89Å; S434-S437 PolarHBondContact OG-O 3.04Å
438	G	93.2	Very high	93.4	Very high	16 Å²	16	48 Å²	48	17%	0.165	26%	0.257	C	S	.	.			trans	-176.6	-155.8	176.1	0	0	0	0	0	111.1	Q265 E431	Q265-G438 PolarHBondContact NE2-O 2.77Å; Q265-G438 PolarHBondContact OE1-O 3.29Å; E431-G438 CarbonylContact O-C 3.53Å; E431-G438 WeakPolarHBondContact O-CA 3.45Å
439	H	97.2	Very high	93.3	Very high	44 Å²	44	52.9 Å²	52.9	20%	0.204	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	143.6	179.9	-176.1	45.6	0	0	0	110.9	C178 H430 E431 N454 D455	C178-H439 VanDerWaalsContact CB-CE1 3.44Å; C178-H439 WeakPolarHBondContact CB-CE1 3.48Å; C178-H439 WeakPolarHBondContact CB-ND1 3.19Å; C178-H439 PolarHBondContact SG-ND1 3.41Å; H430-H439 CarbonylContact C-O 3.53Å; H430-H439 WeakPolarHBondContact CA-O 3.39Å; E431-H439 HydrophobicContact CB-CB 4.39Å; E431-H439 PolarHBondContact N-O 3.34Å; E431-H439 PolarHBondContact O-N 3.19Å; E431-H439 IonicContact OE2-CD2 3.45Å; H439-N454 PolarHBondContact NE2-OD1 2.91Å; H439-D455 IonicContact CE1-OD2 2.72Å; H439-D455 PolarHBondContact CE1-OD2 3.34Å
440	Y	98.3	Very high	93.3	Very high	14 Å²	14	53.2 Å²	53.2	6%	0.055	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	123.5	179.7	-73.9	-83.4	0	0	0	111	Y179 S182 D267 A268 V428 N429 H430 Y472	Y179-Y440 VanDerWaalsContact CB-CD2 3.47Å; S182-Y440 WeakPolarHBondContact OG-CB 3.43Å; D267-Y440 PolarHBondContact OD1-OH 3.04Å; A268-Y440 HydrophobicContact CB-CD1 3.8Å; A268-Y440 HydrophobicContact CB-CE1 3.44Å; A268-Y440 VanDerWaalsContact CB-CE1 3.44Å; A268-Y440 HydrophobicContact CB-CE2 4.21Å; A268-Y440 HydrophobicContact CB-CG 4.32Å; A268-Y440 PolarHBondContact N-OH 3.36Å; V428-Y440 HydrophobicContact CG1-CD1 3.8Å; N429-Y440 WeakPolarHBondContact O-CA 3.28Å; N429-Y440 VanDerWaalsContact O-CD1 3.31Å; N429-Y440 WeakPolarHBondContact O-CD1 3.26Å; H430-Y440 HydrophobicContact CB-CD1 4.03Å; H430-Y440 HydrophobicContact CB-CE1 3.84Å; H430-Y440 AromaticContact CD2-CE1 3.75Å; H430-Y440 AromaticContact CD2-CE2 3.72Å; H430-Y440 AromaticContact CD2-CZ 3.58Å; Y440-Y472 AromaticContact CE1-CD1 3.86Å; Y440-Y472 HydrophobicContact CE1-CD1 3.86Å; Y440-Y472 HydrophobicContact CE1-CE1 4.25Å
441	V	98.4	Very high	93.4	Very high	2 Å²	2	53.2 Å²	53.2	1%	0.012	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	142.4	176.9	177.7	0	0	0	0	108.3	V428 N429 E431 F443 N454	V428-V441 WeakPolarHBondContact CA-O 3.46Å; N429-V441 PolarHBondContact N-O 3.08Å; N429-V441 PolarHBondContact O-N 3.28Å; E431-V441 WeakPolarHBondContact OE1-CG2 3.27Å; V441-F443 HydrophobicContact CG1-CE2 4.12Å; V441-F443 HydrophobicContact CG1-CZ 4.41Å; V441-N454 HydrophobicContact CG1-CB 4Å; V441-N454 HydrophobicContact CG2-CB 4.06Å
442	S	98.6	Very high	93.6	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	153.9	176.1	55.5	0	0	0	0	111.8	S182 Q185 I427 L453	S182-S442 WeakPolarHBondContact O-CB 3.43Å; Q185-S442 WeakPolarHBondContact CB-OG 3.37Å; I427-S442 CarbonylContact O-C 3.54Å; I427-S442 VanDerWaalsContact O-CA 3.28Å; I427-S442 WeakPolarHBondContact O-CA 3.37Å; S442-L453 PolarHBondContact N-O 3.39Å; S442-L453 VanDerWaalsContact N-O 3.09Å; S442-L453 WeakPolarHBondContact O-CA 3.23Å; S442-L453 WeakPolarHBondContact O-CB 3.32Å; S442-L453 PolarHBondContact O-N 3.49Å; S442-L453 WeakPolarHBondContact OG-CB 3.29Å; S442-L453 PolarHBondContact OG-O 3.1Å
443	F	98.6	Very high	94	Very high	5 Å²	5	49 Å²	49	2%	0.022	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	135.9	168.1	-59.6	-100.5	0	0	0	108.4	A426 I427 V441 W450 L451 S452 T461 H465 V466 Q469	A426-F443 CarbonylContact C-O 3.58Å; A426-F443 WeakPolarHBondContact CA-O 3.49Å; A426-F443 WeakPolarHBondContact CB-O 3.48Å; I427-F443 HydrophobicContact CD1-CB 4.38Å; I427-F443 HydrophobicContact CD1-CD2 3.8Å; I427-F443 HydrophobicContact CD1-CG 4.35Å; I427-F443 HydrophobicContact CG1-CB 3.77Å; I427-F443 HydrophobicContact CG1-CD2 3.86Å; I427-F443 HydrophobicContact CG1-CG 4.21Å; I427-F443 PolarHBondContact N-O 3.16Å; I427-F443 PolarHBondContact O-N 3.19Å; V441-F443 HydrophobicContact CG1-CE2 4.12Å; V441-F443 HydrophobicContact CG1-CZ 4.41Å; F443-W450 HydrophobicContact CB-CE3 4.26Å; F443-W450 HydrophobicContact CB-CZ3 4.36Å; F443-L451 CarbonylContact C-O 3.58Å; F443-L451 WeakPolarHBondContact CA-O 3.41Å; F443-S452 VanDerWaalsContact CE1-OG 3.3Å; F443-S452 WeakPolarHBondContact CE1-OG 3.43Å; F443-T461 HydrophobicContact CD1-CG2 3.97Å; F443-T461 HydrophobicContact CE1-CG2 4.38Å; F443-H465 AromaticContact CE1-CE1 3.91Å; F443-H465 AromaticContact CE1-ND1 3.98Å; F443-V466 HydrophobicContact CB-CG2 4.21Å; F443-V466 HydrophobicContact CD1-CG2 4.05Å; F443-V466 HydrophobicContact CG-CG2 4.31Å; F443-Q469 HydrophobicContact CD2-CG 4.46Å; F443-Q469 HydrophobicContact CE2-CG 3.98Å; F443-Q469 HydrophobicContact CZ-CG 4.21Å
444	T	98.4	Very high	94.8	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	135.2	178.7	69.2	0	0	0	0	112.1	A189 Y425 A426 R446 W450 L451 L453	A189-T444 HydrophobicContact CB-CG2 3.88Å; Y425-T444 CarbonylContact O-C 3.6Å; Y425-T444 WeakPolarHBondContact O-CA 3.41Å; A426-T444 HydrophobicContact CB-CG2 3.89Å; T444-R446 PolarHBondContact OG1-NE 3.22Å; T444-W450 VanDerWaalsContact C-CE3 3.44Å; T444-L451 PolarHBondContact N-O 3.33Å; T444-L451 PolarHBondContact O-N 2.86Å; T444-L453 HydrophobicContact CG2-CD1 3.86Å; T444-L453 WeakPolarHBondContact OG1-CD1 3.44Å
445	L	97.5	Very high	95.4	Very high	50 Å²	50	40.1 Å²	40.1	26%	0.262	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	121.5	167.6	-176.2	62.5	0	0	0	109.1	Y425 G448 Q449 W450	Y425-L445 WeakPolarHBondContact O-CB 3.42Å; Y425-L445 PolarHBondContact O-N 3.41Å; L445-G448 VanDerWaalsContact CD1-C 3.45Å; L445-G448 WeakPolarHBondContact CD1-O 3.37Å; L445-Q449 WeakPolarHBondContact CA-O 3.27Å; L445-W450 HydrophobicContact CB-CD2 3.98Å; L445-W450 HydrophobicContact CB-CE3 4.07Å; L445-W450 HydrophobicContact CB-CH2 4.07Å; L445-W450 HydrophobicContact CB-CZ2 3.99Å; L445-W450 HydrophobicContact CB-CZ3 4.11Å; L445-W450 HydrophobicContact CD1-CD2 4.28Å; L445-W450 HydrophobicContact CD1-CG 4.16Å; L445-W450 HydrophobicContact CD2-CZ2 4.46Å
446	R	95.5	Very high	96	Very high	5 Å²	5	39.6 Å²	39.6	2%	0.019	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	124.1	173.9	-55.4	-168.9	-168.5	-170.8	1.3	108.6	I164 P165 Q185 T444 G448 Q449 L451	I164-R446 HydrophobicContact CG2-CB 4.06Å; I164-R446 HydrophobicContact CG2-CG 3.86Å; P165-R446 WeakPolarHBondContact O-CD 3.41Å; Q185-R446 PolarHBondContact O-NH2 2.91Å; T444-R446 PolarHBondContact OG1-NE 3.22Å; R446-G448 PolarHBondContact O-N 3.46Å; R446-G448 VanDerWaalsContact O-N 3.16Å; R446-Q449 PolarHBondContact N-O 2.87Å; R446-Q449 PolarHBondContact O-N 2.94Å; R446-L451 HydrophobicContact CG-CD1 4.39Å
447	H	93.5	Very high	96.6	Very high	95 Å²	95	37 Å²	37	44%	0.44	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	40.2	179.6	-61.6	-93.2	0	0	0	114	A161 I164 Q449	A161-H447 PolarHBondContact O-CE1 2.78Å; I164-H447 PolarHBondContact O-NE2 3.03Å; H447-Q449 VanDerWaalsContact C-N 3.32Å; H447-Q449 PolarHBondContact O-N 3.05Å
448	G	93.3	Very high	97.1	Very high	70 Å²	70	36.3 Å²	36.3	72%	0.722	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	86	-13.2	-179.7	0	0	0	0	0	115.7	L445 R446	L445-G448 VanDerWaalsContact CD1-C 3.45Å; L445-G448 WeakPolarHBondContact CD1-O 3.37Å; R446-G448 PolarHBondContact O-N 3.46Å; R446-G448 VanDerWaalsContact O-N 3.16Å
449	Q	96.2	Very high	97.3	Very high	103 Å²	103	38.8 Å²	38.8	48%	0.481	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	131.7	179.7	-170.8	170.1	55.2	0	0	111.8	L445 R446 H447 L451 T460	L445-Q449 WeakPolarHBondContact CA-O 3.27Å; R446-Q449 PolarHBondContact N-O 2.87Å; R446-Q449 PolarHBondContact O-N 2.94Å; H447-Q449 VanDerWaalsContact C-N 3.32Å; H447-Q449 PolarHBondContact O-N 3.05Å; Q449-L451 HydrophobicContact CG-CD2 4.34Å; Q449-T460 HydrophobicContact CG-CG2 4.3Å
450	W	98	Very high	97.3	Very high	13 Å²	13	40.9 Å²	40.9	5%	0.049	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	132.1	170	-78.7	102.3	0	0	0	110.6	L424 Y425 F443 T444 L445 T461 T463 V466	L424-W450 HydrophobicContact CD2-CH2 4Å; L424-W450 HydrophobicContact CD2-CZ2 4.25Å; L424-W450 HydrophobicContact CG-CH2 4.05Å; L424-W450 HydrophobicContact CG-CZ2 4.47Å; Y425-W450 WeakPolarHBondContact O-CZ3 3.28Å; F443-W450 HydrophobicContact CB-CE3 4.26Å; F443-W450 HydrophobicContact CB-CZ3 4.36Å; T444-W450 VanDerWaalsContact C-CE3 3.44Å; L445-W450 HydrophobicContact CB-CD2 3.98Å; L445-W450 HydrophobicContact CB-CE3 4.07Å; L445-W450 HydrophobicContact CB-CH2 4.07Å; L445-W450 HydrophobicContact CB-CZ2 3.99Å; L445-W450 HydrophobicContact CB-CZ3 4.11Å; L445-W450 HydrophobicContact CD1-CD2 4.28Å; L445-W450 HydrophobicContact CD1-CG 4.16Å; L445-W450 HydrophobicContact CD2-CZ2 4.46Å; W450-T461 HydrophobicContact CB-CG2 3.65Å; W450-T461 PolarHBondContact O-N 2.99Å; W450-T463 PolarHBondContact NE1-OG1 2.92Å; W450-V466 HydrophobicContact CB-CG2 4.27Å; W450-V466 HydrophobicContact CD2-CB 4.47Å; W450-V466 HydrophobicContact CD2-CG1 4.4Å; W450-V466 HydrophobicContact CD2-CG2 3.84Å; W450-V466 HydrophobicContact CE3-CG1 4.16Å; W450-V466 HydrophobicContact CE3-CG2 3.86Å; W450-V466 HydrophobicContact CG-CG2 4.03Å; W450-V466 HydrophobicContact CH2-CG1 4.07Å; W450-V466 HydrophobicContact CZ2-CG1 4.29Å; W450-V466 HydrophobicContact CZ3-CG1 3.99Å; W450-V466 HydrophobicContact CZ3-CG2 4.5Å
451	L	97.9	Very high	97.2	Very high	12 Å²	12	41.9 Å²	41.9	6%	0.063	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	132.9	174.1	-55.8	179	0	0	0	109.7	A168 F443 T444 R446 Q449 L453 S459 T460	A168-L451 HydrophobicContact CB-CD1 3.72Å; F443-L451 CarbonylContact C-O 3.58Å; F443-L451 WeakPolarHBondContact CA-O 3.41Å; T444-L451 PolarHBondContact N-O 3.33Å; T444-L451 PolarHBondContact O-N 2.86Å; R446-L451 HydrophobicContact CG-CD1 4.39Å; Q449-L451 HydrophobicContact CG-CD2 4.34Å; L451-L453 HydrophobicContact CB-CD2 4.21Å; L451-L453 HydrophobicContact CB-CG 4.26Å; L451-S459 CarbonylContact C-O 3.57Å; L451-S459 WeakPolarHBondContact CA-O 3.31Å; L451-T460 HydrophobicContact CD2-CG2 4.02Å
452	S	98.1	Very high	97.1	Very high	19 Å²	19	45.9 Å²	45.9	13%	0.133	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	132.6	163.3	-174.5	0	0	0	0	109.2	F443 V458 S459	F443-S452 VanDerWaalsContact CE1-OG 3.3Å; F443-S452 WeakPolarHBondContact CE1-OG 3.43Å; S452-V458 WeakPolarHBondContact O-CA 3.4Å; S452-S459 PolarHBondContact N-O 3.24Å; S452-S459 PolarHBondContact O-N 3.32Å
453	L	98.2	Very high	97.1	Very high	3 Å²	3	48.6 Å²	48.6	2%	0.016	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	87.3	-169.2	-60.1	172.7	0	0	0	108.9	A168 Q185 S442 T444 L451 V458	A168-L453 HydrophobicContact CB-CD1 4.44Å; A168-L453 HydrophobicContact CB-CD2 3.59Å; Q185-L453 HydrophobicContact CB-CD1 3.71Å; Q185-L453 HydrophobicContact CG-CB 4.16Å; Q185-L453 HydrophobicContact CG-CD1 3.88Å; S442-L453 PolarHBondContact N-O 3.39Å; S442-L453 VanDerWaalsContact N-O 3.09Å; S442-L453 WeakPolarHBondContact O-CA 3.23Å; S442-L453 WeakPolarHBondContact O-CB 3.32Å; S442-L453 PolarHBondContact O-N 3.49Å; S442-L453 WeakPolarHBondContact OG-CB 3.29Å; S442-L453 PolarHBondContact OG-O 3.1Å; T444-L453 HydrophobicContact CG2-CD1 3.86Å; T444-L453 WeakPolarHBondContact OG1-CD1 3.44Å; L451-L453 HydrophobicContact CB-CD2 4.21Å; L451-L453 HydrophobicContact CB-CG 4.26Å; L453-V458 HydrophobicContact CD2-CB 4.07Å; L453-V458 HydrophobicContact CD2-CG1 3.7Å; L453-V458 HydrophobicContact CD2-CG2 3.64Å
454	N	98.1	Very high	97	Very high	52 Å²	52	52.9 Å²	52.9	28%	0.278	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	86.3	-179.2	-174.9	-16.5	0	0	0	109	H439 V441 S456 F457	H439-N454 PolarHBondContact NE2-OD1 2.91Å; V441-N454 HydrophobicContact CG1-CB 4Å; V441-N454 HydrophobicContact CG2-CB 4.06Å; N454-S456 PolarHBondContact O-N 2.9Å; N454-F457 PolarHBondContact N-O 2.89Å; N454-F457 PolarHBondContact O-N 2.76Å
455	D	98.1	Very high	97	Very high	18 Å²	18	56.3 Å²	56.3	10%	0.096	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	46.2	-110.7	-171.2	-76.5	-34.7	0	0	0	112.1	G170 F171 N173 N181 H439 F457	G170-D455 CarbonylContact C-O 3.45Å; G170-D455 VanDerWaalsContact CA-O 3.27Å; G170-D455 WeakPolarHBondContact CA-O 3.5Å; F171-D455 PolarHBondContact N-O 3Å; F171-D455 CarbonylContact O-C 3.55Å; F171-D455 VanDerWaalsContact O-CA 3.23Å; F171-D455 WeakPolarHBondContact O-CA 3.25Å; F171-D455 VanDerWaalsContact O-CB 3.32Å; F171-D455 WeakPolarHBondContact O-CB 3.41Å; N173-D455 HydrophobicContact CB-CB 4.35Å; N173-D455 WeakPolarHBondContact CB-OD2 3.4Å; N173-D455 PolarHBondContact ND2-OD2 3.17Å; N181-D455 WeakPolarHBondContact CB-OD1 3.4Å; N181-D455 PolarHBondContact ND2-OD1 2.79Å; H439-D455 IonicContact CE1-OD2 2.72Å; H439-D455 PolarHBondContact CE1-OD2 3.34Å; D455-F457 VanDerWaalsContact C-N 3.28Å; D455-F457 PolarHBondContact O-N 3.49Å
