A0A077YZS8_TRITR Loading...

protein-tyrosine-phosphatase

AlphaFold DB , UniProt , Accession A0A077YZS8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 779 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43.9	Very low	45.3	Very low	194 Å²	194	126.2 Å²	126.2	96%	0.956	65%	0.654	S	S	*	*				0	-49.3	0	-67.1	-58.6	-109.5	0	0	112.6	L4 V5	M1-L4 PolarHBondContact O-N 3.42Å; M1-V5 PolarHBondContact O-N 2.89Å
2	L	41.7	Very low	44.5	Very low	139 Å²	139	125.3 Å²	125.3	73%	0.728	65%	0.65	S	S	*	*	H	α-helix	trans	-56.5	-40.3	-178.9	-136.9	81.4	0	0	0	116	L4 V5 I6	L2-L4 VanDerWaalsContact C-N 3.32Å; L2-L4 PolarHBondContact O-N 2.94Å; L2-V5 PolarHBondContact O-N 3.11Å; L2-I6 WeakPolarHBondContact O-CG1 3.3Å; L2-I6 PolarHBondContact O-N 3.13Å
3	P	48.8	Very low	43.3	Very low	91 Å²	91	121.3 Å²	121.3	59%	0.591	66%	0.659	S	S	*	*	H	α-helix	trans	-68.1	-30.3	179.8	-19.4	31.5	0	0	0	113.6	I6 L7	P3-I6 PolarHBondContact O-N 3.44Å; P3-L7 PolarHBondContact O-N 3.44Å
4	L	50.5	Low	42.4	Very low	118 Å²	118	122.2 Å²	122.2	62%	0.618	66%	0.662	S	S	*	*	H	α-helix	trans	-71.8	-35.1	178.6	-109.8	129.6	0	0	0	111.7	M1 L2 I6 L7 L8	M1-L4 PolarHBondContact O-N 3.42Å; L2-L4 VanDerWaalsContact C-N 3.32Å; L2-L4 PolarHBondContact O-N 2.94Å; L4-I6 VanDerWaalsContact C-N 3.33Å; L4-L7 PolarHBondContact O-N 3.33Å; L4-L8 WeakPolarHBondContact O-CB 3.5Å; L4-L8 WeakPolarHBondContact O-CD1 3.23Å; L4-L8 WeakPolarHBondContact O-CG 3.48Å; L4-L8 PolarHBondContact O-N 3.48Å
5	V	53.7	Low	41.6	Very low	83 Å²	83	123.3 Å²	123.3	50%	0.503	67%	0.674	S	S	.	*	H	α-helix	trans	-66.9	-37.1	174.5	179	0	0	0	0	110.7	M1 L2 L8 C9	M1-V5 PolarHBondContact O-N 2.89Å; L2-V5 PolarHBondContact O-N 3.11Å; V5-L8 PolarHBondContact O-N 2.97Å; V5-C9 WeakPolarHBondContact O-CB 3.03Å; V5-C9 PolarHBondContact O-N 2.75Å; V5-C9 PolarHBondContact O-SG 3.15Å
6	I	51.8	Low	40.8	Very low	103 Å²	103	126.8 Å²	126.8	53%	0.528	68%	0.681	S	S	.	*	H	α-helix	trans	-67.1	-40	177.6	-63.8	167.7	0	0	0	111.1	L2 P3 L4 C9 W10	L2-I6 WeakPolarHBondContact O-CG1 3.3Å; L2-I6 PolarHBondContact O-N 3.13Å; P3-I6 PolarHBondContact O-N 3.44Å; L4-I6 VanDerWaalsContact C-N 3.33Å; I6-C9 PolarHBondContact O-N 2.85Å; I6-W10 PolarHBondContact O-N 2.73Å
7	L	50.6	Low	40	Very low	110 Å²	110	124.9 Å²	124.9	58%	0.576	69%	0.687	S	S	*	*	H	α-helix	trans	-68	-36.5	174.6	-91.9	152.3	0	0	0	113.1	P3 L4 W10 N11	P3-L7 PolarHBondContact O-N 3.44Å; L4-L7 PolarHBondContact O-N 3.33Å; L7-W10 PolarHBondContact O-N 3.06Å; L7-N11 PolarHBondContact O-N 3.27Å
8	L	41.9	Very low	39.2	Very low	106 Å²	106	127.1 Å²	127.1	56%	0.555	70%	0.695	S	S	*	*	H	α-helix	trans	-66	-39.3	174	-82.7	157.5	0	0	0	111.8	L4 V5 W10 N11 L12	L4-L8 WeakPolarHBondContact O-CB 3.5Å; L4-L8 WeakPolarHBondContact O-CD1 3.23Å; L4-L8 WeakPolarHBondContact O-CG 3.48Å; L4-L8 PolarHBondContact O-N 3.48Å; V5-L8 PolarHBondContact O-N 2.97Å; L8-W10 VanDerWaalsContact C-N 3.3Å; L8-W10 PolarHBondContact O-N 3.01Å; L8-N11 PolarHBondContact O-N 3.04Å; L8-L12 PolarHBondContact O-N 2.79Å