456	S	97.5	Very high	97	Very high	28 Å²	28	54 Å²	54	20%	0.196	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-14.5	-178.3	-69.1	0	0	0	0	114.2	F171 G172 N454	F171-S456 PolarHBondContact O-N 3.37Å; G172-S456 WeakPolarHBondContact CA-OG 3.44Å; N454-S456 PolarHBondContact O-N 2.9Å
457	F	97.1	Very high	97.1	Very high	157 Å²	157	55.7 Å²	55.7	69%	0.689	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.8	116.2	-176.5	-60.2	-80.5	0	0	0	110.1	N454 D455	N454-F457 PolarHBondContact N-O 2.89Å; N454-F457 PolarHBondContact O-N 2.76Å; D455-F457 VanDerWaalsContact C-N 3.28Å; D455-F457 PolarHBondContact O-N 3.49Å
458	V	97.2	Very high	97.2	Very high	57 Å²	57	58 Å²	58	35%	0.345	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	123.3	172.5	179.1	0	0	0	0	107.5	A168 S452 L453	A168-V458 HydrophobicContact CB-CG1 4.1Å; A168-V458 HydrophobicContact CB-CG2 4.41Å; S452-V458 WeakPolarHBondContact O-CA 3.4Å; L453-V458 HydrophobicContact CD2-CB 4.07Å; L453-V458 HydrophobicContact CD2-CG1 3.7Å; L453-V458 HydrophobicContact CD2-CG2 3.64Å
459	S	97	Very high	97.4	Very high	67 Å²	67	56.1 Å²	56.1	47%	0.469	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	157.7	171.6	64.5	0	0	0	0	111.1	L451 S452	L451-S459 CarbonylContact C-O 3.57Å; L451-S459 WeakPolarHBondContact CA-O 3.31Å; S452-S459 PolarHBondContact N-O 3.24Å; S452-S459 PolarHBondContact O-N 3.32Å
460	T	97.2	Very high	97.3	Very high	89 Å²	89	53 Å²	53	55%	0.546	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	153.3	172.1	52.1	0	0	0	0	110.1	Q449 L451	Q449-T460 HydrophobicContact CG-CG2 4.3Å; L451-T460 HydrophobicContact CD2-CG2 4.02Å
461	T	97.3	Very high	97.3	Very high	35 Å²	35	52.4 Å²	52.4	22%	0.215	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	173.4	175.2	-161.8	0	0	0	0	110.9	F443 W450 H465 V466	F443-T461 HydrophobicContact CD1-CG2 3.97Å; F443-T461 HydrophobicContact CE1-CG2 4.38Å; W450-T461 HydrophobicContact CB-CG2 3.65Å; W450-T461 PolarHBondContact O-N 2.99Å; T461-H465 PolarHBondContact OG1-ND1 3.35Å; T461-V466 HydrophobicContact CG2-CG2 3.77Å
462	N	96.7	Very high	97.3	Very high	86 Å²	86	52 Å²	52	46%	0.46	28%	0.277	S	S	.	.			trans	-108	160.7	177.8	61.8	40.3	0	0	0	111.8	D464 H465 V466	N462-D464 VanDerWaalsContact C-N 3.27Å; N462-D464 PolarHBondContact O-N 3.37Å; N462-H465 PolarHBondContact O-N 3.38Å; N462-H465 VanDerWaalsContact OD1-CB 3.23Å; N462-H465 WeakPolarHBondContact OD1-CB 3.34Å; N462-H465 PolarHBondContact OD1-N 2.95Å; N462-V466 PolarHBondContact O-N 3.24Å
463	T	97.2	Very high	97.3	Very high	56 Å²	56	51 Å²	51	34%	0.344	27%	0.27	S	S	.	.	H	α-helix	trans	-57.2	-40.1	-178.3	-53.4	0	0	0	0	111.9	W450 H465 V466 L467	W450-T463 PolarHBondContact NE1-OG1 2.92Å; T463-H465 VanDerWaalsContact C-N 3.35Å; T463-H465 PolarHBondContact O-N 3.23Å; T463-V466 CarbonylContact O-C 3.58Å; T463-V466 WeakPolarHBondContact O-CA 3.46Å; T463-V466 WeakPolarHBondContact O-CB 3.46Å; T463-V466 PolarHBondContact O-N 3.18Å; T463-V466 VanDerWaalsContact O-N 3.08Å; T463-L467 HydrophobicContact CG2-CD1 3.98Å; T463-L467 HydrophobicContact CG2-CG 4.16Å; T463-L467 WeakPolarHBondContact O-CG 3.36Å; T463-L467 PolarHBondContact O-N 3.25Å
464	D	97.3	Very high	97.3	Very high	95 Å²	95	50.9 Å²	50.9	51%	0.508	27%	0.27	S	S	.	.	H	α-helix	trans	-68.4	-35.3	-175.9	-48.3	-40	0	0	0	112.3	N462 V466 L467 R468	N462-D464 VanDerWaalsContact C-N 3.27Å; N462-D464 PolarHBondContact O-N 3.37Å; D464-V466 VanDerWaalsContact C-N 3.32Å; D464-L467 PolarHBondContact O-N 2.79Å; D464-R468 WeakPolarHBondContact O-CB 3.35Å; D464-R468 WeakPolarHBondContact O-CG 3.46Å; D464-R468 PolarHBondContact O-N 3.09Å; D464-R468 PolarHBondContact O-NE 3.03Å
465	H	97.3	Very high	97.4	Very high	73 Å²	73	48.4 Å²	48.4	34%	0.338	26%	0.256	S	S	.	.	H	α-helix	trans	-65.2	-37.8	171.7	178.9	-105.3	0	0	0	111.3	F443 T461 N462 T463 R468 Q469	F443-H465 AromaticContact CE1-CE1 3.91Å; F443-H465 AromaticContact CE1-ND1 3.98Å; T461-H465 PolarHBondContact OG1-ND1 3.35Å; N462-H465 PolarHBondContact O-N 3.38Å; N462-H465 VanDerWaalsContact OD1-CB 3.23Å; N462-H465 WeakPolarHBondContact OD1-CB 3.34Å; N462-H465 PolarHBondContact OD1-N 2.95Å; T463-H465 VanDerWaalsContact C-N 3.35Å; T463-H465 PolarHBondContact O-N 3.23Å; H465-R468 PolarHBondContact O-N 3.41Å; H465-Q469 PolarHBondContact CE1-NE2 3.11Å; H465-Q469 VanDerWaalsContact CE1-NE2 3.25Å; H465-Q469 PolarHBondContact NE2-NE2 3.34Å; H465-Q469 VanDerWaalsContact NE2-NE2 3.18Å; H465-Q469 WeakPolarHBondContact O-CG 3.28Å; H465-Q469 PolarHBondContact O-NE2 3.11Å
466	V	98.1	Very high	97.4	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-65.3	-46.5	173.8	176.4	0	0	0	0	111.1	F402 L424 I427 F443 W450 T461 N462 T463 D464 R468 Q469	F402-V466 VanDerWaalsContact CZ-O 3.28Å; F402-V466 WeakPolarHBondContact CZ-O 3.33Å; L424-V466 HydrophobicContact CD2-CG1 4.35Å; I427-V466 HydrophobicContact CD1-CG1 3.87Å; I427-V466 HydrophobicContact CG1-CG1 4.16Å; F443-V466 HydrophobicContact CB-CG2 4.21Å; F443-V466 HydrophobicContact CD1-CG2 4.05Å; F443-V466 HydrophobicContact CG-CG2 4.31Å; W450-V466 HydrophobicContact CB-CG2 4.27Å; W450-V466 HydrophobicContact CD2-CB 4.47Å; W450-V466 HydrophobicContact CD2-CG1 4.4Å; W450-V466 HydrophobicContact CD2-CG2 3.84Å; W450-V466 HydrophobicContact CE3-CG1 4.16Å; W450-V466 HydrophobicContact CE3-CG2 3.86Å; W450-V466 HydrophobicContact CG-CG2 4.03Å; W450-V466 HydrophobicContact CH2-CG1 4.07Å; W450-V466 HydrophobicContact CZ2-CG1 4.29Å; W450-V466 HydrophobicContact CZ3-CG1 3.99Å; W450-V466 HydrophobicContact CZ3-CG2 4.5Å; T461-V466 HydrophobicContact CG2-CG2 3.77Å; N462-V466 PolarHBondContact O-N 3.24Å; T463-V466 CarbonylContact O-C 3.58Å; T463-V466 WeakPolarHBondContact O-CA 3.46Å; T463-V466 WeakPolarHBondContact O-CB 3.46Å; T463-V466 PolarHBondContact O-N 3.18Å; T463-V466 VanDerWaalsContact O-N 3.08Å; D464-V466 VanDerWaalsContact C-N 3.32Å; V466-R468 PolarHBondContact O-N 3.45Å; V466-Q469 VanDerWaalsContact O-CB 3.31Å; V466-Q469 WeakPolarHBondContact O-CB 3.41Å; V466-Q469 VanDerWaalsContact O-CG 3.25Å; V466-Q469 WeakPolarHBondContact O-CG 3.29Å; V466-Q469 PolarHBondContact O-N 3.03Å; V466-Q469 VanDerWaalsContact O-N 3.12Å
467	L	97.8	Very high	97.4	Very high	41 Å²	41	49.1 Å²	49.1	22%	0.215	26%	0.256	C	S	.	.	H	α-helix	trans	-68.9	-18.5	178.4	-60.7	178.2	0	0	0	113.5	R399 F402 L424 T463 D464 Q469	R399-L467 PolarHBondContact NH2-O 2.94Å; R399-L467 VanDerWaalsContact NH2-O 3.13Å; F402-L467 HydrophobicContact CD2-CD2 4.24Å; F402-L467 HydrophobicContact CE2-CD2 4.02Å; F402-L467 WeakPolarHBondContact O-CD2 3.42Å; L424-L467 HydrophobicContact CD2-CD2 4.31Å; T463-L467 HydrophobicContact CG2-CD1 3.98Å; T463-L467 HydrophobicContact CG2-CG 4.16Å; T463-L467 WeakPolarHBondContact O-CG 3.36Å; T463-L467 PolarHBondContact O-N 3.25Å; D464-L467 PolarHBondContact O-N 2.79Å; L467-Q469 VanDerWaalsContact C-N 3.35Å
468	R	96.8	Very high	97.4	Very high	143 Å²	143	42.4 Å²	42.4	54%	0.54	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-12.6	171.5	-80.7	-174.6	-68.9	-91.8	-0	114.3	R399 D464 H465 V466	R399-R468 PolarHBondContact NH1-O 2.63Å; D464-R468 WeakPolarHBondContact O-CB 3.35Å; D464-R468 WeakPolarHBondContact O-CG 3.46Å; D464-R468 PolarHBondContact O-N 3.09Å; D464-R468 PolarHBondContact O-NE 3.03Å; H465-R468 PolarHBondContact O-N 3.41Å; V466-R468 PolarHBondContact O-N 3.45Å
469	Q	96.5	Very high	97.1	Very high	31 Å²	31	42.9 Å²	42.9	15%	0.145	23%	0.232	C	C	.	.	S	Bend	trans	-67.9	169.7	-176.3	-61	-53.4	-52	0	0	114.5	I427 N429 F443 H465 V466 L467 P471	I427-Q469 HydrophobicContact CD1-CB 3.84Å; I427-Q469 HydrophobicContact CD1-CG 3.95Å; N429-Q469 PolarHBondContact ND2-OE1 3.1Å; F443-Q469 HydrophobicContact CD2-CG 4.46Å; F443-Q469 HydrophobicContact CE2-CG 3.98Å; F443-Q469 HydrophobicContact CZ-CG 4.21Å; H465-Q469 PolarHBondContact CE1-NE2 3.11Å; H465-Q469 VanDerWaalsContact CE1-NE2 3.25Å; H465-Q469 PolarHBondContact NE2-NE2 3.34Å; H465-Q469 VanDerWaalsContact NE2-NE2 3.18Å; H465-Q469 WeakPolarHBondContact O-CG 3.28Å; H465-Q469 PolarHBondContact O-NE2 3.11Å; V466-Q469 VanDerWaalsContact O-CB 3.31Å; V466-Q469 WeakPolarHBondContact O-CB 3.41Å; V466-Q469 VanDerWaalsContact O-CG 3.25Å; V466-Q469 WeakPolarHBondContact O-CG 3.29Å; V466-Q469 PolarHBondContact O-N 3.03Å; V466-Q469 VanDerWaalsContact O-N 3.12Å; L467-Q469 VanDerWaalsContact C-N 3.35Å; Q469-P471 WeakPolarHBondContact O-CD 3.35Å
470	S	94.9	Very high	96.1	Very high	39 Å²	39	43.7 Å²	43.7	27%	0.273	24%	0.238	S	C	.	.			trans	-110	72.6	169.9	-73.7	0	0	0	0	111
471	P	97.1	Very high	94.3	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	150	-174.2	28.6	-36.6	0	0	0	112.3	R389 F402 I427 N429 Q469 L474	R389-P471 PolarHBondContact NE-O 3Å; R389-P471 PolarHBondContact NH2-O 3.31Å; F402-P471 HydrophobicContact CD1-CG 3.7Å; F402-P471 HydrophobicContact CE1-CG 3.38Å; F402-P471 HydrophobicContact CE2-CG 4.27Å; F402-P471 HydrophobicContact CG-CG 4.3Å; F402-P471 HydrophobicContact CZ-CG 3.68Å; I427-P471 HydrophobicContact CB-CB 4.1Å; I427-P471 HydrophobicContact CD1-CB 4.28Å; I427-P471 HydrophobicContact CG2-CB 4.32Å; N429-P471 WeakPolarHBondContact OD1-CA 3.33Å; Q469-P471 WeakPolarHBondContact O-CD 3.35Å; P471-L474 HydrophobicContact CB-CD2 3.71Å; P471-L474 HydrophobicContact CG-CD2 3.48Å; P471-L474 VanDerWaalsContact CG-CD2 3.48Å; P471-L474 HydrophobicContact CG-CG 4.4Å
472	Y	98	Very high	92.1	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.008	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	-41.7	168.9	173.4	-126.2	0	0	0	111.1	D267 A268 H269 Q386 L387 R389 F390 V428 Y440	D267-Y472 VanDerWaalsContact CG-OH 3.23Å; D267-Y472 WeakPolarHBondContact OD1-CE1 3.15Å; D267-Y472 PolarHBondContact OD1-OH 3.5Å; D267-Y472 PolarHBondContact OD2-OH 3.42Å; A268-Y472 HydrophobicContact CB-CE1 4.49Å; H269-Y472 HydrophobicContact CB-CE1 3.95Å; H269-Y472 WeakPolarHBondContact CB-OH 3.49Å; Q386-Y472 HydrophobicContact CG-CE2 3.91Å; Q386-Y472 PolarHBondContact NE2-OH 2.8Å; L387-Y472 PolarHBondContact N-O 2.88Å; L387-Y472 WeakPolarHBondContact O-CD2 3.24Å; L387-Y472 WeakPolarHBondContact O-CE2 3.33Å; R389-Y472 HydrophobicContact CB-CD2 4.18Å; R389-Y472 HydrophobicContact CG-CD2 4.32Å; F390-Y472 HydrophobicContact CD2-CD2 4.33Å; F390-Y472 HydrophobicContact CD2-CE1 4.38Å; F390-Y472 AromaticContact CD2-CE2 3.66Å; F390-Y472 HydrophobicContact CD2-CE2 3.66Å; F390-Y472 AromaticContact CD2-CZ 3.66Å; F390-Y472 HydrophobicContact CE2-CD1 4.13Å; F390-Y472 AromaticContact CE2-CD2 3.94Å; F390-Y472 HydrophobicContact CE2-CD2 3.94Å; F390-Y472 AromaticContact CE2-CE1 3.79Å; F390-Y472 HydrophobicContact CE2-CE1 3.79Å; F390-Y472 AromaticContact CE2-CE2 3.62Å; F390-Y472 HydrophobicContact CE2-CE2 3.62Å; F390-Y472 HydrophobicContact CE2-CG 4.18Å; F390-Y472 AromaticContact CE2-CZ 3.51Å; V428-Y472 PolarHBondContact O-N 2.9Å; Y440-Y472 AromaticContact CE1-CD1 3.86Å; Y440-Y472 HydrophobicContact CE1-CD1 3.86Å; Y440-Y472 HydrophobicContact CE1-CE1 4.25Å
473	L	98.6	Very high	89.7	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	140.8	172.9	-53.5	172.6	0	0	0	110.4	V183 A268 H269 L272 I385 Q386 I427 V428 F475	V183-L473 HydrophobicContact CG2-CD1 4.45Å; A268-L473 HydrophobicContact CB-CD1 4.41Å; H269-L473 HydrophobicContact CB-CD2 4.23Å; L272-L473 HydrophobicContact CD2-CD1 3.9Å; I385-L473 CarbonylContact O-C 3.5Å; I385-L473 WeakPolarHBondContact O-CA 3.31Å; Q386-L473 HydrophobicContact CB-CD2 3.87Å; Q386-L473 HydrophobicContact CG-CD2 4.05Å; I427-L473 CarbonylContact C-O 3.59Å; I427-L473 VanDerWaalsContact CA-O 3.3Å; I427-L473 WeakPolarHBondContact CA-O 3.36Å; V428-L473 HydrophobicContact CB-CB 4.05Å; V428-L473 HydrophobicContact CB-CD1 4.26Å; V428-L473 HydrophobicContact CB-CG 4.38Å; V428-L473 HydrophobicContact CG2-CB 4.37Å; V428-L473 HydrophobicContact CG2-CD1 4.28Å; V428-L473 PolarHBondContact N-O 2.98Å; V428-L473 PolarHBondContact O-N 3.33Å; V428-L473 VanDerWaalsContact O-N 3.09Å; L473-F475 HydrophobicContact CB-CE2 4.07Å
474	L	98.7	Very high	87	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	136.8	173.2	-55.4	167.2	0	0	0	109	L340 I384 I385 F402 L424 I427 P471 Y476	L340-L474 HydrophobicContact CD1-CD1 4.04Å; L340-L474 HydrophobicContact CD2-CD1 4.11Å; I384-L474 WeakPolarHBondContact CA-O 3.44Å; I385-L474 HydrophobicContact CB-CB 4.25Å; I385-L474 HydrophobicContact CB-CD1 4.44Å; I385-L474 HydrophobicContact CG2-CD1 4.49Å; I385-L474 PolarHBondContact N-O 2.93Å; I385-L474 PolarHBondContact O-N 2.82Å; F402-L474 HydrophobicContact CB-CD1 4.17Å; F402-L474 HydrophobicContact CB-CD2 4.39Å; F402-L474 HydrophobicContact CD1-CD2 4.49Å; F402-L474 HydrophobicContact CD2-CD2 3.62Å; F402-L474 HydrophobicContact CE2-CD2 3.98Å; F402-L474 HydrophobicContact CG-CD2 3.9Å; L424-L474 HydrophobicContact CD1-CB 4.3Å; L424-L474 HydrophobicContact CD1-CD2 4.21Å; I427-L474 HydrophobicContact CB-CD2 4.5Å; I427-L474 HydrophobicContact CG2-CD2 3.53Å; P471-L474 HydrophobicContact CB-CD2 3.71Å; P471-L474 HydrophobicContact CG-CD2 3.48Å; P471-L474 VanDerWaalsContact CG-CD2 3.48Å; P471-L474 HydrophobicContact CG-CG 4.4Å; L474-Y476 HydrophobicContact CB-CD2 4.13Å; L474-Y476 HydrophobicContact CB-CE2 3.8Å; L474-Y476 HydrophobicContact CD1-CE2 4.08Å; L474-Y476 HydrophobicContact CG-CE2 4.44Å