9	C	39.1	Very low	38.5	Very low	80 Å²	80	130.6 Å²	130.6	54%	0.541	70%	0.703	S	S	.	*	H	α-helix	trans	-70.4	-22.9	174.4	-69.7	0	0	0	0	113.4	V5 I6	V5-C9 WeakPolarHBondContact O-CB 3.03Å; V5-C9 PolarHBondContact O-N 2.75Å; V5-C9 PolarHBondContact O-SG 3.15Å; I6-C9 PolarHBondContact O-N 2.85Å
10	W	39.2	Very low	37.8	Very low	220 Å²	220	133.1 Å²	133.1	83%	0.833	71%	0.707	S	S	*	*	H	α-helix	trans	-76.2	-33.3	174.7	-108.8	29.3	0	0	0	113.4	I6 L7 L8	I6-W10 PolarHBondContact O-N 2.73Å; L7-W10 PolarHBondContact O-N 3.06Å; L8-W10 VanDerWaalsContact C-N 3.3Å; L8-W10 PolarHBondContact O-N 3.01Å
11	N	37.6	Very low	37.2	Very low	144 Å²	144	132.4 Å²	132.4	77%	0.77	71%	0.708	S	S	*	*	H	α-helix	trans	-80.7	-23.5	176.9	-84.5	-32.7	0	0	0	113.5	L7 L8 G13	L7-N11 PolarHBondContact O-N 3.27Å; L8-N11 PolarHBondContact O-N 3.04Å; N11-G13 PolarHBondContact O-N 2.91Å
12	L	34.7	Very low	36.3	Very low	115 Å²	115	129.9 Å²	129.9	60%	0.602	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	87.4	169.6	-72.5	161.2	0	0	0	107.6	L8 L14	L8-L12 PolarHBondContact O-N 2.79Å; L12-L14 PolarHBondContact O-N 3.48Å
13	G	29.3	Very low	35.5	Very low	74 Å²	74	134.3 Å²	134.3	76%	0.763	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.8	63.6	-173.1	0	0	0	0	0	117.1	N11	N11-G13 PolarHBondContact O-N 2.91Å
14	L	30.7	Very low	34.4	Very low	134 Å²	134	135.4 Å²	135.4	70%	0.702	72%	0.715	S	S	*	*			trans	-102.6	77	173	-88.5	131	0	0	0	107.9	L12 F16	L12-L14 PolarHBondContact O-N 3.48Å; L14-F16 PolarHBondContact O-N 3.33Å
15	T	29.8	Very low	33.1	Very low	138 Å²	138	137.4 Å²	137.4	85%	0.847	73%	0.726	S	S	*	*			trans	-69.7	95.6	169.8	47.1	0	0	0	0	109.4	A17	T15-A17 PolarHBondContact O-N 3.37Å
16	F	29.1	Very low	31.8	Very low	180 Å²	180	138.5 Å²	138.5	79%	0.789	74%	0.735	S	S	*	*			trans	-73.2	102.1	162.3	-94.4	-87	0	0	0	108.8	L14 I18	L14-F16 PolarHBondContact O-N 3.33Å; F16-I18 PolarHBondContact O-N 3.29Å; F16-I18 VanDerWaalsContact O-N 3.1Å
17	A	27.5	Very low	30.3	Very low	94 Å²	94	140 Å²	140	78%	0.777	75%	0.748	S	S	*	*			trans	-72.3	96.8	174.5	0	0	0	0	0	110.2	T15 K19	T15-A17 PolarHBondContact O-N 3.37Å; A17-K19 PolarHBondContact O-N 2.95Å; A17-K19 VanDerWaalsContact O-N 3.08Å
18	I	26.1	Very low	29	Very low	164 Å²	164	144.3 Å²	144.3	84%	0.841	76%	0.763	S	S	*	*			trans	-74.8	94.4	167.5	-61.2	173.4	0	0	0	107.3	F16 K20	F16-I18 PolarHBondContact O-N 3.29Å; F16-I18 VanDerWaalsContact O-N 3.1Å; I18-K20 PolarHBondContact O-N 3.23Å
19	K	25.4	Very low	28.1	Very low	194 Å²	194	146.5 Å²	146.5	84%	0.843	77%	0.77	S	S	*	*			trans	-79.9	98.8	178.2	-155.5	174.8	-173.7	179.6	0	109.3	A17 V21	A17-K19 PolarHBondContact O-N 2.95Å; A17-K19 VanDerWaalsContact O-N 3.08Å; K19-V21 PolarHBondContact O-N 3.19Å
20	K	24.3	Very low	27.3	Very low	180 Å²	180	149.7 Å²	149.7	78%	0.783	78%	0.777	S	S	*	*			trans	-61.1	112.6	173.3	-159.4	175.2	-174.7	179.5	0	109.5	I18 N22	I18-K20 PolarHBondContact O-N 3.23Å; K20-N22 PolarHBondContact O-N 2.96Å
21	V	26.5	Very low	26.5	Very low	120 Å²	120	144.9 Å²	144.9	73%	0.727	77%	0.768	S	S	*	*			trans	-83.1	91.9	175.6	178.2	0	0	0	0	108.3	K19 R23	K19-V21 PolarHBondContact O-N 3.19Å; V21-R23 HydrophobicContact CG1-CG 4.19Å