475	F	98.8	Very high	84.2	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	120.3	174.8	-66	-106.9	0	0	0	109.6	C186 L272 I384 Y425 A426 V428 L473	C186-F475 HydrophobicContact CB-CD1 4.45Å; C186-F475 HydrophobicContact CB-CD2 3.99Å; C186-F475 HydrophobicContact CB-CE1 4.16Å; C186-F475 HydrophobicContact CB-CE2 3.67Å; C186-F475 HydrophobicContact CB-CG 4.38Å; C186-F475 HydrophobicContact CB-CZ 3.76Å; L272-F475 HydrophobicContact CD1-CE1 4.35Å; L272-F475 HydrophobicContact CD1-CZ 4.24Å; L272-F475 HydrophobicContact CD2-CE1 4.29Å; L272-F475 HydrophobicContact CD2-CZ 3.74Å; I384-F475 HydrophobicContact CD1-CD1 4.22Å; I384-F475 HydrophobicContact CD1-CE1 3.82Å; I384-F475 HydrophobicContact CG1-CD1 3.82Å; I384-F475 HydrophobicContact CG1-CE1 3.89Å; I384-F475 HydrophobicContact CG2-CE1 4.46Å; Y425-F475 HydrophobicContact CD1-CB 4.3Å; Y425-F475 WeakPolarHBondContact CD1-O 3.17Å; Y425-F475 HydrophobicContact CE1-CB 3.72Å; Y425-F475 HydrophobicContact CE2-CB 4.24Å; Y425-F475 PolarHBondContact N-O 2.87Å; A426-F475 HydrophobicContact CB-CB 3.99Å; A426-F475 HydrophobicContact CB-CD2 4.22Å; A426-F475 HydrophobicContact CB-CG 4.29Å; A426-F475 PolarHBondContact N-O 3.46Å; A426-F475 PolarHBondContact O-N 3.42Å; V428-F475 HydrophobicContact CG2-CE2 4.25Å; L473-F475 HydrophobicContact CB-CE2 4.07Å
476	Y	98.5	Very high	81.4	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	143	-178.6	-78.2	-88.5	0	0	0	111	L340 I382 L383 I385 P403 F406 K423 L424 L474	L340-Y476 HydrophobicContact CD2-CE2 3.89Å; I382-Y476 CarbonylContact C-O 3.51Å; I382-Y476 WeakPolarHBondContact CA-O 3.49Å; L383-Y476 PolarHBondContact N-O 3.29Å; L383-Y476 PolarHBondContact O-N 2.97Å; I385-Y476 HydrophobicContact CD1-CD2 4.28Å; I385-Y476 HydrophobicContact CD1-CE2 4.38Å; P403-Y476 WeakPolarHBondContact O-CE1 3.32Å; P403-Y476 PolarHBondContact O-OH 3.19Å; F406-Y476 AromaticContact CD1-CD1 3.96Å; F406-Y476 HydrophobicContact CD1-CD1 3.96Å; F406-Y476 AromaticContact CD1-CE1 3.63Å; F406-Y476 HydrophobicContact CD1-CE1 3.63Å; F406-Y476 AromaticContact CD1-CZ 3.96Å; F406-Y476 AromaticContact CE1-CD1 3.68Å; F406-Y476 HydrophobicContact CE1-CD1 3.68Å; F406-Y476 AromaticContact CE1-CD2 3.98Å; F406-Y476 HydrophobicContact CE1-CD2 3.98Å; F406-Y476 AromaticContact CE1-CE1 3.67Å; F406-Y476 HydrophobicContact CE1-CE1 3.67Å; F406-Y476 AromaticContact CE1-CE2 3.93Å; F406-Y476 HydrophobicContact CE1-CE2 3.93Å; F406-Y476 AromaticContact CE1-CG 3.86Å; F406-Y476 HydrophobicContact CE1-CG 3.86Å; F406-Y476 AromaticContact CE1-CZ 3.8Å; K423-Y476 VanDerWaalsContact C-CD1 3.44Å; K423-Y476 CarbonylContact O-C 2.92Å; K423-Y476 VanDerWaalsContact O-CA 3.26Å; K423-Y476 WeakPolarHBondContact O-CA 3.42Å; L424-Y476 HydrophobicContact CB-CD1 4Å; L424-Y476 HydrophobicContact CB-CE1 3.61Å; L424-Y476 HydrophobicContact CD1-CD1 4.29Å; L424-Y476 HydrophobicContact CD1-CD2 4.03Å; L424-Y476 HydrophobicContact CD1-CE1 3.89Å; L424-Y476 HydrophobicContact CD1-CE2 3.64Å; L424-Y476 HydrophobicContact CD1-CG 4.34Å; L424-Y476 HydrophobicContact CG-CE1 4.37Å; L424-Y476 VanDerWaalsContact N-CD1 3.35Å; L474-Y476 HydrophobicContact CB-CD2 4.13Å; L474-Y476 HydrophobicContact CB-CE2 3.8Å; L474-Y476 HydrophobicContact CD1-CE2 4.08Å; L474-Y476 HydrophobicContact CG-CE2 4.44Å
477	E	97.5	Very high	78.3	Confident	61 Å²	61	57.9 Å²	57.9	29%	0.285	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	137.2	177.2	-179.6	167.3	-120.6	0	0	110.6	P192 P381 I382 Y422 K423 Y425	P192-E477 WeakPolarHBondContact CD-OE1 3.5Å; P381-E477 WeakPolarHBondContact O-CA 3.16Å; I382-E477 HydrophobicContact CD1-CB 3.89Å; I382-E477 HydrophobicContact CD1-CG 3.79Å; Y422-E477 CarbonylContact C-O 3.57Å; Y422-E477 VanDerWaalsContact CA-O 3.31Å; Y422-E477 WeakPolarHBondContact CA-O 3.44Å; K423-E477 PolarHBondContact N-O 3.33Å; K423-E477 PolarHBondContact O-N 2.6Å; Y425-E477 HydrophobicContact CD1-CB 3.76Å; Y425-E477 HydrophobicContact CE1-CB 4.03Å
478	A	96.6	Very high	75.2	Confident	16 Å²	16	60.4 Å²	60.4	13%	0.132	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	125.6	-179.4	0	0	0	0	0	111.3	P381 L421 Y422 S480 Y481	P381-A478 PolarHBondContact O-N 2.86Å; L421-A478 WeakPolarHBondContact O-CA 3.44Å; Y422-A478 HydrophobicContact CD1-CB 4.23Å; Y422-A478 HydrophobicContact CE1-CB 3.76Å; A478-S480 VanDerWaalsContact C-N 3.31Å; A478-S480 PolarHBondContact O-N 2.81Å; A478-Y481 HydrophobicContact CB-CD2 4.35Å
479	V	91.4	Very high	72.1	Confident	67 Å²	67	62.9 Å²	62.9	41%	0.406	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-28.8	-172.7	-178.5	0	0	0	0	113.3	L421 K423	L421-V479 HydrophobicContact CB-CB 4.18Å; L421-V479 HydrophobicContact CB-CG2 3.97Å; L421-V479 WeakPolarHBondContact O-CG2 3.4Å; L421-V479 PolarHBondContact O-N 2.97Å; K423-V479 HydrophobicContact CB-CG2 4.37Å; K423-V479 HydrophobicContact CD-CG2 3.76Å; K423-V479 HydrophobicContact CG-CG2 3.61Å
480	S	75.3	Confident	69.1	Low	84 Å²	84	70 Å²	70	59%	0.587	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-148.2	72.8	-177.1	60.9	0	0	0	0	109.6	A478 V482	A478-S480 VanDerWaalsContact C-N 3.31Å; A478-S480 PolarHBondContact O-N 2.81Å; S480-V482 PolarHBondContact O-N 3.48Å; S480-V482 VanDerWaalsContact O-N 3.1Å
481	Y	60.1	Low	66.3	Low	51 Å²	51	73 Å²	73	20%	0.2	40%	0.397	C	S	.	.			trans	-75.2	97.2	174.4	-163.7	-93.8	0	0	0	109.3	L153 D154 P381 A478 T483	L153-Y481 HydrophobicContact CD2-CD1 4.25Å; L153-Y481 HydrophobicContact CD2-CE1 3.41Å; L153-Y481 VanDerWaalsContact CD2-CE1 3.41Å; L153-Y481 HydrophobicContact CG-CE1 4.17Å; D154-Y481 WeakPolarHBondContact OD1-CD1 3.47Å; P381-Y481 HydrophobicContact CB-CD2 4.15Å; P381-Y481 HydrophobicContact CB-CE2 4.46Å; P381-Y481 HydrophobicContact CB-CG 4.31Å; P381-Y481 HydrophobicContact CG-CD1 4.03Å; P381-Y481 HydrophobicContact CG-CD2 3.77Å; P381-Y481 HydrophobicContact CG-CE1 3.9Å; P381-Y481 HydrophobicContact CG-CE2 3.64Å; P381-Y481 HydrophobicContact CG-CG 3.97Å; A478-Y481 HydrophobicContact CB-CD2 4.35Å; Y481-T483 WeakPolarHBondContact CE1-OG1 3.42Å
482	V	51.8	Low	63.3	Low	104 Å²	104	77.8 Å²	77.8	63%	0.63	43%	0.43	S	S	*	.			trans	-112.9	113.3	173.1	-175.7	0	0	0	0	107.4	S480 R484	S480-V482 PolarHBondContact O-N 3.48Å; S480-V482 VanDerWaalsContact O-N 3.1Å; V482-R484 HydrophobicContact CG1-CG 4.09Å; V482-R484 PolarHBondContact O-N 2.98Å
483	T	44.6	Very low	60.4	Low	30 Å²	30	85.2 Å²	85.2	18%	0.184	47%	0.469	C	S	.	.			trans	-77.8	65.1	-173.3	-49.6	0	0	0	0	112.8	D150 D154 Y481 T485	D150-T483 HydrophobicContact CB-CG2 4.02Å; D150-T483 VanDerWaalsContact CG-CG2 3.48Å; D150-T483 VanDerWaalsContact OD2-CG2 3.24Å; D150-T483 WeakPolarHBondContact OD2-CG2 3.28Å; D154-T483 PolarHBondContact OD1-OG1 2.87Å; D154-T483 PolarHBondContact OD2-N 3.33Å; Y481-T483 WeakPolarHBondContact CE1-OG1 3.42Å; T483-T485 VanDerWaalsContact C-N 3.32Å; T483-T485 HydrophobicContact CG2-CG2 4.48Å; T483-T485 PolarHBondContact O-N 3.5Å
484	R	42.2	Very low	57.4	Low	217 Å²	217	91.4 Å²	91.4	82%	0.819	50%	0.502	S	S	*	.			trans	-76.5	84.7	169.8	-66.9	-163.5	74	-170	2.9	110.6	V482 V486	V482-R484 HydrophobicContact CG1-CG 4.09Å; V482-R484 PolarHBondContact O-N 2.98Å; R484-V486 PolarHBondContact O-N 3.03Å
485	T	38.2	Very low	54.3	Low	93 Å²	93	97.1 Å²	97.1	57%	0.571	54%	0.537	S	S	*	.			trans	-54.6	120.9	161.7	43	0	0	0	0	109.4	T483 T487	T483-T485 VanDerWaalsContact C-N 3.32Å; T483-T485 HydrophobicContact CG2-CG2 4.48Å; T483-T485 PolarHBondContact O-N 3.5Å; T485-T487 PolarHBondContact O-N 3.3Å
486	V	39	Very low	51.1	Low	117 Å²	117	104.4 Å²	104.4	71%	0.709	58%	0.576	S	S	*	*			trans	-81.4	76	179.7	-175	0	0	0	0	109.2	R484 S488	R484-V486 PolarHBondContact O-N 3.03Å; V486-S488 VanDerWaalsContact C-N 3.27Å; V486-S488 PolarHBondContact O-N 3.37Å; V486-S488 VanDerWaalsContact O-N 3.15Å
487	T	33.2	Very low	48.2	Very low	120 Å²	120	109.4 Å²	109.4	74%	0.736	61%	0.607	S	S	*	*			trans	-74.9	88.2	154.3	52.7	0	0	0	0	107.6	T485 K489	T485-T487 PolarHBondContact O-N 3.3Å; T487-K489 PolarHBondContact O-N 3.19Å
488	S	31	Very low	45.1	Very low	94 Å²	94	112 Å²	112	66%	0.657	63%	0.629	S	S	*	*			trans	-68.9	78.4	175.2	52.5	0	0	0	0	110.9	V486 E490	V486-S488 VanDerWaalsContact C-N 3.27Å; V486-S488 PolarHBondContact O-N 3.37Å; V486-S488 VanDerWaalsContact O-N 3.15Å; S488-E490 PolarHBondContact O-N 3.1Å
489	K	32	Very low	42	Very low	195 Å²	195	120.9 Å²	120.9	85%	0.848	67%	0.665	S	S	*	*			trans	-80.2	93.5	148.1	-78.6	-170.6	175.8	-176.7	0	106.8	T487 S491	T487-K489 PolarHBondContact O-N 3.19Å; K489-S491 VanDerWaalsContact C-N 3.33Å; K489-S491 PolarHBondContact O-N 2.96Å
490	E	34.9	Very low	39.4	Very low	180 Å²	180	125 Å²	125	84%	0.841	68%	0.683	S	S	*	*			trans	-69	96.6	164.9	-69.1	175.5	138.1	0	0	107.4	S488 S492	S488-E490 PolarHBondContact O-N 3.1Å; E490-S492 PolarHBondContact O-N 3.41Å; E490-S492 VanDerWaalsContact O-N 3.12Å
491	S	36	Very low	37.4	Very low	102 Å²	102	127.7 Å²	127.7	71%	0.713	69%	0.691	S	S	*	*			trans	-74.1	94.7	164.6	54.5	0	0	0	0	107.7	K489 L493	K489-S491 VanDerWaalsContact C-N 3.33Å; K489-S491 PolarHBondContact O-N 2.96Å; S491-L493 PolarHBondContact O-N 2.91Å; S491-L493 VanDerWaalsContact O-N 3.08Å
492	S	33.6	Very low	36.2	Very low	100 Å²	100	133 Å²	133	70%	0.699	72%	0.723	S	S	*	*			trans	-55.9	111	166.9	49.2	0	0	0	0	109.1	E490	E490-S492 PolarHBondContact O-N 3.41Å; E490-S492 VanDerWaalsContact O-N 3.12Å
493	L	37.2	Very low	35.4	Very low	159 Å²	159	133.4 Å²	133.4	83%	0.832	73%	0.731	S	S	*	*			trans	-89	113.2	164.9	-91.1	159.3	0	0	0	107.1	S491 T495	S491-L493 PolarHBondContact O-N 2.91Å; S491-L493 VanDerWaalsContact O-N 3.08Å; L493-T495 PolarHBondContact O-N 3.36Å
494	D	34.8	Very low	35.2	Very low	130 Å²	130	141.2 Å²	141.2	70%	0.695	77%	0.765	S	S	*	*			trans	-60.9	125.1	-170	-65.8	-62.1	0	0	0	112.2	N496	D494-N496 PolarHBondContact O-N 3.13Å
495	T	33	Very low	34.8	Very low	119 Å²	119	138.2 Å²	138.2	73%	0.73	77%	0.765	S	S	*	*			trans	-80.9	76.2	175.2	-54.3	0	0	0	0	109.3	L493 T497	L493-T495 PolarHBondContact O-N 3.36Å; T495-T497 HydrophobicContact CG2-CG2 3.98Å; T495-T497 PolarHBondContact O-N 3.4Å
496	N	33.1	Very low	34.6	Very low	154 Å²	154	139.4 Å²	139.4	82%	0.824	78%	0.776	S	S	*	*			trans	-71.5	70.7	171.2	-85.1	-32.8	0	0	0	111.1	D494	D494-N496 PolarHBondContact O-N 3.13Å
497	T	36.6	Very low	34.4	Very low	105 Å²	105	139.4 Å²	139.4	64%	0.644	78%	0.779	S	S	*	*			trans	-99.4	114.4	163.8	50.1	0	0	0	0	108.9	T495 K499	T495-T497 HydrophobicContact CG2-CG2 3.98Å; T495-T497 PolarHBondContact O-N 3.4Å; T497-K499 PolarHBondContact O-N 2.99Å
498	P	33.6	Very low	34.5	Very low	116 Å²	116	139.3 Å²	139.3	75%	0.753	78%	0.778	S	S	*	*			trans	-69.2	126.4	-176	27.4	-33.8	0	0	0	111	L500	P498-L500 PolarHBondContact O-N 3.25Å
499	K	31.4	Very low	34.6	Very low	202 Å²	202	141.1 Å²	141.1	88%	0.878	78%	0.78	S	S	*	*			trans	-75.1	100.9	166	-67.6	-177.9	-179.3	179.2	0	108.6	T497	T497-K499 PolarHBondContact O-N 2.99Å
500	L	36.1	Very low	34.8	Very low	153 Å²	153	138 Å²	138	80%	0.801	77%	0.773	S	S	*	*			trans	-77.9	125.4	155.5	-104.9	75.6	0	0	0	108.5	P498	P498-L500 PolarHBondContact O-N 3.25Å
501	N	32.2	Very low	34.6	Very low	141 Å²	141	134.6 Å²	134.6	75%	0.754	76%	0.764	S	S	*	*			trans	-67	147.7	155.7	-65.2	-27.1	0	0	0	108.2
502	N	36.6	Very low	34.5	Very low	161 Å²	161	135.2 Å²	135.2	86%	0.861	76%	0.764	S	S	*	*			trans	-161.8	129.5	130.2	-103.6	-11.5	0	0	0	110.7
503	S	34.9	Very low	34.3	Very low	113 Å²	113	139.4 Å²	139.4	79%	0.79	77%	0.769	S	S	*	*			trans	-106.1	119	165.8	-56.6	0	0	0	0	107.5
504	Q	39.1	Very low	34.1	Very low	194 Å²	194	139.8 Å²	139.8	91%	0.907	77%	0.767	S	S	*	*			trans	-176.4	175.1	138.3	-103.1	168.7	6.7	0	0	111.6
505	L	34	Very low	34	Very low	155 Å²	155	141 Å²	141	81%	0.812	77%	0.768	S	S	*	*			trans	-96.3	167.3	-158.7	-85.3	67.5	0	0	0	113.9
506	S	33.6	Very low	33.9	Very low	117 Å²	117	140.3 Å²	140.3	82%	0.818	77%	0.768	S	S	*	*			trans	79.5	151.4	152.3	70.4	0	0	0	0	118.3
507	P	36	Very low	33.8	Very low	117 Å²	117	138.2 Å²	138.2	76%	0.76	76%	0.762	S	S	*	*			trans	-126.2	-161.4	-156.6	35.3	-13.4	0	0	0	113.3
508	V	33.8	Very low	33.6	Very low	118 Å²	118	138.9 Å²	138.9	72%	0.715	77%	0.765	S	S	*	*			trans	110	113.6	159.3	-175.3	0	0	0	0	115.7
509	N	34.5	Very low	33.6	Very low	133 Å²	133	142.5 Å²	142.5	71%	0.711	77%	0.769	S	S	*	*			trans	75.7	117.3	152.8	-71.4	22.2	0	0	0	123.7
510	D	35.7	Very low	33.8	Very low	129 Å²	129	138.2 Å²	138.2	69%	0.69	76%	0.762	S	S	*	*				75.9	153.7	126.3	-68.6	-47.1	0	0	0	122.8
511	T	31.5	Very low	33.8	Very low	108 Å²	108	141.9 Å²	141.9	66%	0.663	77%	0.767	S	S	*	*			cis	-174.7	161.2	-36.3	-94.2	0	0	0	0	106.8
512	V	33.5	Very low	33.9	Very low	116 Å²	116	142.8 Å²	142.8	70%	0.703	77%	0.771	S	S	*	*			trans	74.8	106.8	-177.3	-164.8	0	0	0	0	112.8
513	K	30	Very low	34.3	Very low	188 Å²	188	140.5 Å²	140.5	82%	0.817	77%	0.765	S	S	*	*				80.8	154.4	60.3	-71.8	178.4	174.9	175.5	0	114.7
514	Q	32	Very low	34.2	Very low	166 Å²	166	143.2 Å²	143.2	78%	0.776	77%	0.77	S	S	*	*			trans	80.4	146.4	165.7	-61.4	-168.2	-8.6	0	0	117.2
515	Q	31.8	Very low	34.1	Very low	155 Å²	155	138.9 Å²	138.9	72%	0.724	76%	0.761	S	S	*	*			cis	-176.5	166.1	-34.6	-124.9	170.6	-24.9	0	0	108.2
516	S	31.3	Very low	34.3	Very low	105 Å²	105	137 Å²	137	73%	0.734	76%	0.761	S	S	*	*			trans	69.7	156.2	151	82.6	0	0	0	0	117.9
517	T	31.9	Very low	34.5	Very low	111 Å²	111	136.4 Å²	136.4	68%	0.681	76%	0.756	S	S	*	*			cis	-166.5	148	-17.3	15.7	0	0	0	0	111.2
518	T	31.2	Very low	34.6	Very low	118 Å²	118	136.1 Å²	136.1	72%	0.724	76%	0.757	S	S	*	*			trans	62.3	163.1	149.2	58.8	0	0	0	0	118.9
519	K	33.5	Very low	34.8	Very low	192 Å²	192	135.1 Å²	135.1	84%	0.835	76%	0.756	S	S	*	*			cis	-154.1	168	-14.3	-116.4	168.5	-180	179.9	0	108.2
520	P	37.4	Very low	34.9	Very low	112 Å²	112	136.8 Å²	136.8	73%	0.727	76%	0.764	S	S	*	*			trans	-95	170.2	-172.8	38.5	-35.5	0	0	0	114.4
521	Y	35.5	Very low	34.8	Very low	230 Å²	230	135 Å²	135	90%	0.902	76%	0.761	S	S	*	*			trans	-142.3	172.5	163	-122.2	-92	0	0	0	113.4
522	L	34.7	Very low	35	Very low	160 Å²	160	136.3 Å²	136.3	84%	0.838	77%	0.769	S	S	*	*			trans	-105.2	170.7	-160	-81.5	167.4	0	0	0	114.9
523	P	43.4	Very low	35.1	Very low	114 Å²	114	138.5 Å²	138.5	74%	0.74	77%	0.772	S	S	*	*			trans	-101.4	177.8	-163.1	40.8	-37.8	0	0	0	115
524	L	34.6	Very low	35.4	Very low	170 Å²	170	136.4 Å²	136.4	89%	0.89	78%	0.775	S	S	*	*			trans	-147.4	152.3	162.4	-152.3	61.9	0	0	0	116
525	S	35.6	Very low	35.5	Very low	102 Å²	102	134.4 Å²	134.4	71%	0.713	77%	0.77	S	S	*	*			trans	-62.9	161.7	-172.7	-39.3	0	0	0	0	119
526	S	38.3	Very low	35.8	Very low	117 Å²	117	134.9 Å²	134.9	82%	0.818	77%	0.771	S	S	*	*			trans	157.7	157.6	130.3	49.7	0	0	0	0	112.4
527	S	37.4	Very low	36	Very low	103 Å²	103	139 Å²	139	72%	0.72	78%	0.776	S	S	*	*			cis	-168.8	177.4	-31.1	62.3	0	0	0	0	110.3
528	S	38.6	Very low	36	Very low	111 Å²	111	138.6 Å²	138.6	78%	0.776	78%	0.778	S	S	*	*			trans	73.8	158.7	165.5	80.7	0	0	0	0	119.6
529	S	37.6	Very low	36.3	Very low	98 Å²	98	143 Å²	143	69%	0.685	79%	0.787	S	S	*	*				-177.8	140.6	-55.2	50.6	0	0	0	0	111.9
530	L	37.2	Very low	36.1	Very low	168 Å²	168	140.1 Å²	140.1	88%	0.88	78%	0.781	S	S	*	*				-177.7	-179.3	120.6	-131.2	64.5	0	0	0	112.5
531	S	34.8	Very low	36	Very low	91 Å²	91	142 Å²	142	64%	0.636	79%	0.79	S	S	*	*			trans	-157.1	156.7	-152.4	55.6	0	0	0	0	116.2
532	T	35.2	Very low	35.9	Very low	135 Å²	135	136.2 Å²	136.2	83%	0.828	78%	0.779	S	S	*	*			trans	171	119.1	143	25	0	0	0	0	107.4
533	Q	36.1	Very low	35.9	Very low	162 Å²	162	138.3 Å²	138.3	76%	0.757	78%	0.781	S	S	*	*				78.1	112.6	54.5	-74.4	-155.2	23.1	0	0	116.3
534	T	36.3	Very low	35.4	Very low	145 Å²	145	140.7 Å²	140.7	89%	0.89	78%	0.783	S	S	*	*				-168.9	163	120	17.9	0	0	0	0	110.7
535	N	33	Very low	35.4	Very low	124 Å²	124	138.5 Å²	138.5	66%	0.663	78%	0.777	S	S	*	*			trans	-122.4	159.7	-165.7	-66.1	-59.6	0	0	0	112.3
536	H	38.4	Very low	35.2	Very low	164 Å²	164	139.8 Å²	139.8	76%	0.759	78%	0.775	S	S	*	*				171.4	146.5	97.9	-97	-60.1	0	0	0	118.8
537	K	35.8	Very low	34.9	Very low	193 Å²	193	141 Å²	141	84%	0.839	77%	0.772	S	S	*	*			trans	81.8	151.5	148.2	-75	170.6	-178.2	179.4	0	118.9
538	S	32.1	Very low	34.7	Very low	101 Å²	101	142.9 Å²	142.9	71%	0.706	77%	0.773	S	S	*	*			trans	-150.9	166.5	-154.4	-23.6	0	0	0	0	109.8
539	F	36.2	Very low	34.3	Very low	211 Å²	211	142.9 Å²	142.9	93%	0.925	77%	0.771	S	S	*	*			trans	-152.6	143.2	139.6	-118.9	-78.4	0	0	0	110.7
540	N	31.1	Very low	34.1	Very low	131 Å²	131	145.1 Å²	145.1	70%	0.701	78%	0.78	S	S	*	*			trans	-111.5	151.1	-177.4	-71	-22.4	0	0	0	111
541	T	34.9	Very low	33.8	Very low	152 Å²	152	143 Å²	143	93%	0.933	77%	0.774	S	S	*	*			trans	-142.9	142.7	140.5	-32.6	0	0	0	0	109.8
542	T	32	Very low	33.5	Very low	108 Å²	108	145.4 Å²	145.4	66%	0.663	79%	0.785	S	S	*	*			trans	-116.9	145.5	-161.2	-48.7	0	0	0	0	112.5
543	K	35.3	Very low	33.4	Very low	204 Å²	204	144.6 Å²	144.6	89%	0.887	78%	0.784	S	S	*	*			trans	-150.1	150.1	138.8	-113	166.1	-174.2	179.1	0	111.2
544	Q	33.8	Very low	33.1	Very low	164 Å²	164	142.6 Å²	142.6	77%	0.766	79%	0.789	S	S	*	*			trans	-78.3	167.2	-171.8	-65.7	144.3	-35.7	0	0	110.3
545	T	34.5	Very low	32.9	Very low	125 Å²	125	141.9 Å²	141.9	77%	0.767	78%	0.783	S	S	*	*			cis	-149.4	127.8	37	49.9	0	0	0	0	116
546	N	31.1	Very low	32.8	Very low	128 Å²	128	143.1 Å²	143.1	68%	0.684	79%	0.789	S	S	*	*				52.2	114.7	126.9	-68.5	9.4	0	0	0	123.5
547	L	32	Very low	32.5	Very low	144 Å²	144	140.9 Å²	140.9	75%	0.754	79%	0.791	S	S	*	*			trans	68.7	149.9	133.3	-47.8	169.5	0	0	0	118.9
548	L	32.3	Very low	32.3	Very low	142 Å²	142	137 Å²	137	74%	0.743	79%	0.789	S	S	*	*			cis	-157.9	161.1	-23.9	-102.8	175.6	0	0	0	106.7
549	P	30.3	Very low	32.4	Very low	111 Å²	111	138.1 Å²	138.1	72%	0.721	80%	0.797	S	S	*	*			trans	-78.8	150.8	179	33.8	-33.7	0	0	0	112.3
550	V	33.4	Very low	32.2	Very low	145 Å²	145	134.3 Å²	134.3	88%	0.879	79%	0.791	S	S	*	*			trans	-114	115.4	175.4	178.9	0	0	0	0	110.7
551	T	31.4	Very low	32.5	Very low	124 Å²	124	133.8 Å²	133.8	76%	0.761	80%	0.797	S	S	*	*			trans	-75.6	150.2	175	-35.1	0	0	0	0	111.2
552	V	29.5	Very low	32.3	Very low	141 Å²	141	136 Å²	136	86%	0.855	79%	0.794	S	S	*	*			trans	-66.8	132.3	171.6	-78.9	0	0	0	0	112.2
553	S	33	Very low	32.4	Very low	117 Å²	117	135.3 Å²	135.3	82%	0.818	80%	0.8	S	S	*	*			trans	-152	125.4	160.3	-89.6	0	0	0	0	109.9
554	S	28.8	Very low	32.1	Very low	121 Å²	121	135.5 Å²	135.5	85%	0.846	80%	0.8	S	S	*	*			trans	-88.9	129.1	175.3	54.4	0	0	0	0	111
555	V	33.1	Very low	32	Very low	129 Å²	129	133.7 Å²	133.7	78%	0.782	80%	0.801	S	S	*	*			trans	-130.5	129.9	167.3	-168.3	0	0	0	0	109.1
556	I	29.3	Very low	31.8	Very low	151 Å²	151	133.3 Å²	133.3	77%	0.774	80%	0.8	S	S	*	*			trans	-88.3	133.3	173	-62.2	168.2	0	0	0	107.8
557	S	33.5	Very low	31.6	Very low	116 Å²	116	133.1 Å²	133.1	81%	0.811	80%	0.804	S	S	*	*			trans	-139.9	123.1	164.7	-75.5	0	0	0	0	109.9
558	S	30.6	Very low	31.6	Very low	112 Å²	112	133.9 Å²	133.9	78%	0.783	81%	0.807	S	S	*	*			trans	-105.1	130.7	-178	-54.9	0	0	0	0	110.7
559	S	35	Very low	31.5	Very low	125 Å²	125	132.6 Å²	132.6	87%	0.874	80%	0.801	S	S	*	*			trans	-152	149	158.7	52.9	0	0	0	0	110.1
560	T	32.1	Very low	31.4	Very low	131 Å²	131	133.2 Å²	133.2	80%	0.804	81%	0.808	S	S	*	*			trans	-123.8	143.6	-162.3	48.2	0	0	0	0	112.8
561	S	35.9	Very low	31.1	Very low	120 Å²	120	133.1 Å²	133.1	84%	0.839	80%	0.802	S	S	*	*			trans	-150.9	157	148.5	64.1	0	0	0	0	109.7
562	F	31.2	Very low	30.9	Very low	199 Å²	199	132.1 Å²	132.1	87%	0.873	80%	0.798	S	S	*	*			trans	-96.6	134.9	-162.3	-79.3	-112	0	0	0	113.5
563	A	35.3	Very low	30.8	Very low	93 Å²	93	131.9 Å²	131.9	77%	0.769	80%	0.802	S	S	*	*			trans	-121.6	127.9	150.3	0	0	0	0	0	108.3	T565	A563-T565 PolarHBondContact O-N 3Å
564	K	27.9	Very low	30.5	Very low	207 Å²	207	130.5 Å²	130.5	90%	0.9	79%	0.792	S	S	*	*			trans	-76.4	114.7	-170.2	-65.2	175.5	-178.8	175.1	0	111.3
565	T	32.3	Very low	30.5	Very low	127 Å²	127	132.3 Å²	132.3	78%	0.779	79%	0.792	S	S	*	*			trans	-110.1	144.3	158.4	46.3	0	0	0	0	109.6	A563 T567	A563-T565 PolarHBondContact O-N 3Å; T565-T567 PolarHBondContact O-N 3.46Å
566	P	29.7	Very low	30.1	Very low	117 Å²	117	132.9 Å²	132.9	76%	0.76	80%	0.796	S	S	*	*			trans	-73.2	130.4	-172.7	28.4	-34.2	0	0	0	111.6	I568	P566-I568 PolarHBondContact O-N 3.33Å
567	T	27.7	Very low	30.1	Very low	123 Å²	123	131.3 Å²	131.3	76%	0.755	79%	0.794	S	S	*	*			trans	-64.8	100.1	170.7	-35.7	0	0	0	0	109.3	T565 N569	T565-T567 PolarHBondContact O-N 3.46Å; T567-N569 VanDerWaalsContact C-N 3.34Å; T567-N569 PolarHBondContact O-N 2.75Å
568	I	32.1	Very low	29.7	Very low	161 Å²	161	132.8 Å²	132.8	83%	0.826	80%	0.798	S	S	*	*			trans	-70.8	98	168	-61.4	-178.6	0	0	0	106.9	P566	P566-I568 PolarHBondContact O-N 3.33Å
569	N	29.3	Very low	29.6	Very low	114 Å²	114	131.8 Å²	131.8	61%	0.61	79%	0.791	S	S	*	*			trans	-57.1	149.8	179.2	-82.8	-18.6	0	0	0	111.6	T567 L571	T567-N569 VanDerWaalsContact C-N 3.34Å; T567-N569 PolarHBondContact O-N 2.75Å; N569-L571 HydrophobicContact CB-CD1 3.73Å; N569-L571 PolarHBondContact O-N 2.94Å
570	S	27.5	Very low	29.2	Very low	124 Å²	124	133.1 Å²	133.1	87%	0.867	79%	0.794	S	S	*	*			trans	-67.1	72.6	165.5	172.6	0	0	0	0	110.7	C572	S570-C572 PolarHBondContact O-N 3.35Å
571	L	28.6	Very low	29.1	Very low	144 Å²	144	133 Å²	133	75%	0.754	79%	0.793	S	S	*	*			trans	-77	100.1	165.5	-98.7	69.5	0	0	0	108.9	N569	N569-L571 HydrophobicContact CB-CD1 3.73Å; N569-L571 PolarHBondContact O-N 2.94Å
572	C	26.8	Very low	28.7	Very low	102 Å²	102	130.1 Å²	130.1	69%	0.689	77%	0.773	S	S	*	*			trans	-56.8	135.9	159.9	-168.3	0	0	0	0	108.7	S570 S574	S570-C572 PolarHBondContact O-N 3.35Å; C572-S574 PolarHBondContact O-N 2.93Å
573	C	27.5	Very low	28.8	Very low	137 Å²	137	125.7 Å²	125.7	93%	0.926	77%	0.767	S	S	*	*	S	Bend	trans	-77.4	76	178.5	-64	0	0	0	0	110.9
574	S	25.8	Very low	28.7	Very low	88 Å²	88	125.1 Å²	125.1	62%	0.615	75%	0.75	S	S	*	*			trans	-124	61.2	175.6	60.1	0	0	0	0	111.1	C572	C572-S574 PolarHBondContact O-N 2.93Å
575	N	28.9	Very low	28.7	Very low	158 Å²	158	117 Å²	117	85%	0.845	72%	0.718	S	S	*	*			trans	-113.6	120.8	162.8	-91.7	-0.9	0	0	0	108.4	T577	N575-T577 PolarHBondContact O-N 3.5Å
576	T	25	Very low	29.1	Very low	141 Å²	141	113.1 Å²	113.1	87%	0.865	69%	0.691	S	S	*	*			trans	-90.9	93.1	-171.6	-45.6	0	0	0	0	110.8
577	T	29.8	Very low	29.1	Very low	119 Å²	119	110.6 Å²	110.6	73%	0.73	67%	0.67	S	S	*	*			trans	-124.7	113.5	168.3	45.7	0	0	0	0	110.6	N575 S579	N575-T577 PolarHBondContact O-N 3.5Å; T577-S579 PolarHBondContact O-N 2.97Å
578	T	25.1	Very low	29.3	Very low	146 Å²	146	107.3 Å²	107.3	90%	0.896	65%	0.65	S	S	*	*			trans	-66.9	104.2	-177.9	43.7	0	0	0	0	111.2
579	S	29	Very low	29.1	Very low	91 Å²	91	107.9 Å²	107.9	64%	0.636	65%	0.646	S	S	*	*			trans	-137.5	126.4	169.4	49.2	0	0	0	0	109.1	T577 V581	T577-S579 PolarHBondContact O-N 2.97Å; S579-V581 PolarHBondContact O-N 3.3Å
580	T	26.4	Very low	29.1	Very low	154 Å²	154	106.8 Å²	106.8	95%	0.945	64%	0.64	S	S	*	*			trans	-82.1	76	-167	40.5	0	0	0	0	112.3	S582	T580-S582 PolarHBondContact O-N 2.86Å
581	V	29.2	Very low	29.1	Very low	127 Å²	127	105.3 Å²	105.3	77%	0.77	63%	0.628	S	S	*	*			trans	-86.2	110.7	177	-175.3	0	0	0	0	111	S579 S583	S579-V581 PolarHBondContact O-N 3.3Å; V581-S583 PolarHBondContact O-N 3.16Å
582	S	28.6	Very low	29	Very low	60 Å²	60	105.8 Å²	105.8	42%	0.42	62%	0.624	S	S	.	*			trans	-58.4	123.5	176.6	-172.3	0	0	0	0	112.1	Q21 T580	Q21-S582 VanDerWaalsContact CD-OG 3.27Å; Q21-S582 PolarHBondContact NE2-OG 2.98Å; Q21-S582 VanDerWaalsContact NE2-OG 3.15Å; Q21-S582 VanDerWaalsContact OE1-CB 3.3Å; Q21-S582 PolarHBondContact OE1-OG 3.44Å; T580-S582 PolarHBondContact O-N 2.86Å
583	S	32.3	Very low	29	Very low	107 Å²	107	107.5 Å²	107.5	75%	0.748	63%	0.626	S	S	*	*			trans	-90.8	122.3	175.5	45.9	0	0	0	0	110.9	V581 P585	V581-S583 PolarHBondContact O-N 3.16Å; S583-P585 VanDerWaalsContact O-CD 3.29Å; S583-P585 WeakPolarHBondContact O-CD 3.18Å
584	I	32.5	Very low	28.8	Very low	80 Å²	80	106.9 Å²	106.9	41%	0.41	62%	0.623	S	S	.	*			trans	-85.8	112.4	-179.9	-55.2	174.2	0	0	0	109.4
585	P	28.5	Very low	28.9	Very low	36 Å²	36	109.3 Å²	109.3	23%	0.234	63%	0.628	C	S	.	*			trans	-79	134	-177.5	31.4	-35	0	0	0	112.1	V19 S583 I587	V19-P585 HydrophobicContact CG2-CG 4.26Å; S583-P585 VanDerWaalsContact O-CD 3.29Å; S583-P585 WeakPolarHBondContact O-CD 3.18Å; P585-I587 PolarHBondContact O-N 2.91Å
586	K	40.8	Very low	29	Very low	47 Å²	47	108.6 Å²	108.6	20%	0.204	62%	0.624	C	S	.	*			trans	-89.5	89.9	176.5	-70.9	177.3	-174.7	164.7	0	110.1	P16 D333 E351 R372 V588	P16-K586 HydrophobicContact CB-CG 4.43Å; P16-K586 HydrophobicContact CG-CG 4.47Å; D333-K586 WeakPolarHBondContact OD2-CE 3.48Å; D333-K586 IonicContact OD2-NZ 3.91Å; E351-K586 PolarHBondContact OE2-N 3.09Å; R372-K586 PolarHBondContact NH1-O 3.48Å; R372-K586 VanDerWaalsContact NH1-O 3.17Å; K586-V588 PolarHBondContact O-N 2.85Å; K586-V588 VanDerWaalsContact O-N 3.16Å
587	I	30.9	Very low	29.1	Very low	63 Å²	63	106.8 Å²	106.8	32%	0.323	60%	0.604	S	S	.	*			trans	-57.3	116.4	-178.2	-49.5	-178.5	0	0	0	110.9	P585	P585-I587 PolarHBondContact O-N 2.91Å
588	V	30.1	Very low	29.2	Very low	54 Å²	54	108.2 Å²	108.2	33%	0.327	61%	0.606	S	S	.	*			trans	-117.9	126.9	174.6	167.4	0	0	0	0	110.1	K586	K586-V588 PolarHBondContact O-N 2.85Å; K586-V588 VanDerWaalsContact O-N 3.16Å
589	F	28.6	Very low	29.2	Very low	173 Å²	173	106.8 Å²	106.8	76%	0.759	59%	0.593	S	S	*	*			trans	-74.7	141	176.3	-97.8	-101.7	0	0	0	111.8	P591	F589-P591 WeakPolarHBondContact O-CD 3.39Å
590	N	28.8	Very low	29.4	Very low	91 Å²	91	109.7 Å²	109.7	49%	0.487	60%	0.6	S	S	.	*			trans	-104.5	102.6	179.7	-174.9	2.9	0	0	0	110.9	K592	N590-K592 VanDerWaalsContact C-N 3.28Å; N590-K592 PolarHBondContact O-N 3.13Å
591	P	27.7	Very low	29.4	Very low	93 Å²	93	109 Å²	109	60%	0.604	59%	0.59	S	S	*	*			trans	-81.5	67.7	-175.2	34.4	-36.6	0	0	0	112.4	F589	F589-P591 WeakPolarHBondContact O-CD 3.39Å