22	N	23.6	Very low	25.8	Very low	141 Å²	141	146 Å²	146	75%	0.754	77%	0.768	S	S	*	*			trans	-79.6	110.1	161.1	-96.5	2.8	0	0	0	107.7	K20	K20-N22 PolarHBondContact O-N 2.96Å
23	R	25.6	Very low	25.3	Very low	232 Å²	232	149.3 Å²	149.3	88%	0.875	78%	0.783	S	S	*	*			trans	-97.3	92.1	162.3	-84.5	-175.7	175.4	-178	-1.4	108.1	V21	V21-R23 HydrophobicContact CG1-CG 4.19Å
24	S	24.8	Very low	25	Very low	113 Å²	113	150.4 Å²	150.4	79%	0.79	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-74.2	117.8	159.8	46.5	0	0	0	0	108.4
25	L	24.7	Very low	24.8	Very low	160 Å²	160	152.1 Å²	152.1	84%	0.838	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-67.3	137.5	168.3	-83.8	137.5	0	0	0	109.8	V27	L25-V27 PolarHBondContact O-N 3.37Å
26	P	25.6	Very low	24.6	Very low	107 Å²	107	150.8 Å²	150.8	70%	0.695	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-78	120.7	176.9	30.1	-30	0	0	0	110.2
27	V	20.3	Very low	24.3	Very low	133 Å²	133	151.6 Å²	151.6	81%	0.806	79%	0.794	S	S	*	*			trans	-86	110.4	163.9	175.5	0	0	0	0	106.2	L25	L25-V27 PolarHBondContact O-N 3.37Å
28	F	23.9	Very low	24.2	Very low	201 Å²	201	156.1 Å²	156.1	88%	0.882	80%	0.799	S	S	*	*			trans	-102	126.4	164.8	-100.8	-83.3	0	0	0	109.3
29	Q	21.4	Very low	23.9	Very low	153 Å²	153	156.3 Å²	156.3	72%	0.715	80%	0.801	S	S	*	*			trans	-80.1	153.3	-179.7	-87.7	174.6	-71.1	0	0	112.9
30	Q	23.1	Very low	23.7	Very low	146 Å²	146	152.3 Å²	152.3	68%	0.682	80%	0.797	S	S	*	*			trans	75.5	110.6	139.8	-79.7	-172.6	-76.1	0	0	121.5
31	D	22.6	Very low	23.7	Very low	120 Å²	120	151.6 Å²	151.6	64%	0.642	80%	0.801	S	S	*	*				83.8	130.7	112.1	-70.3	-15	0	0	0	122.2
32	Q	23.3	Very low	23.5	Very low	168 Å²	168	156.5 Å²	156.5	79%	0.785	81%	0.808	S	S	*	*			trans	81.8	101.6	148.1	-72.9	179	15.2	0	0	119.6
33	M	24.6	Very low	23.5	Very low	183 Å²	183	157.6 Å²	157.6	90%	0.901	81%	0.808	S	S	*	*				179.3	135.7	88.6	-102.9	-177.9	179	0	0	110.5
34	A	22.5	Very low	23.5	Very low	98 Å²	98	149.7 Å²	149.7	81%	0.81	79%	0.788	S	S	*	*			trans	-90.3	143.3	-176	0	0	0	0	0	112.9
35	L	25.8	Very low	23.7	Very low	170 Å²	170	151.6 Å²	151.6	89%	0.89	79%	0.79	S	S	*	*			trans	-160	153.3	157.9	-97.3	146.6	0	0	0	107.3
36	P	25.3	Very low	24.1	Very low	109 Å²	109	145.9 Å²	145.9	71%	0.708	77%	0.77	S	S	*	*				-99.3	157.4	-123.3	30.5	-20.2	0	0	0	115.3	Q38	P36-Q38 PolarHBondContact O-N 3.23Å
37	E	23.1	Very low	24.6	Very low	198 Å²	198	148.9 Å²	148.9	93%	0.925	77%	0.774	S	S	*	*			trans	-15.4	97.7	169.6	-69.8	173.5	145.9	0	0	115.9
38	Q	24.8	Very low	25.8	Very low	189 Å²	189	144.8 Å²	144.8	88%	0.883	75%	0.748	S	S	*	*			trans	-89.6	127.7	153.8	-91.5	-174.8	-38.2	0	0	108.7	P36 S40	P36-Q38 PolarHBondContact O-N 3.23Å; Q38-S40 PolarHBondContact O-N 2.89Å
39	L	21.4	Very low	26.5	Very low	168 Å²	168	136.5 Å²	136.5	88%	0.88	71%	0.712	S	S	*	*			trans	-40.9	122.9	179.3	-79.5	90.8	0	0	0	111.7	L41	L39-L41 PolarHBondContact O-N 3.07Å
40	S	21.2	Very low	27.4	Very low	109 Å²	109	132.3 Å²	132.3	76%	0.762	70%	0.695	S	S	*	*			trans	-58.1	104.4	167.4	38.7	0	0	0	0	109.7	Q38 Y42	Q38-S40 PolarHBondContact O-N 2.89Å; S40-Y42 PolarHBondContact O-N 3.33Å; S40-Y42 VanDerWaalsContact O-N 3.16Å
41	L	23.2	Very low	28.4	Very low	165 Å²	165	127.8 Å²	127.8	86%	0.864	67%	0.673	S	S	*	*			trans	-54.5	116.7	151.9	-81.5	151.3	0	0	0	106.3	L39 E43	L39-L41 PolarHBondContact O-N 3.07Å; L41-E43 PolarHBondContact O-N 2.91Å
42	Y	22.5	Very low	29.3	Very low	224 Å²	224	125.7 Å²	125.7	88%	0.878	66%	0.66	S	S	*	*			trans	-51.2	107.1	165.6	-101.9	-104.4	0	0	0	107.7	S40 S44	S40-Y42 PolarHBondContact O-N 3.33Å; S40-Y42 VanDerWaalsContact O-N 3.16Å; Y42-S44 PolarHBondContact O-N 3.36Å
43	E	23.7	Very low	30.4	Very low	164 Å²	164	122.2 Å²	122.2	77%	0.766	64%	0.639	S	S	*	*			trans	-63.7	86.3	157.4	-84.5	-177.6	161.4	0	0	106.6	L41 N45	L41-E43 PolarHBondContact O-N 2.91Å; E43-N45 PolarHBondContact O-N 3.48Å
44	S	25.9	Very low	31.4	Very low	65 Å²	65	119.3 Å²	119.3	46%	0.455	62%	0.623	S	S	.	*			trans	-66.2	95	156.4	-174.4	0	0	0	0	105.9	Y42 G46 Q67	Y42-S44 PolarHBondContact O-N 3.36Å; S44-G46 PolarHBondContact O-N 2.91Å; S44-Q67 PolarHBondContact OG-OE1 2.99Å
45	N	29	Very low	32.5	Very low	154 Å²	154	116.4 Å²	116.4	82%	0.824	60%	0.597	S	S	*	*			trans	-65.7	45.4	169.1	-86.8	-38.8	0	0	0	111.7	E43	E43-N45 PolarHBondContact O-N 3.48Å
46	G	32.2	Very low	33.5	Very low	40 Å²	40	110.6 Å²	110.6	41%	0.412	57%	0.565	S	S	.	*	S	Bend	trans	-128.2	112.1	179.8	0	0	0	0	0	109.9	S44 L48	S44-G46 PolarHBondContact O-N 2.91Å; G46-L48 PolarHBondContact O-N 2.66Å
47	Q	36.2	Very low	34.7	Very low	169 Å²	169	109.6 Å²	109.6	79%	0.79	55%	0.554	S	S	*	*			trans	-50.1	103.4	175.5	-71.9	174.2	-25.2	0	0	110.8	L49	Q47-L49 PolarHBondContact O-N 3.49Å
48	L	46.5	Very low	35.5	Very low	48 Å²	48	103.4 Å²	103.4	25%	0.251	52%	0.523	S	S	.	.	S	Bend	trans	-64	-25	177	-108.9	121	0	0	0	112.5	G46 W63 D64 Q67 I68	G46-L48 PolarHBondContact O-N 2.66Å; L48-W63 VanDerWaalsContact O-CA 3.23Å; L48-W63 WeakPolarHBondContact O-CA 3.4Å; L48-W63 WeakPolarHBondContact O-CB 3.29Å; L48-D64 PolarHBondContact O-N 3.02Å; L48-Q67 HydrophobicContact CD1-CB 4.42Å; L48-Q67 HydrophobicContact CD2-CB 4.4Å; L48-Q67 HydrophobicContact CG-CB 4.16Å; L48-I68 HydrophobicContact CD2-CB 4.13Å; L48-I68 HydrophobicContact CD2-CD1 4.3Å; L48-I68 HydrophobicContact CD2-CG1 3.2Å
49	L	37.1	Very low	36.4	Very low	26 Å²	26	95.5 Å²	95.5	14%	0.136	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	122.4	179.1	-71.8	152.1	0	0	0	109.3	Q47 F51 V61 S62 W63 I140 T153	Q47-L49 PolarHBondContact O-N 3.49Å; L49-F51 HydrophobicContact CB-CD2 4.29Å; L49-F51 HydrophobicContact CB-CE2 3.74Å; L49-V61 HydrophobicContact CD2-CG1 3.87Å; L49-S62 CarbonylContact C-O 3.54Å; L49-S62 WeakPolarHBondContact CA-O 3.48Å; L49-W63 HydrophobicContact CD2-CB 3.69Å; L49-W63 HydrophobicContact CD2-CD2 4.23Å; L49-W63 HydrophobicContact CD2-CE3 3.91Å; L49-W63 HydrophobicContact CD2-CG 4.19Å; L49-W63 HydrophobicContact CG-CB 4.24Å; L49-I140 HydrophobicContact CD1-CD1 4.39Å; L49-I140 HydrophobicContact CD2-CD1 3.61Å; L49-T153 HydrophobicContact CD1-CG2 3.87Å