592	K	26.5	Very low	29.6	Very low	154 Å²	154	108.3 Å²	108.3	67%	0.67	59%	0.588	S	S	*	*			trans	-129.3	53.1	166.4	-77.6	-165.3	179.1	-176.2	0	111.8	E362 N590	E362-K592 IonicContact OE1-NZ 3.08Å; E362-K592 PolarHBondContact OE1-NZ 3.15Å; N590-K592 VanDerWaalsContact C-N 3.28Å; N590-K592 PolarHBondContact O-N 3.13Å
593	L	26.5	Very low	29.7	Very low	139 Å²	139	110.4 Å²	110.4	73%	0.728	60%	0.602	S	S	*	*			trans	-133.2	98	161.9	-88.4	172.4	0	0	0	109.6	L595	L593-L595 HydrophobicContact CD1-CD1 4.48Å; L593-L595 HydrophobicContact CD2-CD1 4.27Å; L593-L595 PolarHBondContact O-N 3.35Å; L593-L595 VanDerWaalsContact O-N 3.15Å
594	S	23.4	Very low	29.6	Very low	123 Å²	123	110.7 Å²	110.7	86%	0.86	60%	0.602	S	S	*	*			trans	-71.2	95.1	158.7	49.3	0	0	0	0	108
595	L	29	Very low	29.7	Very low	139 Å²	139	114.8 Å²	114.8	73%	0.728	62%	0.623	S	S	*	*			trans	-119	135.5	175.3	-105.4	168.4	0	0	0	110.9	L593	L593-L595 HydrophobicContact CD1-CD1 4.48Å; L593-L595 HydrophobicContact CD2-CD1 4.27Å; L593-L595 PolarHBondContact O-N 3.35Å; L593-L595 VanDerWaalsContact O-N 3.15Å
596	N	29.3	Very low	29.8	Very low	143 Å²	143	118 Å²	118	77%	0.765	64%	0.641	S	S	*	*			trans	-68	151.9	-169	-63.1	-45.5	0	0	0	112.7	I598	N596-I598 PolarHBondContact O-N 3.34Å
597	K	27.5	Very low	29.3	Very low	103 Å²	103	121.1 Å²	121.1	45%	0.448	67%	0.666	S	S	.	*			trans	0.8	100.5	160.7	-61.5	175.7	-178.2	177.5	0	115.9	D71 L74	D71-K597 WeakPolarHBondContact OD1-CD 3.49Å; D71-K597 VanDerWaalsContact OD1-CE 3.32Å; D71-K597 WeakPolarHBondContact OD1-CE 3.47Å; D71-K597 IonicContact OD1-NZ 3.87Å; D71-K597 PolarHBondContact OD1-NZ 3.19Å; L74-K597 HydrophobicContact CD1-CD 4.26Å
598	I	31.6	Very low	29.4	Very low	150 Å²	150	123.8 Å²	123.8	77%	0.769	69%	0.691	S	S	*	*			trans	-108.1	98.6	153.3	-61.4	179.3	0	0	0	106.9	N596 I600	N596-I598 PolarHBondContact O-N 3.34Å; I598-I600 HydrophobicContact CG2-CG1 4.18Å; I598-I600 PolarHBondContact O-N 3.4Å; I598-I600 VanDerWaalsContact O-N 3.09Å
599	N	26.5	Very low	29.3	Very low	116 Å²	116	127.1 Å²	127.1	62%	0.62	71%	0.712	S	S	*	*			trans	-73.5	94.5	173.8	-78.2	-15.3	0	0	0	109	D71 L601	D71-N599 PolarHBondContact OD2-ND2 3.14Å; N599-L601 PolarHBondContact O-N 2.85Å
600	I	32.8	Very low	29.5	Very low	151 Å²	151	124.3 Å²	124.3	77%	0.774	71%	0.713	S	S	*	*			trans	-78.9	104.8	161.2	-58.4	-176.5	0	0	0	107	I598	I598-I600 HydrophobicContact CG2-CG1 4.18Å; I598-I600 PolarHBondContact O-N 3.4Å; I598-I600 VanDerWaalsContact O-N 3.09Å
601	L	26.5	Very low	29.7	Very low	140 Å²	140	126.8 Å²	126.8	73%	0.733	73%	0.725	S	S	*	*			trans	-68.4	132.2	-179.8	-162.7	75.2	0	0	0	109.7	N599 S603	N599-L601 PolarHBondContact O-N 2.85Å; L601-S603 PolarHBondContact O-N 3.3Å; L601-S603 VanDerWaalsContact O-N 3.16Å
602	P	34	Very low	29.8	Very low	113 Å²	113	126.3 Å²	126.3	73%	0.734	72%	0.724	S	S	*	*			trans	-72.8	107.7	170.8	29.1	-32	0	0	0	109.3
603	S	30.3	Very low	30.1	Very low	104 Å²	104	121.8 Å²	121.8	73%	0.727	71%	0.709	S	S	*	*			trans	-60.4	125.9	172.5	-59.4	0	0	0	0	110.3	L601 I605	L601-S603 PolarHBondContact O-N 3.3Å; L601-S603 VanDerWaalsContact O-N 3.16Å; S603-I605 PolarHBondContact O-N 3.08Å
604	P	30.9	Very low	30.2	Very low	113 Å²	113	117.6 Å²	117.6	73%	0.734	70%	0.7	S	S	*	*			trans	-76.9	108.4	178.3	30.1	-32.5	0	0	0	110.1	V606	P604-V606 PolarHBondContact O-N 2.72Å
605	I	32.9	Very low	30.6	Very low	165 Å²	165	119.4 Å²	119.4	85%	0.846	70%	0.699	S	S	*	*			trans	-77.9	102.5	166	-61.9	-178.6	0	0	0	107.6	S603	S603-I605 PolarHBondContact O-N 3.08Å
606	V	31.3	Very low	30.6	Very low	103 Å²	103	119 Å²	119	62%	0.624	70%	0.697	S	S	*	*			trans	-67.9	138.1	175.4	179.2	0	0	0	0	109.3	P604 S608	P604-V606 PolarHBondContact O-N 2.72Å; V606-S608 PolarHBondContact O-N 2.97Å
607	P	31.2	Very low	30.7	Very low	113 Å²	113	118.6 Å²	118.6	73%	0.734	70%	0.695	S	S	*	*			trans	-70.5	115.7	175	28.7	-34.2	0	0	0	110.7	T609	P607-T609 PolarHBondContact O-N 2.93Å
608	S	32.1	Very low	30.7	Very low	120 Å²	120	118.2 Å²	118.2	84%	0.839	71%	0.706	S	S	*	*			trans	-88	103.2	178.2	-63.6	0	0	0	0	111.6	V606	V606-S608 PolarHBondContact O-N 2.97Å
609	T	27.4	Very low	30.7	Very low	124 Å²	124	119.3 Å²	119.3	76%	0.761	71%	0.709	S	S	*	*			trans	-104.2	116.3	173.1	50.5	0	0	0	0	111.9	P607	P607-T609 PolarHBondContact O-N 2.93Å
610	S	33.2	Very low	30.7	Very low	114 Å²	114	117.9 Å²	117.9	80%	0.797	71%	0.709	S	S	*	*			trans	-144.8	127.5	159.3	50.4	0	0	0	0	106.9
611	I	32.8	Very low	30.5	Very low	142 Å²	142	119.2 Å²	119.2	73%	0.728	72%	0.716	S	S	*	*			cis	78.1	55.8	34.6	-44.3	-177.7	0	0	0	113.3
612	S	30.1	Very low	30.8	Very low	84 Å²	84	117.4 Å²	117.4	59%	0.587	71%	0.713	S	S	*	*				78.2	160.8	110.7	78.8	0	0	0	0	122.6
613	T	32.2	Very low	30.7	Very low	59 Å²	59	118.3 Å²	118.3	36%	0.362	72%	0.722	S	S	.	*			trans	72.9	136.9	167.1	60.6	0	0	0	0	117.8	K909	T613-K909 WeakPolarHBondContact O-CE 3.44Å; T613-K909 PolarHBondContact O-NZ 3.27Å; T613-K909 WeakPolarHBondContact OG1-CB 3.47Å; T613-K909 WeakPolarHBondContact OG1-CD 3.42Å; T613-K909 VanDerWaalsContact OG1-CG 3.29Å; T613-K909 WeakPolarHBondContact OG1-CG 3.37Å
614	G	30	Very low	30.7	Very low	51 Å²	51	122.9 Å²	122.9	53%	0.526	73%	0.729	S	S	.	*			trans	-113.4	-121.3	-170.2	0	0	0	0	0	113.5
615	L	31.3	Very low	30.6	Very low	161 Å²	161	125 Å²	125	84%	0.843	73%	0.734	S	S	*	*			trans	69.5	140	-163.6	-49.8	177.5	0	0	0	112.5
616	N	29.4	Very low	30.6	Very low	129 Å²	129	126.3 Å²	126.3	69%	0.69	73%	0.734	S	S	*	*			cis	-161	176.5	-17.3	-121.2	12.6	0	0	0	109.8
617	N	30.9	Very low	30.5	Very low	136 Å²	136	126.3 Å²	126.3	73%	0.727	74%	0.738	S	S	*	*			trans	63.9	108.2	165.3	-60.2	4.4	0	0	0	115.8
618	S	28.5	Very low	30.6	Very low	95 Å²	95	127.5 Å²	127.5	66%	0.664	74%	0.737	S	S	*	*				74.5	105.1	63	78.2	0	0	0	0	115
619	M	30.1	Very low	30.6	Very low	172 Å²	172	129.4 Å²	129.4	85%	0.847	73%	0.733	S	S	*	*				-164.6	161.4	110.7	-97.6	-79.3	84.2	0	0	110.2
620	S	27.9	Very low	30.8	Very low	86 Å²	86	129.7 Å²	129.7	60%	0.601	73%	0.73	S	S	*	*			trans	-98.5	146.2	-173.5	47.1	0	0	0	0	112.8
621	L	27.7	Very low	30.8	Very low	179 Å²	179	130.7 Å²	130.7	94%	0.937	73%	0.725	S	S	*	*			trans	-114.1	112.4	158.8	-111.9	75.6	0	0	0	109.3
622	P	32.8	Very low	30.9	Very low	103 Å²	103	130.3 Å²	130.3	67%	0.669	72%	0.723	S	S	*	*			trans	-103	130.7	172.3	34.8	-27.7	0	0	0	111.8	K624	P622-K624 PolarHBondContact O-N 3.47Å
623	S	30.8	Very low	31.1	Very low	132 Å²	132	134 Å²	134	92%	0.923	73%	0.731	S	S	*	*			trans	-71.5	125	169.3	-54.7	0	0	0	0	110.7
624	K	31.9	Very low	31.1	Very low	199 Å²	199	135.9 Å²	135.9	87%	0.865	75%	0.746	S	S	*	*			trans	-136.3	159.8	170.5	-90	-170.6	175	-178.6	0	111.6	P622	P622-K624 PolarHBondContact O-N 3.47Å
625	N	28.8	Very low	31.3	Very low	158 Å²	158	136.9 Å²	136.9	85%	0.845	76%	0.757	S	S	*	*			trans	-86.8	160.8	-165.6	-73.5	-37.2	0	0	0	115
626	K	32.1	Very low	31.4	Very low	192 Å²	192	137.7 Å²	137.7	84%	0.835	75%	0.753	S	S	*	*			trans	80.1	103.9	152.3	-78.4	178.4	177.7	-173.5	0	120.3
627	S	29.7	Very low	31.6	Very low	103 Å²	103	136.9 Å²	136.9	72%	0.72	75%	0.749	S	S	*	*				81.7	153.3	117.7	68.4	0	0	0	0	122
628	I	32.3	Very low	31.8	Very low	139 Å²	139	137.4 Å²	137.4	71%	0.713	75%	0.747	S	S	*	*			trans	89.9	104.4	167.5	-58.2	177.3	0	0	0	115.4
629	Q	32.9	Very low	32.2	Very low	160 Å²	160	140.8 Å²	140.8	75%	0.748	75%	0.752	S	S	*	*			trans	46.5	145.3	135.3	-55	-173.8	-87.1	0	0	121
630	D	31	Very low	32.5	Very low	130 Å²	130	136.5 Å²	136.5	70%	0.695	74%	0.739	S	S	*	*			cis	-152	-141.4	-23.6	-83.9	-39.9	0	0	0	103.3
631	I	33.8	Very low	32.6	Very low	135 Å²	135	139.6 Å²	139.6	69%	0.692	75%	0.749	S	S	*	*			cis	-161.7	142	-6.2	-155.5	168	0	0	0	109
632	I	33.9	Very low	32.8	Very low	134 Å²	134	138.6 Å²	138.6	69%	0.687	74%	0.743	S	S	*	*			trans	61.8	142.9	150.5	-79.8	171.5	0	0	0	119.1
633	E	34.9	Very low	32.8	Very low	161 Å²	161	139.6 Å²	139.6	75%	0.752	75%	0.746	S	S	*	*			cis	-152.7	173.6	1.7	-132.1	166	-169	0	0	115.5
634	S	32.2	Very low	33	Very low	99 Å²	99	138.1 Å²	138.1	69%	0.692	74%	0.736	S	S	*	*			trans	-16.3	166.6	165.2	73.6	0	0	0	0	122.3
635	G	34.3	Very low	33	Very low	72 Å²	72	134.1 Å²	134.1	74%	0.742	73%	0.729	S	S	*	*			cis	172.2	-163.4	5	0	0	0	0	0	109.8
636	K	33.9	Very low	33.2	Very low	177 Å²	177	132.6 Å²	132.6	77%	0.77	72%	0.724	S	S	*	*			cis	-171.4	144	-18.3	-117.7	-173.4	178.4	172.5	0	109.8
637	N	32.5	Very low	33.3	Very low	113 Å²	113	128.8 Å²	128.8	60%	0.604	72%	0.722	S	S	*	*			trans	80	157.8	144.9	-60.9	4.1	0	0	0	125.4
638	H	36.6	Very low	33.5	Very low	146 Å²	146	128.8 Å²	128.8	68%	0.676	72%	0.722	S	S	*	*			trans	82.6	112.5	157	-61.6	-49.9	0	0	0	118.2
639	H	35.8	Very low	33.5	Very low	167 Å²	167	128 Å²	128	77%	0.773	72%	0.724	S	S	*	*				85.7	144	66.9	-88.4	-127.2	0	0	0	112.9
640	S	36.4	Very low	33.6	Very low	82 Å²	82	125.1 Å²	125.1	57%	0.573	72%	0.721	S	S	*	*			cis	-174.7	145.9	-9.1	48.1	0	0	0	0	113.4
641	N	29.9	Very low	33.6	Very low	151 Å²	151	124.3 Å²	124.3	81%	0.807	73%	0.725	S	S	*	*			trans	50.9	173.5	140.8	-64.3	-1.5	0	0	0	123.4
642	I	33	Very low	33.6	Very low	158 Å²	158	123.7 Å²	123.7	81%	0.81	73%	0.733	S	S	*	*			trans	90.9	109.4	177.8	-53.7	164.8	0	0	0	113
643	V	31.7	Very low	33.3	Very low	124 Å²	124	124.1 Å²	124.1	75%	0.752	74%	0.742	S	S	*	*			cis	91.5	142	22.2	-170.2	0	0	0	0	114.6
644	S	34.6	Very low	33.2	Very low	101 Å²	101	122 Å²	122	71%	0.706	75%	0.746	S	S	*	*			trans	79.9	146.2	170	-70.4	0	0	0	0	119.7
645	T	33.7	Very low	33.1	Very low	115 Å²	115	123.1 Å²	123.1	71%	0.706	75%	0.753	S	S	*	*			cis	-168.2	154.8	-25.7	22.5	0	0	0	0	110.5
646	V	32.2	Very low	33	Very low	125 Å²	125	125.4 Å²	125.4	76%	0.758	76%	0.757	S	S	*	*			trans	33	131.4	150.3	-52.1	0	0	0	0	122.8
647	S	34.7	Very low	32.9	Very low	112 Å²	112	123.4 Å²	123.4	78%	0.783	76%	0.76	S	S	*	*				174.2	165.7	108.4	-76.3	0	0	0	0	115
648	S	32.6	Very low	32.7	Very low	104 Å²	104	124.7 Å²	124.7	73%	0.727	77%	0.772	S	S	*	*			trans	-68	176.3	-178.8	42.6	0	0	0	0	114.5
649	V	33.9	Very low	32.4	Very low	123 Å²	123	124.1 Å²	124.1	75%	0.745	78%	0.779	S	S	*	*			cis	-154.2	148.7	31.7	-142.2	0	0	0	0	115.1
650	S	33.5	Very low	32.2	Very low	98 Å²	98	121.6 Å²	121.6	69%	0.685	78%	0.781	S	S	*	*			trans	43.7	113	145.2	61.6	0	0	0	0	123.6
651	S	31	Very low	32.2	Very low	113 Å²	113	125 Å²	125	79%	0.79	79%	0.791	S	S	*	*				60.1	111.9	128.7	66.3	0	0	0	0	122.7
652	S	34	Very low	32.5	Very low	123 Å²	123	123.5 Å²	123.5	86%	0.86	79%	0.789	S	S	*	*				-160.8	163.5	114.7	55	0	0	0	0	111.1
653	T	27.6	Very low	32.6	Very low	143 Å²	143	122 Å²	122	88%	0.877	78%	0.783	S	S	*	*			trans	-84.5	128.2	-170.9	44.8	0	0	0	0	114.4
654	S	32.7	Very low	33.4	Very low	117 Å²	117	119.2 Å²	119.2	82%	0.818	77%	0.768	S	S	*	*			trans	-152.4	147.9	151.8	60.1	0	0	0	0	110.9
655	S	30.5	Very low	33.6	Very low	122 Å²	122	118 Å²	118	85%	0.853	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-87.2	122.8	-179.5	44	0	0	0	0	111.6
656	S	33	Very low	34.1	Very low	119 Å²	119	115.7 Å²	115.7	83%	0.832	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-101.8	125.6	-179.3	50	0	0	0	0	112.8
657	T	30.2	Very low	35	Very low	135 Å²	135	112.5 Å²	112.5	83%	0.828	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-79.6	132.3	177.3	-18.3	0	0	0	0	111	T659	T657-T659 PolarHBondContact O-N 2.94Å
658	T	29.4	Very low	35.5	Very low	140 Å²	140	110.2 Å²	110.2	86%	0.859	72%	0.719	S	S	*	*			trans	-82.6	111.6	168.5	39.3	0	0	0	0	111.1
659	T	30.2	Very low	35.8	Very low	134 Å²	134	113.4 Å²	113.4	82%	0.822	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-81.4	120.4	175.7	31.9	0	0	0	0	111.5	T657	T657-T659 PolarHBondContact O-N 2.94Å
660	S	32	Very low	36.4	Very low	114 Å²	114	113.3 Å²	113.3	80%	0.797	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-100.8	130	164.9	55.3	0	0	0	0	110.3
661	I	35.2	Very low	37.1	Very low	153 Å²	153	115.4 Å²	115.4	79%	0.785	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-83	123.9	-172.4	-58.9	172.4	0	0	0	109.5	L663	I661-L663 PolarHBondContact O-N 3.45Å
662	P	36.4	Very low	37.5	Very low	120 Å²	120	115.6 Å²	115.6	78%	0.779	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-73.1	116.7	176.8	28.8	-33.1	0	0	0	110.9
663	L	36.6	Very low	37.8	Very low	128 Å²	128	117.6 Å²	117.6	67%	0.67	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-60	143.4	174.1	-76.6	125.2	0	0	0	111.8	I661 T667	I661-L663 PolarHBondContact O-N 3.45Å; L663-T667 HydrophobicContact CD2-CG2 3.82Å
664	S	47	Very low	38.1	Very low	64 Å²	64	113.6 Å²	113.6	45%	0.448	68%	0.677	S	S	.	*	P	Polyproline II helix	trans	-64.1	150.8	-178.7	84.6	0	0	0	0	112.6	A666 T667 V668	S664-A666 PolarHBondContact O-N 3.1Å; S664-A666 PolarHBondContact OG-N 3.29Å; S664-T667 PolarHBondContact O-N 3.24Å; S664-T667 VanDerWaalsContact O-N 3.08Å; S664-T667 PolarHBondContact OG-N 3.5Å; S664-T667 PolarHBondContact OG-OG1 2.67Å; S664-V668 PolarHBondContact O-N 3.2Å
665	A	39.4	Very low	38.3	Very low	77 Å²	77	115.7 Å²	115.7	64%	0.636	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	-8.4	175.7	0	0	0	0	0	114.3