50	N	41.1	Very low	37.3	Very low	66 Å²	66	90.5 Å²	90.5	35%	0.353	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	120.8	172.8	176.2	41.2	0	0	0	109.9	S62	N50-S62 WeakPolarHBondContact CB-OG 3.29Å; N50-S62 PolarHBondContact N-O 3.32Å; N50-S62 PolarHBondContact ND2-OG 3.43Å; N50-S62 PolarHBondContact O-N 3Å; N50-S62 PolarHBondContact O-OG 3.46Å
51	F	44.2	Very low	38.5	Very low	50 Å²	50	85.8 Å²	85.8	22%	0.219	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	122.1	179	-74.9	-106.5	0	0	0	110.1	L49 K60 V61 I155	L49-F51 HydrophobicContact CB-CD2 4.29Å; L49-F51 HydrophobicContact CB-CE2 3.74Å; F51-K60 CarbonylContact C-O 3.54Å; F51-K60 WeakPolarHBondContact CA-O 3.31Å; F51-V61 HydrophobicContact CD1-CB 4.18Å; F51-V61 HydrophobicContact CD1-CG1 4.03Å; F51-V61 HydrophobicContact CD1-CG2 3.51Å; F51-V61 HydrophobicContact CD2-CG1 4.14Å; F51-V61 HydrophobicContact CE1-CB 3.93Å; F51-V61 HydrophobicContact CE1-CG1 3.56Å; F51-V61 HydrophobicContact CE1-CG2 3.19Å; F51-V61 HydrophobicContact CE2-CG1 3.65Å; F51-V61 HydrophobicContact CG-CG1 4.3Å; F51-V61 HydrophobicContact CG-CG2 4.44Å; F51-V61 HydrophobicContact CZ-CB 4.21Å; F51-V61 HydrophobicContact CZ-CG1 3.32Å; F51-V61 HydrophobicContact CZ-CG2 3.9Å; F51-I155 HydrophobicContact CD2-CD1 3.64Å; F51-I155 HydrophobicContact CE1-CG2 4.38Å; F51-I155 HydrophobicContact CE2-CB 4.45Å; F51-I155 HydrophobicContact CE2-CD1 3.26Å; F51-I155 HydrophobicContact CE2-CG1 4.32Å; F51-I155 HydrophobicContact CE2-CG2 3.69Å; F51-I155 HydrophobicContact CZ-CD1 3.91Å; F51-I155 HydrophobicContact CZ-CG2 3.37Å
52	E	41.5	Very low	39.3	Very low	77 Å²	77	79.2 Å²	79.2	36%	0.36	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	125.8	174.6	-70.6	175.7	176.4	0	0	109.6	K60	E52-K60 HydrophobicContact CB-CB 4.29Å; E52-K60 HydrophobicContact CB-CD 4.41Å; E52-K60 PolarHBondContact N-O 3.26Å; E52-K60 WeakPolarHBondContact O-CA 3.19Å; E52-K60 WeakPolarHBondContact O-CB 3.3Å; E52-K60 PolarHBondContact O-N 3.01Å; E52-K60 IonicContact OE2-NZ 2.93Å; E52-K60 PolarHBondContact OE2-NZ 2.74Å
53	R	46.3	Very low	40.6	Very low	95 Å²	95	69.7 Å²	69.7	36%	0.358	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	136.5	177.5	175.5	-179.4	166.1	174.8	-5.3	110.2	R242 E244	R53-R242 PolarHBondContact NH1-O 3.38Å; R53-R242 PolarHBondContact NH2-O 2.84Å; R53-E244 IonicContact CZ-OE1 3.53Å; R53-E244 IonicContact NE-OE1 3.46Å; R53-E244 IonicContact NH2-OE1 3.56Å; R53-E244 PolarHBondContact NH2-OE1 3.42Å
54	H	45.1	Very low	41.6	Very low	122 Å²	122	65.9 Å²	65.9	57%	0.565	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.5	-32.2	165.9	-68.8	-125.7	0	0	0	115	Y58	H54-Y58 HydrophobicContact CB-CD1 3.34Å; H54-Y58 HydrophobicContact CB-CE1 3.61Å; H54-Y58 HydrophobicContact CB-CG 4.29Å; H54-Y58 AromaticContact CD2-CD1 3.95Å; H54-Y58 AromaticContact CD2-CE1 3.35Å; H54-Y58 WeakPolarHBondContact CD2-CE1 3.21Å; H54-Y58 AromaticContact CG-CD1 3.8Å; H54-Y58 AromaticContact CG-CE1 3.49Å; H54-Y58 VanDerWaalsContact CG-CE1 3.49Å; H54-Y58 PolarHBondContact N-O 3.38Å