666	A	43.6	Very low	38.5	Very low	65 Å²	65	117.9 Å²	117.9	54%	0.537	67%	0.668	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.8	-48.2	169.7	0	0	0	0	0	111.2	S664 V668 R669 E670	S664-A666 PolarHBondContact O-N 3.1Å; S664-A666 PolarHBondContact OG-N 3.29Å; A666-V668 VanDerWaalsContact C-N 3.29Å; A666-V668 PolarHBondContact O-N 3.1Å; A666-R669 WeakPolarHBondContact O-CB 3.39Å; A666-R669 PolarHBondContact O-N 3.43Å; A666-E670 PolarHBondContact O-N 2.88Å
667	T	52	Low	38.5	Very low	58 Å²	58	118.7 Å²	118.7	36%	0.356	67%	0.669	S	S	.	*	H	α-helix	trans	-60.8	-39.6	178.3	-38.2	0	0	0	0	111.5	L663 S664 R669 E670 L671	L663-T667 HydrophobicContact CD2-CG2 3.82Å; S664-T667 PolarHBondContact O-N 3.24Å; S664-T667 VanDerWaalsContact O-N 3.08Å; S664-T667 PolarHBondContact OG-N 3.5Å; S664-T667 PolarHBondContact OG-OG1 2.67Å; T667-R669 PolarHBondContact O-N 3.23Å; T667-E670 PolarHBondContact O-N 3.44Å; T667-L671 PolarHBondContact O-N 3.1Å
668	V	44.3	Very low	38.6	Very low	64 Å²	64	118.1 Å²	118.1	39%	0.388	67%	0.67	S	S	.	*	H	α-helix	trans	-65.5	-21.8	175.1	178.3	0	0	0	0	112.5	S664 A666 L672	S664-V668 PolarHBondContact O-N 3.2Å; A666-V668 VanDerWaalsContact C-N 3.29Å; A666-V668 PolarHBondContact O-N 3.1Å; V668-L672 HydrophobicContact CG1-CD1 3.69Å; V668-L672 HydrophobicContact CG1-CG 4.32Å; V668-L672 VanDerWaalsContact O-CB 3.32Å; V668-L672 WeakPolarHBondContact O-CB 3.18Å; V668-L672 WeakPolarHBondContact O-CD1 3.39Å; V668-L672 WeakPolarHBondContact O-CG 3.22Å; V668-L672 PolarHBondContact O-N 3.1Å
669	R	40.1	Very low	38.8	Very low	171 Å²	171	117 Å²	117	65%	0.645	67%	0.668	S	S	*	*	H	α-helix	trans	-78.4	-45.3	173	-80.7	-172.5	-179.6	126	-0.8	113.2	A666 T667 L671 L672 Y673	A666-R669 WeakPolarHBondContact O-CB 3.39Å; A666-R669 PolarHBondContact O-N 3.43Å; T667-R669 PolarHBondContact O-N 3.23Å; R669-L671 PolarHBondContact O-N 3.17Å; R669-L672 PolarHBondContact O-N 3.03Å; R669-Y673 HydrophobicContact CB-CD2 4.31Å; R669-Y673 HydrophobicContact CG-CD2 4.26Å; R669-Y673 HydrophobicContact CG-CE2 4.41Å; R669-Y673 WeakPolarHBondContact O-CB 3.45Å; R669-Y673 WeakPolarHBondContact O-CD2 3.36Å; R669-Y673 PolarHBondContact O-N 3.36Å
670	E	46.7	Very low	38.9	Very low	122 Å²	122	118.1 Å²	118.1	57%	0.57	67%	0.669	S	S	*	*	H	α-helix	trans	-58.9	-38.6	176.4	-77.1	-100.7	123.9	0	0	110.7	A666 T667 K675	A666-E670 PolarHBondContact O-N 2.88Å; T667-E670 PolarHBondContact O-N 3.44Å; E670-K675 WeakPolarHBondContact OE1-CE 3.39Å; E670-K675 IonicContact OE1-NZ 3.69Å; E670-K675 IonicContact OE2-NZ 3.6Å
671	L	46.3	Very low	38.7	Very low	141 Å²	141	120.5 Å²	120.5	74%	0.738	67%	0.672	S	S	*	*	H	α-helix	trans	-73.9	-25.8	178	-67.9	171.5	0	0	0	114.9	T667 R669	T667-L671 PolarHBondContact O-N 3.1Å; R669-L671 PolarHBondContact O-N 3.17Å
672	L	39.8	Very low	38.3	Very low	117 Å²	117	125 Å²	125	61%	0.613	68%	0.679	S	S	*	*	H	α-helix	trans	-97.8	-15.4	179.5	-70.1	177	0	0	0	114.2	V668 R669	V668-L672 HydrophobicContact CG1-CD1 3.69Å; V668-L672 HydrophobicContact CG1-CG 4.32Å; V668-L672 VanDerWaalsContact O-CB 3.32Å; V668-L672 WeakPolarHBondContact O-CB 3.18Å; V668-L672 WeakPolarHBondContact O-CD1 3.39Å; V668-L672 WeakPolarHBondContact O-CG 3.22Å; V668-L672 PolarHBondContact O-N 3.1Å; R669-L672 PolarHBondContact O-N 3.03Å
673	Y	40.1	Very low	38	Very low	166 Å²	166	124.9 Å²	124.9	65%	0.651	68%	0.676	S	S	*	*	S	Bend	trans	-139.1	53.5	-173	-55	-67.8	0	0	0	110.9	R669	R669-Y673 HydrophobicContact CB-CD2 4.31Å; R669-Y673 HydrophobicContact CG-CD2 4.26Å; R669-Y673 HydrophobicContact CG-CE2 4.41Å; R669-Y673 WeakPolarHBondContact O-CB 3.45Å; R669-Y673 WeakPolarHBondContact O-CD2 3.36Å; R669-Y673 PolarHBondContact O-N 3.36Å
674	G	34.5	Very low	37.7	Very low	58 Å²	58	127.8 Å²	127.8	60%	0.598	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-49.3	140.2	-179.2	0	0	0	0	0	113	E676	G674-E676 PolarHBondContact O-N 3.49Å
675	K	37.5	Very low	36.8	Very low	162 Å²	162	135.4 Å²	135.4	70%	0.704	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-50.6	121.6	-168.4	-73.5	167.4	179.4	151.9	0	112.7	E670 T677	E670-K675 WeakPolarHBondContact OE1-CE 3.39Å; E670-K675 IonicContact OE1-NZ 3.69Å; E670-K675 IonicContact OE2-NZ 3.6Å; K675-T677 PolarHBondContact O-N 2.77Å
676	E	34.9	Very low	36.6	Very low	167 Å²	167	137.8 Å²	137.8	78%	0.78	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-65.9	117.6	171.8	-65.9	-174	152	0	0	110	M1 G674	M1-E676 WeakPolarHBondContact CE-OE1 3.17Å; G674-E676 PolarHBondContact O-N 3.49Å
677	T	32.9	Very low	36.1	Very low	137 Å²	137	139.9 Å²	139.9	84%	0.84	72%	0.721	S	S	*	*			trans	-112.1	140	163	49.1	0	0	0	0	109.4	K675	K675-T677 PolarHBondContact O-N 2.77Å
678	S	31.2	Very low	35.7	Very low	122 Å²	122	143.4 Å²	143.4	85%	0.853	75%	0.745	S	S	*	*			trans	-111	118.5	-165.5	47.5	0	0	0	0	113
679	S	34.9	Very low	35.2	Very low	118 Å²	118	147.9 Å²	147.9	83%	0.825	77%	0.765	S	S	*	*			trans	-154.3	153.1	160	55.4	0	0	0	0	112.4
680	N	30.5	Very low	34.8	Very low	157 Å²	157	147.1 Å²	147.1	84%	0.84	77%	0.773	S	S	*	*			trans	-72.3	154.5	-172.6	-42	-75.7	0	0	0	112.9
681	L	29.6	Very low	34.2	Very low	163 Å²	163	149.9 Å²	149.9	85%	0.853	79%	0.786	S	S	*	*			trans	-168.4	137.6	131.9	-103.6	158.5	0	0	0	110.7
682	W	26.3	Very low	33.5	Very low	248 Å²	248	148.4 Å²	148.4	94%	0.939	79%	0.786	S	S	*	*			trans	-115.2	121.8	167.1	-83.5	66.8	0	0	0	107.5
683	T	30	Very low	33.4	Very low	117 Å²	117	150 Å²	150	72%	0.718	80%	0.799	S	S	*	*			trans	-167.1	132.2	150.2	16.5	0	0	0	0	112.6
684	E	30.9	Very low	33	Very low	189 Å²	189	149.5 Å²	149.5	88%	0.883	81%	0.807	S	S	*	*			trans	61.7	176.9	143.9	-63.3	-172.2	172.1	0	0	121.6
685	R	26.9	Very low	32.7	Very low	224 Å²	224	151.6 Å²	151.6	85%	0.845	81%	0.813	S	S	*	*			trans	-152.6	113.3	-153.7	178.8	-163.9	-164.8	-172	6.6	109.9
686	P	35	Very low	32.4	Very low	127 Å²	127	152.3 Å²	152.3	83%	0.825	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-73.1	134	175.7	-17.3	31.6	0	0	0	112.5
687	T	33	Very low	32.1	Very low	110 Å²	110	149.5 Å²	149.5	68%	0.675	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-101.9	139.9	157.4	45.5	0	0	0	0	109.1
688	P	45.4	Very low	32.1	Very low	132 Å²	132	148 Å²	148	86%	0.857	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-60.2	151.1	172	-22.5	34.4	0	0	0	112.4
689	I	33.1	Very low	32.2	Very low	157 Å²	157	148.5 Å²	148.5	81%	0.805	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-101.6	148.8	-174.3	-65.6	168	0	0	0	109.9
690	N	31	Very low	32.1	Very low	155 Å²	155	147.8 Å²	147.8	83%	0.829	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-87.8	133	170.2	-75.5	-17.2	0	0	0	111
691	E	33.7	Very low	32.3	Very low	180 Å²	180	145 Å²	145	84%	0.841	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-89	134.4	166	-77.5	-86.9	119.7	0	0	110.5
692	P	33.1	Very low	32.5	Very low	111 Å²	111	142.1 Å²	142.1	72%	0.721	80%	0.797	S	S	*	*			trans	-104.3	144.2	174.4	36.9	-30.4	0	0	0	113.2
693	V	36.7	Very low	32.8	Very low	149 Å²	149	135.3 Å²	135.3	90%	0.903	79%	0.787	S	S	*	*			trans	-129.6	147.3	165.7	-178.1	0	0	0	0	109.4
694	L	32.7	Very low	32.9	Very low	156 Å²	156	136.3 Å²	136.3	82%	0.817	79%	0.787	S	S	*	*			trans	-95.1	147	-155.8	-75.3	161	0	0	0	115.8
695	S	27.8	Very low	32.9	Very low	102 Å²	102	133.1 Å²	133.1	71%	0.713	78%	0.78	S	S	*	*			trans	6	137.1	152	60.2	0	0	0	0	121.4
696	L	31.3	Very low	33.1	Very low	177 Å²	177	127.9 Å²	127.9	93%	0.927	77%	0.773	S	S	*	*				-155.4	158.4	122.6	-106.8	158.1	0	0	0	110
697	S	28.1	Very low	33	Very low	109 Å²	109	128.8 Å²	128.8	76%	0.762	77%	0.77	S	S	*	*			trans	-146	126.9	-156.7	58.4	0	0	0	0	116.2
698	S	33.7	Very low	33	Very low	104 Å²	104	127.5 Å²	127.5	73%	0.727	77%	0.766	S	S	*	*			trans	-166.4	122.5	160.2	51.6	0	0	0	0	108.2
699	T	31.8	Very low	32.4	Very low	133 Å²	133	130 Å²	130	82%	0.816	77%	0.766	S	S	*	*				49.4	128.1	78.2	62.9	0	0	0	0	113.4
700	S	34.7	Very low	32.2	Very low	103 Å²	103	127.2 Å²	127.2	72%	0.72	76%	0.759	S	S	*	*			cis	-164.2	146.7	12.1	48	0	0	0	0	115.2
701	S	34	Very low	32.2	Very low	98 Å²	98	125.4 Å²	125.4	69%	0.685	75%	0.75	S	S	*	*			trans	49	119.3	140.8	64.2	0	0	0	0	123.8
702	S	33.5	Very low	32.1	Very low	103 Å²	103	125 Å²	125	72%	0.72	75%	0.745	S	S	*	*				87.5	146.5	121	72.3	0	0	0	0	123
703	S	33.3	Very low	32	Very low	105 Å²	105	126.7 Å²	126.7	73%	0.734	75%	0.748	S	S	*	*			trans	73.8	156.9	157.5	-58.3	0	0	0	0	119.1
704	I	31.4	Very low	31.6	Very low	139 Å²	139	126.7 Å²	126.7	71%	0.713	74%	0.742	S	S	*	*			cis	-179.4	126.9	-48	-105.6	163.6	0	0	0	106.1
705	T	31.1	Very low	31.6	Very low	122 Å²	122	124.9 Å²	124.9	75%	0.748	74%	0.738	S	S	*	*			trans	61	158.5	168.4	55	0	0	0	0	117.1
706	T	31.2	Very low	31.7	Very low	114 Å²	114	126.9 Å²	126.9	70%	0.699	74%	0.741	S	S	*	*			cis	-158.7	167.1	-2.2	1.9	0	0	0	0	112.4
707	L	31.6	Very low	31.7	Very low	145 Å²	145	127.8 Å²	127.8	76%	0.759	74%	0.74	S	S	*	*			trans	75.3	109	142.3	-78.6	163.2	0	0	0	122.7
708	S	33.6	Very low	31.8	Very low	84 Å²	84	131.2 Å²	131.2	59%	0.587	74%	0.744	S	S	*	*				74.3	120.1	120.5	67.9	0	0	0	0	123.7
709	H	32.6	Very low	31.7	Very low	183 Å²	183	131.5 Å²	131.5	85%	0.847	75%	0.746	S	S	*	*			trans	60.3	149.9	138.9	-62.7	94.1	0	0	0	118.9
710	C	29.3	Very low	31.8	Very low	100 Å²	100	130.7 Å²	130.7	68%	0.676	75%	0.745	S	S	*	*			cis	-151.4	163.6	11.8	-151.9	0	0	0	0	113.9
711	N	31.5	Very low	31.8	Very low	117 Å²	117	132.3 Å²	132.3	63%	0.626	75%	0.751	S	S	*	*			trans	-4.3	134.9	163.1	-77.2	-73	0	0	0	123.1
712	K	30.8	Very low	31.6	Very low	171 Å²	171	134.9 Å²	134.9	74%	0.743	76%	0.757	S	S	*	*				59.1	118.8	129.5	-59	170.1	-177.5	172.3	0	120.9
713	N	31.1	Very low	31.3	Very low	147 Å²	147	138.6 Å²	138.6	79%	0.786	77%	0.768	S	S	*	*				-179.7	178.8	92.8	-100.3	-25.8	0	0	0	113.6
714	L	29.4	Very low	31.2	Very low	148 Å²	148	138.6 Å²	138.6	78%	0.775	77%	0.768	S	S	*	*			trans	-61.3	159.5	172.3	-64.3	65.8	0	0	0	110.7
715	T	31.7	Very low	31	Very low	118 Å²	118	139.6 Å²	139.6	72%	0.724	77%	0.774	S	S	*	*				-162.6	170.4	54.2	40	0	0	0	0	113.9
716	N	29.6	Very low	31	Very low	145 Å²	145	139.9 Å²	139.9	78%	0.775	78%	0.781	S	S	*	*			trans	30.8	129.2	151.7	-61.2	1.8	0	0	0	121.5
717	E	32.7	Very low	31	Very low	196 Å²	196	139.2 Å²	139.2	92%	0.916	78%	0.782	S	S	*	*				-158.7	-177.9	92.8	-112.9	-175.6	-175	0	0	113.1
718	Q	29.7	Very low	31.2	Very low	181 Å²	181	138.2 Å²	138.2	85%	0.846	78%	0.777	S	S	*	*			trans	-113.2	157.7	-158.5	-56.2	174.7	-3.2	0	0	114
719	S	31.9	Very low	31.3	Very low	110 Å²	110	140.4 Å²	140.4	77%	0.769	78%	0.782	S	S	*	*			trans	177.7	144.5	130.6	39.4	0	0	0	0	114.7
720	S	34.3	Very low	31.3	Very low	115 Å²	115	138.4 Å²	138.4	80%	0.804	78%	0.777	S	S	*	*			trans	66.8	147.8	160.1	77.1	0	0	0	0	119.7
721	V	33.6	Very low	31.6	Very low	138 Å²	138	139.6 Å²	139.6	84%	0.836	78%	0.781	S	S	*	*			cis	-150	164.5	-20.4	122.4	0	0	0	0	108.8
722	N	29.8	Very low	31.6	Very low	152 Å²	152	139.2 Å²	139.2	81%	0.813	78%	0.784	S	S	*	*			trans	-64.9	157.1	-163.9	-58.9	-36.4	0	0	0	117.8
723	L	27	Very low	31.8	Very low	181 Å²	181	138.3 Å²	138.3	95%	0.948	79%	0.785	S	S	*	*			trans	-113.7	128.3	160.4	-99	160.1	0	0	0	109.2
724	S	31	Very low	32	Very low	105 Å²	105	136.6 Å²	136.6	73%	0.734	79%	0.785	S	S	*	*			trans	-157	127.9	172.2	59.3	0	0	0	0	113.8
725	N	26.6	Very low	32	Very low	159 Å²	159	135.9 Å²	135.9	85%	0.85	79%	0.787	S	S	*	*			trans	16	130.4	156.6	-54.9	-8.1	0	0	0	121.3
726	S	32.9	Very low	32.3	Very low	128 Å²	128	137 Å²	137	90%	0.895	79%	0.794	S	S	*	*			trans	-143.7	130.6	132.2	-75.8	0	0	0	0	109.6
727	S	29.9	Very low	32.6	Very low	101 Å²	101	139.4 Å²	139.4	71%	0.706	80%	0.797	S	S	*	*			trans	-89.3	166.2	164.8	52.7	0	0	0	0	110.4
728	D	35.7	Very low	32.7	Very low	123 Å²	123	136.2 Å²	136.2	66%	0.658	79%	0.791	S	S	*	*				176.1	138.1	115.8	-97.2	17.6	0	0	0	114.8
729	N	36.3	Very low	32.9	Very low	130 Å²	130	135.5 Å²	135.5	70%	0.695	79%	0.788	S	S	*	*			trans	56.5	155.4	146.2	-59.9	-42.9	0	0	0	122
730	L	32.5	Very low	32.7	Very low	141 Å²	141	136.3 Å²	136.3	74%	0.738	79%	0.788	S	S	*	*			cis	-163.7	170.9	-44.2	-152.3	106.8	0	0	0	108.4
731	T	34.6	Very low	32.7	Very low	125 Å²	125	137.6 Å²	137.6	77%	0.767	79%	0.791	S	S	*	*			trans	93.2	144.2	172.1	73.1	0	0	0	0	118.1
732	T	33.2	Very low	32.6	Very low	110 Å²	110	136.6 Å²	136.6	68%	0.675	79%	0.79	S	S	*	*			cis	-159.8	131.2	-20.6	-96.6	0	0	0	0	111.8
733	I	35	Very low	32.8	Very low	151 Å²	151	134.7 Å²	134.7	77%	0.774	79%	0.789	S	S	*	*			trans	40.6	119.8	152	-57.1	169.7	0	0	0	120.6
734	S	34.4	Very low	33.2	Very low	112 Å²	112	135.4 Å²	135.4	78%	0.783	79%	0.787	S	S	*	*				-176.3	127.9	120.2	-80.7	0	0	0	0	111.9
735	T	30.3	Very low	33.2	Very low	133 Å²	133	135.7 Å²	135.7	82%	0.816	79%	0.789	S	S	*	*			trans	-149.5	133	-173.7	56.3	0	0	0	0	115.7
736	T	37.5	Very low	33.7	Very low	142 Å²	142	134.3 Å²	134.3	87%	0.871	79%	0.789	S	S	*	*			trans	-148	107.5	158.8	45.4	0	0	0	0	107
737	K	35.1	Very low	33.5	Very low	195 Å²	195	133.5 Å²	133.5	85%	0.848	78%	0.783	S	S	*	*			cis	88.2	145.1	38.9	-158.3	-179.7	-172.2	-177.2	0	112.5