55	S	47	Very low	42.1	Very low	37 Å²	37	67.7 Å²	67.7	26%	0.259	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	-178.3	179.3	62.4	0	0	0	0	112.4	D57 Y58	S55-D57 PolarHBondContact O-N 2.92Å; S55-D57 PolarHBondContact OG-OD1 3.43Å; S55-Y58 PolarHBondContact N-O 3.48Å; S55-Y58 PolarHBondContact O-N 3.32Å; S55-Y58 WeakPolarHBondContact OG-CB 3.39Å
56	E	47.2	Very low	42.9	Very low	48 Å²	48	64.6 Å²	64.6	22%	0.224	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-26.8	-178.8	-55.6	-172.2	146.2	0	0	113.2	L162 E244	E56-L162 HydrophobicContact CB-CD2 4.34Å; E56-L162 WeakPolarHBondContact OE2-CD2 3.31Å; E56-E244 HydrophobicContact CG-CB 4.42Å; E56-E244 HydrophobicContact CG-CG 3.7Å; E56-E244 PolarHBondContact OE1-N 2.91Å
57	D	49.9	Very low	43.2	Very low	88 Å²	88	67.3 Å²	67.3	47%	0.471	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.1	5.9	-176.7	61.3	-26.6	0	0	0	113.5	S55	S55-D57 PolarHBondContact O-N 2.92Å; S55-D57 PolarHBondContact OG-OD1 3.43Å
58	Y	40.4	Very low	43.4	Very low	68 Å²	68	60.6 Å²	60.6	27%	0.267	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	117	-174	-177.5	-85.3	0	0	0	113.2	H54 S55 K60 A126	H54-Y58 HydrophobicContact CB-CD1 3.34Å; H54-Y58 HydrophobicContact CB-CE1 3.61Å; H54-Y58 HydrophobicContact CB-CG 4.29Å; H54-Y58 AromaticContact CD2-CD1 3.95Å; H54-Y58 AromaticContact CD2-CE1 3.35Å; H54-Y58 WeakPolarHBondContact CD2-CE1 3.21Å; H54-Y58 AromaticContact CG-CD1 3.8Å; H54-Y58 AromaticContact CG-CE1 3.49Å; H54-Y58 VanDerWaalsContact CG-CE1 3.49Å; H54-Y58 PolarHBondContact N-O 3.38Å; S55-Y58 PolarHBondContact N-O 3.48Å; S55-Y58 PolarHBondContact O-N 3.32Å; S55-Y58 WeakPolarHBondContact OG-CB 3.39Å; Y58-K60 HydrophobicContact CE1-CB 3.85Å; Y58-A126 HydrophobicContact CD2-CB 4.11Å; Y58-A126 HydrophobicContact CE2-CB 3.54Å
59	L	43.2	Very low	42.9	Very low	22 Å²	22	63.3 Å²	63.3	12%	0.115	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	126.6	168.5	-76.8	154	0	0	0	108.9	L130 Q157 T159	L59-L130 HydrophobicContact CD1-CD1 4.25Å; L59-Q157 HydrophobicContact CD1-CG 4.25Å; L59-Q157 HydrophobicContact CD2-CG 4.33Å; L59-T159 HydrophobicContact CD1-CG2 4.43Å
60	K	39.5	Very low	42.8	Very low	64 Å²	64	70.5 Å²	70.5	28%	0.278	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	121.7	171.8	177.6	-176.1	169.7	-153.9	0	108.9	F51 E52 Y58	F51-K60 CarbonylContact C-O 3.54Å; F51-K60 WeakPolarHBondContact CA-O 3.31Å; E52-K60 HydrophobicContact CB-CB 4.29Å; E52-K60 HydrophobicContact CB-CD 4.41Å; E52-K60 PolarHBondContact N-O 3.26Å; E52-K60 WeakPolarHBondContact O-CA 3.19Å; E52-K60 WeakPolarHBondContact O-CB 3.3Å; E52-K60 PolarHBondContact O-N 3.01Å; E52-K60 IonicContact OE2-NZ 2.93Å; E52-K60 PolarHBondContact OE2-NZ 2.74Å; Y58-K60 HydrophobicContact CE1-CB 3.85Å