738	V	34.9	Very low	33.8	Very low	128 Å²	128	135.1 Å²	135.1	78%	0.776	79%	0.789	S	S	*	*			trans	79.1	125.2	-174.3	-176.8	0	0	0	0	112.8
739	Q	34.6	Very low	33.6	Very low	167 Å²	167	136.6 Å²	136.6	78%	0.78	80%	0.797	S	S	*	*			cis	-161.7	175.6	-18.4	-153.5	166.8	-31	0	0	110.6
740	T	27.4	Very low	33.3	Very low	127 Å²	127	137 Å²	137	78%	0.779	80%	0.804	S	S	*	*			trans	-137.6	147.5	173.6	39.1	0	0	0	0	111.9
741	T	34.6	Very low	33.4	Very low	141 Å²	141	137.1 Å²	137.1	87%	0.865	81%	0.81	S	S	*	*			trans	-140	160.3	163.5	49.6	0	0	0	0	110.4
742	S	30.4	Very low	33.1	Very low	117 Å²	117	134.4 Å²	134.4	82%	0.818	81%	0.807	S	S	*	*			trans	-136.5	146.9	-159.7	57.7	0	0	0	0	114.3
743	S	35.4	Very low	33.3	Very low	112 Å²	112	138 Å²	138	78%	0.783	82%	0.821	S	S	*	*			trans	-156.7	108.6	157.2	44.3	0	0	0	0	114.6
744	Q	34.5	Very low	33.1	Very low	196 Å²	196	139.6 Å²	139.6	92%	0.916	82%	0.822	S	S	*	*			trans	43.7	130.1	133.7	-61.6	175.8	-2.9	0	0	122.3
745	S	32.1	Very low	33	Very low	111 Å²	111	141.2 Å²	141.2	78%	0.776	82%	0.822	S	S	*	*			trans	-94	165.9	159.3	55.5	0	0	0	0	112.5
746	P	36	Very low	33.3	Very low	131 Å²	131	144.7 Å²	144.7	85%	0.851	83%	0.826	S	S	*	*			trans	-130.9	161.7	137	37.3	-27.9	0	0	0	114.1
747	S	28.7	Very low	32.9	Very low	111 Å²	111	146.5 Å²	146.5	78%	0.776	82%	0.824	S	S	*	*			trans	-117.8	149.3	-178.1	52.5	0	0	0	0	112.1
748	V	35.8	Very low	32.8	Very low	135 Å²	135	149 Å²	149	82%	0.818	83%	0.829	S	S	*	*			trans	-140.9	104.9	170.2	-175.7	0	0	0	0	112.4
749	N	32.1	Very low	32.5	Very low	154 Å²	154	151 Å²	151	82%	0.824	83%	0.829	S	S	*	*			trans	34.6	146.4	137.9	-59.3	-9.2	0	0	0	124.2
750	T	29.3	Very low	32.5	Very low	137 Å²	137	151.4 Å²	151.4	84%	0.84	84%	0.836	S	S	*	*			trans	-102.1	135.5	176	-50.4	0	0	0	0	112.1
751	V	36.3	Very low	32.7	Very low	145 Å²	145	150.7 Å²	150.7	88%	0.879	83%	0.832	S	S	*	*			trans	-141.4	144.4	152.7	-174.8	0	0	0	0	107.9
752	G	28.1	Very low	32.7	Very low	67 Å²	67	150.4 Å²	150.4	69%	0.691	83%	0.825	S	S	*	*			trans	-123.2	165.8	-177	0	0	0	0	0	114.3
753	L	35.9	Very low	33.1	Very low	185 Å²	185	150.9 Å²	150.9	97%	0.969	83%	0.825	S	S	*	*			trans	-140.4	152.8	172	-100.5	165.3	0	0	0	110.3
754	K	31.9	Very low	33	Very low	186 Å²	186	152.2 Å²	152.2	81%	0.809	82%	0.823	S	S	*	*			trans	-107.7	156.7	-169.6	-83	-177.2	175.8	176.9	0	113.5
755	N	33.3	Very low	33	Very low	146 Å²	146	149.4 Å²	149.4	78%	0.781	82%	0.819	S	S	*	*			trans	61.8	112.7	153.5	-61.4	-1.4	0	0	0	119.4
756	K	35.2	Very low	33.1	Very low	205 Å²	205	150.7 Å²	150.7	89%	0.891	82%	0.817	S	S	*	*				-161.6	156.4	98.7	-108.2	174.4	-178.8	177.2	0	112.5
757	Q	29.2	Very low	33	Very low	180 Å²	180	155.1 Å²	155.1	84%	0.841	82%	0.818	S	S	*	*			trans	-84.6	147.5	-178.6	-57.7	141.7	-69.1	0	0	111.6
758	R	32.8	Very low	33.1	Very low	248 Å²	248	155 Å²	155	94%	0.936	82%	0.817	S	S	*	*				-167.6	148.5	112	-106.5	174	175.3	177.5	-2.5	111.5
759	E	29.5	Very low	32.7	Very low	169 Å²	169	159 Å²	159	79%	0.79	82%	0.819	S	S	*	*			trans	-87.1	158.5	-178.2	-61.6	148.2	110.6	0	0	111.8
760	L	33.7	Very low	32.7	Very low	177 Å²	177	160.2 Å²	160.2	93%	0.927	82%	0.82	S	S	*	*			trans	-156.8	112.8	151.2	-110	163.9	0	0	0	107.9
761	T	31.3	Very low	32.9	Very low	112 Å²	112	162.6 Å²	162.6	69%	0.687	82%	0.821	S	S	*	*			trans	-124.8	168.7	-176.5	50.3	0	0	0	0	110.9
762	N	34.3	Very low	33	Very low	135 Å²	135	161.7 Å²	161.7	72%	0.722	82%	0.821	S	S	*	*			trans	71.9	163.8	161.2	-93	7.1	0	0	0	116
763	P	39.6	Very low	33.3	Very low	126 Å²	126	165.8 Å²	165.8	82%	0.818	83%	0.828	S	S	*	*			cis	-114.8	137.9	24.8	38.3	-26.3	0	0	0	117.7
764	L	32.7	Very low	33.3	Very low	141 Å²	141	161.9 Å²	161.9	74%	0.738	82%	0.816	S	S	*	*			trans	-63.6	153.5	141.8	-105.1	68.6	0	0	0	109.6
765	V	35.6	Very low	33.5	Very low	137 Å²	137	158.8 Å²	158.8	83%	0.83	81%	0.808	S	S	*	*			trans	-85.2	121.4	163.1	179.5	0	0	0	0	108.1
766	D	33.2	Very low	33.7	Very low	138 Å²	138	159.1 Å²	159.1	74%	0.738	80%	0.802	S	S	*	*			trans	-109.3	153.2	179.2	-163.4	4	0	0	0	111
767	Y	34.8	Very low	33.7	Very low	223 Å²	223	156.5 Å²	156.5	88%	0.875	80%	0.798	S	S	*	*			trans	-125.8	91.6	177.1	-112.7	-76.2	0	0	0	108.3
768	S	30.9	Very low	34.1	Very low	108 Å²	108	154.7 Å²	154.7	76%	0.755	80%	0.799	S	S	*	*			trans	-72.5	124.8	-165.3	42	0	0	0	0	114.3
769	Y	27.6	Very low	34.2	Very low	221 Å²	221	148 Å²	148	87%	0.867	79%	0.791	S	S	*	*			trans	-162.5	90.4	160	-146.3	-84.7	0	0	0	112.1
770	E	32.4	Very low	34.7	Very low	179 Å²	179	145.6 Å²	145.6	84%	0.836	79%	0.79	S	S	*	*			trans	-156.1	121.1	147.6	-72	-150.8	157.3	0	0	105
771	E	33.2	Very low	35.2	Very low	186 Å²	186	142.4 Å²	142.4	87%	0.869	78%	0.78	S	S	*	*				59.7	120.1	93.3	-67.3	-160.4	154.3	0	0	114.5
772	S	37.8	Very low	35.6	Very low	126 Å²	126	143 Å²	143	88%	0.881	79%	0.785	S	S	*	*			trans	-119.6	123.2	-176.4	57.7	0	0	0	0	110
773	D	34.7	Very low	36.2	Very low	154 Å²	154	142.1 Å²	142.1	82%	0.824	79%	0.787	S	S	*	*			trans	-98.7	157	-167.5	-162.7	5.2	0	0	0	113.7
774	S	35.4	Very low	36.2	Very low	102 Å²	102	146.1 Å²	146.1	71%	0.713	79%	0.791	S	S	*	*			trans	58.8	128.3	173.1	65.1	0	0	0	0	116.9
775	D	36.4	Very low	36.1	Very low	121 Å²	121	150.6 Å²	150.6	65%	0.647	80%	0.798	S	S	*	*				-169.9	161.1	65.8	-160.5	2.4	0	0	0	113.5
776	K	38.1	Very low	36.1	Very low	153 Å²	153	150 Å²	150	67%	0.665	80%	0.801	S	S	*	*			trans	64.4	103.7	162.6	-73.3	141.7	-175	147	0	122.7
777	N	34.1	Very low	36	Very low	150 Å²	150	154.5 Å²	154.5	80%	0.802	81%	0.807	S	S	*	*				85.8	146.8	126.1	-64	-18.7	0	0	0	123.4
778	V	38.3	Very low	36.1	Very low	142 Å²	142	151 Å²	151	86%	0.861	81%	0.809	S	S	*	*			trans	83.4	108.2	165.4	-164.9	0	0	0	0	118.5
779	S	34.8	Very low	36.1	Very low	109 Å²	109	150.8 Å²	150.8	76%	0.762	81%	0.808	S	S	*	*			trans	-101.5	-172.7	163	-41.7	0	0	0	0	109.9
780	P	40.6	Very low	36.5	Very low	118 Å²	118	149.6 Å²	149.6	77%	0.766	81%	0.81	S	S	*	*			cis	-135.1	-140	0.5	45.3	-24.8	0	0	0	110.7
781	P	43.8	Very low	36.5	Very low	110 Å²	110	147 Å²	147	71%	0.714	81%	0.811	S	S	*	*			cis	-123.7	173.6	-33.2	37.6	-21.7	0	0	0	114.4
782	P	39.7	Very low	36.5	Very low	123 Å²	123	142.1 Å²	142.1	80%	0.799	81%	0.811	S	S	*	*			trans	-110	159.8	-177	39.8	-33.8	0	0	0	116.3
783	P	46.1	Very low	36.1	Very low	118 Å²	118	141.3 Å²	141.3	77%	0.766	81%	0.805	S	S	*	*			trans	-115.3	110.2	171.9	36.5	-26	0	0	0	116.4
784	K	39.7	Very low	36	Very low	209 Å²	209	141 Å²	141	91%	0.909	80%	0.803	S	S	*	*			trans	57.4	129.7	133.2	-61.1	177.4	-178.8	176.8	0	122.2
785	R	31	Very low	36	Very low	235 Å²	235	140.8 Å²	140.8	89%	0.887	80%	0.802	S	S	*	*			trans	-63.9	158.4	163.7	-67	171.5	166.7	170	-5.3	112.9
786	S	36.3	Very low	35.6	Very low	126 Å²	126	138.9 Å²	138.9	88%	0.881	81%	0.811	S	S	*	*			trans	-128.4	152.4	137.3	60.5	0	0	0	0	110.2
787	R	31.2	Very low	35.4	Very low	231 Å²	231	137 Å²	137	87%	0.872	81%	0.813	S	S	*	*			trans	-117.8	128.8	-177.5	-127.9	-177.1	172.9	-179.4	-5.7	107.3
788	T	36.5	Very low	35.3	Very low	150 Å²	150	136.2 Å²	136.2	92%	0.92	81%	0.813	S	S	*	*			trans	-136.5	152.8	150.6	47	0	0	0	0	108.4
789	S	30.5	Very low	34.9	Very low	103 Å²	103	140 Å²	140	72%	0.72	81%	0.812	S	S	*	*			trans	-131.6	129.6	-170	51.6	0	0	0	0	110.1
790	H	35.9	Very low	34.8	Very low	197 Å²	197	140.9 Å²	140.9	91%	0.912	81%	0.813	S	S	*	*			trans	-139.4	134.7	154.6	-87.3	-65.5	0	0	0	110.7
791	S	32	Very low	34.7	Very low	124 Å²	124	140.7 Å²	140.7	87%	0.867	81%	0.812	S	S	*	*			trans	-76.5	147.6	169.5	41.2	0	0	0	0	110.5
792	G	33	Very low	34.1	Very low	83 Å²	83	139.1 Å²	139.1	86%	0.856	82%	0.815	S	S	*	*			trans	-170.9	98.8	175.5	0	0	0	0	0	110.4
793	S	30.6	Very low	33.7	Very low	110 Å²	110	140.2 Å²	140.2	77%	0.769	81%	0.814	S	S	*	*			trans	-106.1	123.5	179.3	52.4	0	0	0	0	110.8
794	D	33	Very low	33.3	Very low	146 Å²	146	142.4 Å²	142.4	78%	0.781	81%	0.814	S	S	*	*			trans	-170.4	125.5	142.2	-97.3	-39	0	0	0	107.1
795	S	35	Very low	32.8	Very low	98 Å²	98	138.7 Å²	138.7	69%	0.685	80%	0.804	S	S	*	*				75	139.5	64.2	96.7	0	0	0	0	112.9
796	G	28.3	Very low	33.1	Very low	82 Å²	82	134.6 Å²	134.6	85%	0.845	80%	0.795	S	S	*	*			trans	-103.2	136.3	-167.5	0	0	0	0	0	112.4
797	T	33.7	Very low	33.1	Very low	114 Å²	114	134.6 Å²	134.6	70%	0.699	79%	0.79	S	S	*	*			trans	-118.2	122.7	179.9	-55.8	0	0	0	0	111.8
798	V	32	Very low	33.4	Very low	133 Å²	133	127.6 Å²	127.6	81%	0.806	78%	0.776	S	S	*	*			trans	-79	133.2	169.3	174.6	0	0	0	0	109.1
799	W	28.6	Very low	33.4	Very low	220 Å²	220	126.9 Å²	126.9	83%	0.833	76%	0.762	S	S	*	*			trans	-101.5	122.5	178.3	-90.4	79.1	0	0	0	112.8
800	V	34	Very low	33.5	Very low	129 Å²	129	129 Å²	129	78%	0.782	76%	0.759	S	S	*	*			trans	-135.6	129.5	158.8	-178.9	0	0	0	0	106.7
801	P	37.6	Very low	33.6	Very low	114 Å²	114	128.9 Å²	128.9	74%	0.74	76%	0.758	S	S	*	*			trans	-89.8	155	-165.3	34.5	-36.6	0	0	0	115
802	G	31.9	Very low	33.8	Very low	76 Å²	76	129.6 Å²	129.6	78%	0.784	75%	0.747	S	S	*	*			trans	-126.8	167.3	169	0	0	0	0	0	112.3
803	N	30	Very low	34	Very low	147 Å²	147	134.9 Å²	134.9	79%	0.786	75%	0.747	S	S	*	*			trans	-99.3	-175.6	-166.4	-84.2	-19	0	0	0	115.1
804	H	37.4	Very low	34.2	Very low	163 Å²	163	135.5 Å²	135.5	76%	0.755	74%	0.742	S	S	*	*			trans	91.7	116.3	168.4	-53.9	-74.4	0	0	0	113.8
805	N	30.6	Very low	34.4	Very low	131 Å²	131	137.5 Å²	137.5	70%	0.701	74%	0.743	S	S	*	*				67.3	140.3	80.7	-77.1	30.7	0	0	0	111.6
806	E	36.4	Very low	34.5	Very low	149 Å²	149	137.9 Å²	137.9	70%	0.696	75%	0.746	S	S	*	*			cis	-166.2	152.2	29	-147.6	142.8	-109.9	0	0	112.5
807	T	36.6	Very low	34.8	Very low	127 Å²	127	139.2 Å²	139.2	78%	0.779	74%	0.743	S	S	*	*			trans	58.5	166.7	155.2	45.8	0	0	0	0	119.3
808	S	37	Very low	35.1	Very low	84 Å²	84	138.8 Å²	138.8	59%	0.587	74%	0.744	S	S	*	*			cis	-169.1	165.5	-14.9	-99.3	0	0	0	0	108.8
809	E	36.4	Very low	35.4	Very low	134 Å²	134	139.4 Å²	139.4	63%	0.626	74%	0.743	S	S	*	*			cis	-165.7	168	-17.1	-113.9	173.6	109.4	0	0	113.5
810	K	33.6	Very low	36	Very low	148 Å²	148	134 Å²	134	64%	0.643	73%	0.734	S	S	*	*			trans	32.1	133.4	147.2	-66.9	168.3	179.3	150.6	0	124
811	H	37.5	Very low	36.3	Very low	194 Å²	194	135.3 Å²	135.3	90%	0.898	73%	0.731	S	S	*	*				-170.1	168.7	123.7	-98.8	-71.8	0	0	0	110.2
812	H	37.4	Very low	36.4	Very low	139 Å²	139	138.2 Å²	138.2	64%	0.644	73%	0.732	S	S	*	*				-157.8	157.4	-82.2	-135.2	-79.2	0	0	0	109.5
813	K	37	Very low	36.6	Very low	194 Å²	194	144.9 Å²	144.9	84%	0.843	73%	0.734	S	S	*	*			trans	104.3	151.9	169.6	-62.3	169.3	177.9	175.8	0	117.8
814	D	34.5	Very low	37.2	Very low	123 Å²	123	143.7 Å²	143.7	66%	0.658	72%	0.723	S	S	*	*			cis	-173.9	157.7	-45.8	-118.6	-53.1	0	0	0	112.9
815	K	37.1	Very low	37.4	Very low	189 Å²	189	142.7 Å²	142.7	82%	0.822	72%	0.717	S	S	*	*			trans	64.7	163.5	164.9	-65.3	171.1	-175.2	-177.6	0	117.6
816	S	37.4	Very low	37.8	Very low	106 Å²	106	144.9 Å²	144.9	74%	0.741	72%	0.72	S	S	*	*			cis	177.8	157.5	-25.8	58.3	0	0	0	0	108.6
817	S	35	Very low	37.9	Very low	110 Å²	110	145.1 Å²	145.1	77%	0.769	72%	0.719	S	S	*	*			cis	-174.6	-174.7	-20	-168.8	0	0	0	0	108.6
818	S	39.4	Very low	38.3	Very low	104 Å²	104	145.7 Å²	145.7	73%	0.727	71%	0.712	S	S	*	*			trans	72.4	150.6	164.1	84.7	0	0	0	0	118
819	D	38.7	Very low	38.4	Very low	146 Å²	146	149.6 Å²	149.6	78%	0.781	72%	0.719	S	S	*	*			cis	-165.2	174.6	-14.2	-128.3	-45.8	0	0	0	116.5
820	V	39.5	Very low	38.3	Very low	108 Å²	108	147.2 Å²	147.2	66%	0.655	72%	0.717	S	S	*	*			trans	71.6	98.1	144.2	167.8	0	0	0	0	123
821	H	41.1	Very low	38.4	Very low	156 Å²	156	150.8 Å²	150.8	72%	0.722	73%	0.726	S	S	*	*				92.8	153	117.3	-88.5	54.2	0	0	0	127.9
822	K	39	Very low	38.4	Very low	175 Å²	175	149.9 Å²	149.9	76%	0.761	72%	0.722	S	S	*	*			trans	75.6	113.6	159.5	-70.8	155.3	-174.4	172.8	0	117.1
823	R	37.9	Very low	38.3	Very low	215 Å²	215	147.5 Å²	147.5	81%	0.811	72%	0.721	S	S	*	*				69.9	131	75.7	-73.1	-178.6	178.2	-169.9	3.5	111.9
824	H	41.7	Very low	38.2	Very low	122 Å²	122	143.4 Å²	143.4	57%	0.565	72%	0.716	S	S	*	*			cis	-168.4	153.9	40.4	-120.5	-16.7	0	0	0	116
825	K	40.8	Very low	38.1	Very low	142 Å²	142	145.4 Å²	145.4	62%	0.617	72%	0.72	S	S	*	*			trans	59.5	113.8	139.5	-72.2	164.6	178	156.1	0	120.8
826	K	39.3	Very low	38	Very low	178 Å²	178	144.2 Å²	144.2	77%	0.774	72%	0.716	S	S	*	*				90.6	154.6	97.3	-78.6	-177.9	-179.3	-178	0	113.8
827	K	39.9	Very low	37.8	Very low	153 Å²	153	143.7 Å²	143.7	67%	0.665	71%	0.713	S	S	*	*			cis	-162	139.4	11.1	-135.6	-176.6	178.1	-176.4	0	112
828	H	43.7	Very low	37.6	Very low	140 Å²	140	143.2 Å²	143.2	65%	0.648	71%	0.709	S	S	*	*			trans	58.2	166.4	140	-71	-7.9	0	0	0	120.4
829	K	38.8	Very low	37.3	Very low	166 Å²	166	143 Å²	143	72%	0.722	71%	0.708	S	S	*	*			cis	-170	174.7	-16.1	-105	177.7	179	-175.8	0	106.3
830	S	35.8	Very low	37.1	Very low	83 Å²	83	143.7 Å²	143.7	58%	0.58	71%	0.706	S	S	*	*			cis	173.6	158.6	-38.7	61.7	0	0	0	0	109.2
831	R	35.8	Very low	37.1	Very low	223 Å²	223	147 Å²	147	84%	0.842	71%	0.714	S	S	*	*			trans	83.5	136.2	171.8	-59.8	176.1	166.8	178.2	-7.8	114.5
832	H	37.4	Very low	36.6	Very low	176 Å²	176	147.1 Å²	147.1	82%	0.815	72%	0.72	S	S	*	*			cis	71.4	136.9	44.7	-61.9	-67.5	0	0	0	112.6