61	V	46.5	Very low	42.2	Very low	10 Å²	10	70.5 Å²	70.5	6%	0.061	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	131.3	179	-168.5	0	0	0	0	108.6	L49 F51 W63 S124	L49-V61 HydrophobicContact CD2-CG1 3.87Å; F51-V61 HydrophobicContact CD1-CB 4.18Å; F51-V61 HydrophobicContact CD1-CG1 4.03Å; F51-V61 HydrophobicContact CD1-CG2 3.51Å; F51-V61 HydrophobicContact CD2-CG1 4.14Å; F51-V61 HydrophobicContact CE1-CB 3.93Å; F51-V61 HydrophobicContact CE1-CG1 3.56Å; F51-V61 HydrophobicContact CE1-CG2 3.19Å; F51-V61 HydrophobicContact CE2-CG1 3.65Å; F51-V61 HydrophobicContact CG-CG1 4.3Å; F51-V61 HydrophobicContact CG-CG2 4.44Å; F51-V61 HydrophobicContact CZ-CB 4.21Å; F51-V61 HydrophobicContact CZ-CG1 3.32Å; F51-V61 HydrophobicContact CZ-CG2 3.9Å; V61-W63 HydrophobicContact CB-CZ3 4.46Å; V61-W63 HydrophobicContact CG1-CE3 4.23Å; V61-W63 HydrophobicContact CG1-CZ3 4.32Å; V61-S124 WeakPolarHBondContact O-CA 3.49Å; V61-S124 WeakPolarHBondContact O-CB 3.28Å
62	S	39.4	Very low	41.3	Very low	27 Å²	27	74.3 Å²	74.3	19%	0.189	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	148.2	179.2	53.8	0	0	0	0	110.3	L49 N50	L49-S62 CarbonylContact C-O 3.54Å; L49-S62 WeakPolarHBondContact CA-O 3.48Å; N50-S62 WeakPolarHBondContact CB-OG 3.29Å; N50-S62 PolarHBondContact N-O 3.32Å; N50-S62 PolarHBondContact ND2-OG 3.43Å; N50-S62 PolarHBondContact O-N 3Å; N50-S62 PolarHBondContact O-OG 3.46Å
63	W	51.2	Low	40.5	Very low	24 Å²	24	77.8 Å²	77.8	9%	0.091	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	157.8	-179.1	52.7	98.2	0	0	0	112.7	L48 L49 V61 V119 L122 N123	L48-W63 VanDerWaalsContact O-CA 3.23Å; L48-W63 WeakPolarHBondContact O-CA 3.4Å; L48-W63 WeakPolarHBondContact O-CB 3.29Å; L49-W63 HydrophobicContact CD2-CB 3.69Å; L49-W63 HydrophobicContact CD2-CD2 4.23Å; L49-W63 HydrophobicContact CD2-CE3 3.91Å; L49-W63 HydrophobicContact CD2-CG 4.19Å; L49-W63 HydrophobicContact CG-CB 4.24Å; V61-W63 HydrophobicContact CB-CZ3 4.46Å; V61-W63 HydrophobicContact CG1-CE3 4.23Å; V61-W63 HydrophobicContact CG1-CZ3 4.32Å; W63-V119 HydrophobicContact CH2-CB 4.49Å; W63-V119 HydrophobicContact CZ2-CB 4.46Å; W63-L122 WeakPolarHBondContact CZ2-O 3.5Å; W63-N123 WeakPolarHBondContact CZ3-O 2.9Å
64	D	43.1	Very low	39.5	Very low	84 Å²	84	81 Å²	81	45%	0.449	41%	0.414	S	S	.	.			trans	-96.1	112.7	174.3	-173.2	-8.9	0	0	0	110.7	L48 S66	L48-D64 PolarHBondContact O-N 3.02Å; D64-S66 VanDerWaalsContact CG-OG 3.22Å; D64-S66 PolarHBondContact O-N 2.9Å; D64-S66 WeakPolarHBondContact OD1-CB 3.03Å; D64-S66 PolarHBondContact OD1-N 2.93Å; D64-S66 PolarHBondContact OD1-OG 3.26Å; D64-S66 PolarHBondContact OD2-OG 3Å
65	M	38	Very low	38.5	Very low	102 Å²	102	81.4 Å²	81.4	50%	0.502	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-19.9	179.4	-79.1	-92	-83	0	0	113.9
66	S	44.4	Very low	37.3	Very low	90 Å²	90	87.3 Å²	87.3	63%	0.629	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-14.6	-173.7	68.4	0	0	0	0	114.7	D64	D64-S66 VanDerWaalsContact CG-OG 3.22Å; D64-S66 PolarHBondContact O-N 2.9Å; D64-S66 WeakPolarHBondContact OD1-CB 3.03Å; D64-S66 PolarHBondContact OD1-N 2.93Å; D64-S66 PolarHBondContact OD1-OG 3.26Å; D64-S66 PolarHBondContact OD2-OG 3Å