833	S	34.1	Very low	36.4	Very low	89 Å²	89	143.7 Å²	143.7	62%	0.622	72%	0.718	S	S	*	*			cis	-176.6	153.9	-6.7	44.8	0	0	0	0	111.4
834	S	34.5	Very low	36	Very low	107 Å²	107	144.6 Å²	144.6	75%	0.748	72%	0.722	S	S	*	*			trans	68.4	164.4	155.7	86.4	0	0	0	0	115.7
835	K	33.5	Very low	35.6	Very low	166 Å²	166	146 Å²	146	72%	0.722	73%	0.733	S	S	*	*			cis	-166.8	148.9	-6.6	-133.9	174.4	179.3	-174.3	0	108.1
836	H	34.9	Very low	35.1	Very low	163 Å²	163	142.8 Å²	142.8	76%	0.755	74%	0.741	S	S	*	*			trans	62.2	162.8	164.8	-61.9	-61.7	0	0	0	115.8
837	S	33.3	Very low	35	Very low	96 Å²	96	139.2 Å²	139.2	67%	0.671	74%	0.738	S	S	*	*			cis	-157.3	157.9	-16	36.4	0	0	0	0	111.7
838	S	31.4	Very low	34.8	Very low	99 Å²	99	139 Å²	139	69%	0.692	74%	0.744	S	S	*	*			trans	53.7	125.5	141.8	63.6	0	0	0	0	122.4
839	S	32.3	Very low	34.7	Very low	99 Å²	99	138 Å²	138	69%	0.692	74%	0.744	S	S	*	*				120.4	160.6	121.6	83.7	0	0	0	0	118.3
840	H	35.4	Very low	34.7	Very low	161 Å²	161	135 Å²	135	75%	0.745	74%	0.735	S	S	*	*			trans	3.2	141.5	171.4	-44.7	-73.9	0	0	0	119.7
841	H	38.4	Very low	34.5	Very low	179 Å²	179	140.3 Å²	140.3	83%	0.829	74%	0.743	S	S	*	*				-158.6	173.1	55.3	-112.4	-87.4	0	0	0	114.8
842	N	31.5	Very low	34.8	Very low	157 Å²	157	136.8 Å²	136.8	84%	0.84	74%	0.735	S	S	*	*			trans	-95.2	138.4	170.9	-57.6	-41.7	0	0	0	112.2
843	S	34.1	Very low	34.8	Very low	103 Å²	103	135.2 Å²	135.2	72%	0.72	73%	0.728	S	S	*	*			trans	-172.4	135.9	140	-165.1	0	0	0	0	106.6
844	W	28.8	Very low	35	Very low	235 Å²	235	137.7 Å²	137.7	89%	0.89	73%	0.729	S	S	*	*			cis	70.2	138.8	44.9	-86	48.2	0	0	0	115
845	N	34.8	Very low	35.1	Very low	151 Å²	151	138.5 Å²	138.5	81%	0.807	73%	0.726	S	S	*	*			trans	71.3	141.6	-171.2	-53.1	-8.8	0	0	0	115.5
846	G	29.3	Very low	35.1	Very low	75 Å²	75	138.7 Å²	138.7	77%	0.773	73%	0.729	S	S	*	*			cis	133.3	89.6	-12.8	0	0	0	0	0	115
847	S	37.4	Very low	35.2	Very low	102 Å²	102	142.7 Å²	142.7	71%	0.713	74%	0.737	S	S	*	*			trans	-170.4	132.6	160.2	56.4	0	0	0	0	105.3
848	D	35.6	Very low	35.2	Very low	149 Å²	149	145.1 Å²	145.1	80%	0.797	74%	0.742	S	S	*	*				57.9	134.7	69.7	-52.9	-47.1	0	0	0	111.1
849	D	41	Very low	35.4	Very low	120 Å²	120	151.9 Å²	151.9	64%	0.642	75%	0.753	S	S	*	*			cis	-162.7	171	32	-157	-5.6	0	0	0	113
850	N	38.4	Very low	35.6	Very low	102 Å²	102	154.8 Å²	154.8	55%	0.545	76%	0.756	S	S	.	*			trans	58.5	158.1	152.8	-69.6	-43.3	0	0	0	121.7
851	R	33.4	Very low	35.7	Very low	195 Å²	195	154.9 Å²	154.9	74%	0.736	76%	0.761	S	S	*	*			cis	-175.7	176.7	-37.4	-112.6	-179.5	-149.2	178	7.5	106.4
852	H	40.8	Very low	35.5	Very low	149 Å²	149	152.8 Å²	152.8	69%	0.69	76%	0.755	S	S	*	*			trans	71.8	152.9	164.3	-49.5	-55.1	0	0	0	118.1
853	H	38.6	Very low	35.8	Very low	143 Å²	143	156.5 Å²	156.5	66%	0.662	76%	0.758	S	S	*	*			cis	-163	151.3	-40.4	-112.7	-30.9	0	0	0	111.6
854	H	37.4	Very low	35.9	Very low	140 Å²	140	156.4 Å²	156.4	65%	0.648	76%	0.757	S	S	*	*			trans	52.3	128	141.6	-79.4	-58.1	0	0	0	124.4
855	N	36.2	Very low	36.2	Very low	125 Å²	125	150.4 Å²	150.4	67%	0.668	75%	0.751	S	S	*	*				87.2	111.2	127.7	-64.3	-8.1	0	0	0	121.8
856	H	34.2	Very low	36.4	Very low	170 Å²	170	149 Å²	149	79%	0.787	75%	0.753	S	S	*	*				17.2	131	117.5	-71.3	-82.3	0	0	0	119
857	R	36.6	Very low	36.8	Very low	247 Å²	247	153.3 Å²	153.3	93%	0.932	76%	0.757	S	S	*	*				-165.6	152.6	103.2	-105.5	166.6	178.8	176.4	-0.6	113
858	N	33.2	Very low	37.1	Very low	146 Å²	146	154.7 Å²	154.7	78%	0.781	76%	0.764	S	S	*	*			trans	-79.2	157.5	169	-59.1	-7.9	0	0	0	110.4
859	R	37	Very low	37	Very low	242 Å²	242	159.3 Å²	159.3	91%	0.913	77%	0.77	S	S	*	*			trans	-164.9	144.1	134.4	-113.2	168.8	-178.2	173.2	-0.7	111.8
860	E	34.5	Very low	37.3	Very low	160 Å²	160	159.1 Å²	159.1	75%	0.748	78%	0.776	S	S	*	*			trans	-76.1	165.9	168.8	-50.3	99.1	131.9	0	0	111.8
861	L	38.3	Very low	37.3	Very low	163 Å²	163	159 Å²	159	85%	0.853	78%	0.783	S	S	*	*				-179.4	162.4	109.3	-93	165.7	0	0	0	112.4
862	D	35	Very low	37.5	Very low	134 Å²	134	154.2 Å²	154.2	72%	0.717	78%	0.779	S	S	*	*			trans	-74.7	163.3	-167.6	-52.5	-95.6	0	0	0	116.4
863	R	37	Very low	37.4	Very low	236 Å²	236	153 Å²	153	89%	0.891	78%	0.777	S	S	*	*				-170.4	118.7	116.1	-101.4	160.4	-175.5	-164.6	0.1	116.1
864	S	36	Very low	37.4	Very low	100 Å²	100	153.1 Å²	153.1	70%	0.699	78%	0.778	S	S	*	*				58.3	99.5	125.1	-53.4	0	0	0	0	122.1
865	S	35.4	Very low	37.6	Very low	109 Å²	109	153.8 Å²	153.8	76%	0.762	78%	0.781	S	S	*	*				44.1	125.8	120.3	64.3	0	0	0	0	122.4
866	S	38.3	Very low	37.8	Very low	121 Å²	121	155.3 Å²	155.3	85%	0.846	78%	0.784	S	S	*	*				-178.4	158.6	109.6	42.6	0	0	0	0	113.4
867	L	39	Very low	38	Very low	167 Å²	167	154 Å²	154	87%	0.874	78%	0.778	S	S	*	*			trans	-129.2	157	169.6	-76.8	172.5	0	0	0	108.8
868	P	43.8	Very low	38.1	Very low	131 Å²	131	148.3 Å²	148.3	85%	0.851	77%	0.766	S	S	*	*			trans	-132.2	-179.8	131.8	16.1	5.1	0	0	0	114.2
869	R	32.3	Very low	38.4	Very low	245 Å²	245	150 Å²	150	93%	0.925	77%	0.766	S	S	*	*			trans	-131.3	-175.2	-172.5	-112.9	-157.1	168	-158.9	-0.9	111
870	P	48.7	Very low	38.6	Very low	117 Å²	117	145.9 Å²	145.9	76%	0.76	76%	0.757	S	S	*	*			trans	-115.7	176.6	-149.4	44.6	-38.7	0	0	0	117.6
871	S	38.1	Very low	38.8	Very low	100 Å²	100	148.1 Å²	148.1	70%	0.699	76%	0.759	S	S	*	*			trans	-144.8	131.1	160.9	51.1	0	0	0	0	107.2
872	S	37.7	Very low	38.6	Very low	94 Å²	94	150.2 Å²	150.2	66%	0.657	76%	0.755	S	S	*	*				54	131.3	83	85.7	0	0	0	0	112.6
873	D	37.9	Very low	38.7	Very low	122 Å²	122	155.5 Å²	155.5	65%	0.652	77%	0.765	S	S	*	*			cis	-164	163.3	45.9	-97	-61.8	0	0	0	117.2
874	H	39.8	Very low	38.7	Very low	147 Å²	147	152 Å²	152	68%	0.681	76%	0.758	S	S	*	*			trans	55.5	129.8	145.2	-73.5	64.5	0	0	0	125
875	H	40.1	Very low	39	Very low	154 Å²	154	156.1 Å²	156.1	71%	0.713	77%	0.767	S	S	*	*			trans	41.1	154.3	140.4	-58.8	-12.3	0	0	0	122.4
876	H	40.5	Very low	39.2	Very low	157 Å²	157	158.1 Å²	158.1	73%	0.727	76%	0.763	S	S	*	*			cis	-160.4	167.5	24.2	-138.9	13.9	0	0	0	114.2
877	H	39.4	Very low	39.2	Very low	143 Å²	143	162.4 Å²	162.4	66%	0.662	77%	0.767	S	S	*	*			trans	11.6	137.1	163.6	-88.8	-72.6	0	0	0	126.5
878	D	37.8	Very low	39	Very low	126 Å²	126	161.9 Å²	161.9	67%	0.674	76%	0.758	S	S	*	*			trans	45.3	124.7	134.3	-89.9	-73.3	0	0	0	123.8
879	K	40.3	Very low	38.6	Very low	182 Å²	182	166.8 Å²	166.8	79%	0.791	76%	0.761	S	S	*	*				-174.1	145.3	104.3	-99.8	157.2	-173.5	167.2	0	116.2
880	H	40.8	Very low	38.7	Very low	156 Å²	156	164.3 Å²	164.3	72%	0.722	75%	0.751	S	S	*	*			trans	50	106.1	153.5	-67.4	-65.7	0	0	0	123.5
881	R	38.2	Very low	38	Very low	206 Å²	206	167.8 Å²	167.8	78%	0.777	76%	0.758	S	S	*	*				27.4	127	119.7	-81.7	-176.7	169	-179.4	-1.5	120.3
882	R	34.6	Very low	37.8	Very low	208 Å²	208	170 Å²	170	79%	0.785	76%	0.761	S	S	*	*			trans	55.4	105.4	136.9	-62.9	-179.4	176	177.1	-3	118.7
883	R	37.3	Very low	37.7	Very low	245 Å²	245	170.8 Å²	170.8	93%	0.925	77%	0.767	S	S	*	*			trans	-134.7	134.1	135	-76.2	-167.5	173.2	-179.4	-1.8	110.7
884	H	37.8	Very low	37.7	Very low	161 Å²	161	175 Å²	175	75%	0.745	77%	0.773	S	S	*	*			trans	-74.3	143.9	170.8	-75.2	-115.6	0	0	0	109.8
885	H	41.3	Very low	37.5	Very low	188 Å²	188	174.2 Å²	174.2	87%	0.87	78%	0.775	S	S	*	*			trans	-125.7	94	156.2	-103.7	-79	0	0	0	110.7	K887	H885-K887 PolarHBondContact O-N 2.86Å
886	H	38.9	Very low	37.4	Very low	150 Å²	150	171.5 Å²	171.5	69%	0.694	77%	0.773	S	S	*	*			trans	-62.7	117.9	161.1	-87	-88.3	0	0	0	109.1	K888	H886-K888 HydrophobicContact CB-CG 4.28Å; H886-K888 PolarHBondContact O-N 3.36Å
887	K	39.5	Very low	37.2	Very low	211 Å²	211	172.7 Å²	172.7	92%	0.917	78%	0.776	S	S	*	*			trans	-81.7	91.5	150.2	-93.6	-175.7	172.4	178.1	0	108.3	H885 Y889	H885-K887 PolarHBondContact O-N 2.86Å; K887-Y889 PolarHBondContact O-N 3.3Å
888	K	35.2	Very low	36.9	Very low	157 Å²	157	171.6 Å²	171.6	68%	0.683	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-66.2	118.3	166.3	-67.3	179.3	178	178	0	108.2	H886	H886-K888 HydrophobicContact CB-CG 4.28Å; H886-K888 PolarHBondContact O-N 3.36Å
889	Y	34.4	Very low	36.8	Very low	234 Å²	234	175 Å²	175	92%	0.918	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-83.1	118.7	138.9	-98.5	-85.6	0	0	0	106.1	K887	K887-Y889 PolarHBondContact O-N 3.3Å
890	R	34.8	Very low	36.5	Very low	193 Å²	193	176.8 Å²	176.8	73%	0.728	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-73.1	138.6	173.7	-99.3	-179.3	163.5	144.6	-8.8	108.7
891	Q	33.3	Very low	36.2	Very low	190 Å²	190	178.2 Å²	178.2	89%	0.888	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-70.3	131.9	147.2	-65	155.5	-78	0	0	106.5
892	D	34.3	Very low	36	Very low	146 Å²	146	176.1 Å²	176.1	78%	0.781	79%	0.791	S	S	*	*			trans	-117.8	153.3	159.5	-80	-56.1	0	0	0	108.5
893	S	35.2	Very low	35.9	Very low	110 Å²	110	169.9 Å²	169.9	77%	0.769	78%	0.78	S	S	*	*			trans	-96.4	143.3	-153.5	-172	0	0	0	0	114.3
894	R	37.8	Very low	35.8	Very low	210 Å²	210	164.8 Å²	164.8	79%	0.792	77%	0.766	S	S	*	*				-11.7	148.8	126.6	-76.2	-179	-171.7	-169.7	4.7	114.8
895	D	36.6	Very low	35.6	Very low	132 Å²	132	165.4 Å²	165.4	71%	0.706	77%	0.769	S	S	*	*			cis	-168.5	167.4	16.9	-115.4	-25.3	0	0	0	110.8
896	S	37.5	Very low	35.3	Very low	97 Å²	97	164.6 Å²	164.6	68%	0.678	76%	0.763	S	S	*	*			trans	51.9	127.1	143.5	-160.6	0	0	0	0	121.3
897	K	35.3	Very low	35.2	Very low	182 Å²	182	163.9 Å²	163.9	79%	0.791	76%	0.76	S	S	*	*				-163.3	140.8	103.2	-104.9	178.2	-179.8	177.8	0	115.5
898	D	34.8	Very low	34.8	Very low	119 Å²	119	164.3 Å²	164.3	64%	0.636	76%	0.757	S	S	*	*			trans	38.9	102.9	142.8	-52	-30.8	0	0	0	119.5
899	H	35.8	Very low	34.8	Very low	197 Å²	197	162.3 Å²	162.3	91%	0.912	75%	0.748	S	S	*	*				-132.2	123.7	121.8	-98.5	-72.4	0	0	0	111.2
900	R	33.5	Very low	34.7	Very low	221 Å²	221	160 Å²	160	83%	0.834	75%	0.746	S	S	*	*			trans	-53.2	143.2	172.2	-58.1	163	176.7	165.6	-4	110.4
901	F	34.3	Very low	34.5	Very low	186 Å²	186	155.4 Å²	155.4	82%	0.816	74%	0.743	S	S	*	*				-164.1	140.8	109.7	-108.9	-80.2	0	0	0	111.8
902	H	34.6	Very low	34.7	Very low	162 Å²	162	155.3 Å²	155.3	75%	0.75	74%	0.743	S	S	*	*			trans	-16	157.7	154.5	-59.8	87.8	0	0	0	117.9
903	S	32.1	Very low	34.8	Very low	77 Å²	77	153 Å²	153	54%	0.538	74%	0.737	S	S	.	*			cis	179.4	170.7	-9.2	174.8	0	0	0	0	107.1
904	H	34.3	Very low	35	Very low	138 Å²	138	155.5 Å²	155.5	64%	0.639	74%	0.737	S	S	*	*			trans	69.2	138.1	173.5	-52.7	-64.1	0	0	0	115.8
905	H	34.4	Very low	34.8	Very low	173 Å²	173	152.1 Å²	152.1	80%	0.801	73%	0.73	S	S	*	*			cis	58.5	79.4	-2.2	-115.9	-64.5	0	0	0	117.5
906	K	35.6	Very low	34.8	Very low	172 Å²	172	152.8 Å²	152.8	75%	0.748	73%	0.733	S	S	*	*			trans	-154.8	117.9	149.7	-101.9	166.9	-178	179.8	0	104.2
907	H	35.6	Very low	34.8	Very low	135 Å²	135	151.8 Å²	151.8	63%	0.625	74%	0.739	S	S	*	*				37.6	104.9	73	-86.9	-83.1	0	0	0	112.6
908	Y	31.8	Very low	34.9	Very low	219 Å²	219	154.7 Å²	154.7	86%	0.859	75%	0.746	S	S	*	*				-157.5	148.7	107.1	-127.9	-117.4	0	0	0	111.9
909	K	34.2	Very low	35.1	Very low	115 Å²	115	164 Å²	164	50%	0.5	77%	0.773	S	S	.	*	P	Polyproline II helix	trans	-78.5	168.6	158.7	-150.6	178.3	-176.1	175	0	107.7	T613	T613-K909 WeakPolarHBondContact O-CE 3.44Å; T613-K909 PolarHBondContact O-NZ 3.27Å; T613-K909 WeakPolarHBondContact OG1-CB 3.47Å; T613-K909 WeakPolarHBondContact OG1-CD 3.42Å; T613-K909 VanDerWaalsContact OG1-CG 3.29Å; T613-K909 WeakPolarHBondContact OG1-CG 3.37Å
910	Q	33.4	Very low	35.1	Very low	186 Å²	186	162.4 Å²	162.4	87%	0.869	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-61.5	144	179.9	-75.4	162.4	-55.3	0	0	112.9
911	S	30.2	Very low	35.2	Very low	97 Å²	97	159.3 Å²	159.3	68%	0.678	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-54.3	139.8	168.6	49.8	0	0	0	0	113.2
912	H	37.1	Very low	35.2	Very low	188 Å²	188	157.8 Å²	157.8	87%	0.87	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-96.5	162.9	130.7	-96.1	-52.6	0	0	0	109.2
913	S	37.3	Very low	35.2	Very low	96 Å²	96	157.5 Å²	157.5	67%	0.671	76%	0.76	S	S	*	*	S	Bend	trans	54.5	108.7	176.2	57.2	0	0	0	0	118.2
914	H	38	Very low	35.4	Very low	163 Å²	163	162.6 Å²	162.6	76%	0.755	77%	0.774	S	S	*	*			trans	63.6	139.8	148.7	-65.9	-108.8	0	0	0	118.1
915	E	34.5	Very low	35.5	Very low	140 Å²	140	164.2 Å²	164.2	65%	0.654	78%	0.783	S	S	*	*			cis	-163.6	155.6	-7.6	-131	179.4	105	0	0	110.4
916	N	35.8	Very low	35.6	Very low	145 Å²	145	163.6 Å²	163.6	78%	0.775	78%	0.781	S	S	*	*			trans	59.1	148.2	157.1	-56.6	-39.5	0	0	0	121.5
917	G	37.4	Very low	35.6	Very low	77 Å²	77	162.9 Å²	162.9	79%	0.794	78%	0.784	S	S	*	*			trans	129.5	80	153.4	0	0	0	0	0	118.1
918	Y	39.2	Very low	35.6	Very low	242 Å²	242	165.3 Å²	165.3	95%	0.949	80%	0.797	S	S	*	*			trans	-59.6	131.8	168.1	-75.8	-110.6	0	0	0	113
919	R	38.3	Very low	35.9	Very low	315 Å²	315	160.4 Å²	160.4	100%	1.189	79%	0.791	S	S	*	*				-165.4	0	106.3	-137.8	178.8	-171.4	-179.1	4.2	114.1

Retrieved 919 of 919 residues in 405.2 ms (Link to these results)

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