67	Q	39.5	Very low	36.1	Very low	97 Å²	97	94.7 Å²	94.7	45%	0.453	48%	0.479	S	S	.	.	S	Bend	trans	-112.4	0.9	-168.5	-68	-83.6	-36.1	0	0	114.9	S44 L48 P69	S44-Q67 PolarHBondContact OG-OE1 2.99Å; L48-Q67 HydrophobicContact CD1-CB 4.42Å; L48-Q67 HydrophobicContact CD2-CB 4.4Å; L48-Q67 HydrophobicContact CG-CB 4.16Å; Q67-P69 WeakPolarHBondContact O-CD 3.49Å
68	I	40.3	Very low	34.9	Very low	27 Å²	27	95.3 Å²	95.3	14%	0.138	49%	0.49	C	S	.	.	S	Bend	trans	-83.8	106	175.8	-56.2	166.3	0	0	0	108.4	L48 Y70	L48-I68 HydrophobicContact CD2-CB 4.13Å; L48-I68 HydrophobicContact CD2-CD1 4.3Å; L48-I68 HydrophobicContact CD2-CG1 3.2Å; I68-Y70 PolarHBondContact O-N 3.46Å
69	P	35	Very low	34.1	Very low	105 Å²	105	97 Å²	97	68%	0.682	52%	0.517	S	S	*	.			trans	-65.6	126.9	-179.2	26	-32	0	0	0	110.6	Q67	Q67-P69 WeakPolarHBondContact O-CD 3.49Å
70	Y	36.3	Very low	33.3	Very low	178 Å²	178	101.1 Å²	101.1	70%	0.698	54%	0.544	S	S	*	.			trans	-52.6	135.4	174.8	-62.6	-90.4	0	0	0	110.5	I68 D72 L101	I68-Y70 PolarHBondContact O-N 3.46Å; Y70-D72 PolarHBondContact O-N 2.86Å; Y70-D72 VanDerWaalsContact O-N 3.13Å; Y70-L101 HydrophobicContact CD1-CD1 4.25Å; Y70-L101 HydrophobicContact CE1-CD1 3.96Å
71	C	28.6	Very low	33	Very low	65 Å²	65	108 Å²	108	44%	0.439	58%	0.577	S	S	.	*			trans	-40.8	110.6	-171	-53.5	0	0	0	0	114.6	S150	C71-S150 WeakPolarHBondContact SG-CA 2.98Å; C71-S150 WeakPolarHBondContact SG-CB 3.44Å
72	D	25.8	Very low	32.3	Very low	130 Å²	130	112.1 Å²	112.1	70%	0.695	61%	0.606	S	S	*	*			trans	-86.2	119.8	160.3	-81	-32.6	0	0	0	109.2	Y70 F74	Y70-D72 PolarHBondContact O-N 2.86Å; Y70-D72 VanDerWaalsContact O-N 3.13Å; D72-F74 HydrophobicContact CB-CE2 4.31Å; D72-F74 VanDerWaalsContact O-CD2 3.29Å; D72-F74 WeakPolarHBondContact O-CD2 3.11Å; D72-F74 PolarHBondContact O-N 2.86Å
73	I	24.7	Very low	31.8	Very low	150 Å²	150	114.2 Å²	114.2	77%	0.769	63%	0.632	S	S	*	*			trans	-73	111.2	-179.3	-63.5	165.9	0	0	0	108.8
74	F	24.4	Very low	30.5	Very low	162 Å²	162	122.7 Å²	122.7	71%	0.711	67%	0.669	S	S	*	*			trans	-92.2	112.8	173.7	-74.4	-87.2	0	0	0	111.1	D72 I76 L151	D72-F74 HydrophobicContact CB-CE2 4.31Å; D72-F74 VanDerWaalsContact O-CD2 3.29Å; D72-F74 WeakPolarHBondContact O-CD2 3.11Å; D72-F74 PolarHBondContact O-N 2.86Å; F74-I76 PolarHBondContact O-N 3.2Å; F74-L151 HydrophobicContact CD2-CD1 4.15Å; F74-L151 HydrophobicContact CE2-CD1 4.38Å
75	N	23	Very low	29.7	Very low	131 Å²	131	126.3 Å²	126.3	70%	0.701	68%	0.683	S	S	*	*			trans	-75.8	112.7	169.5	-87.9	-32.7	0	0	0	110.5	K77	N75-K77 PolarHBondContact O-N 3.15Å
76	I	22.6	Very low	29	Very low	161 Å²	161	130.7 Å²	130.7	83%	0.826	70%	0.703	S	S	*	*			trans	-81.9	110	169	-61.2	174.1	0	0	0	108	F74 S78	F74-I76 PolarHBondContact O-N 3.2Å; I76-S78 PolarHBondContact O-N 2.97Å
77	K	22.8	Very low	28	Very low	204 Å²	204	136.6 Å²	136.6	89%	0.887	71%	0.713	S	S	*	*			trans	-74.1	107.5	170.1	-73.7	178.5	176.9	176.8	0	109.2	N75	N75-K77 PolarHBondContact O-N 3.15Å
78	S	24.1	Very low	27.1	Very low	100 Å²	100	135.3 Å²	135.3	70%	0.699	73%	0.725	S	S	*	*			trans	-82.7	114.3	164.7	65.4	0	0	0	0	109.5	I76 T80	I76-S78 PolarHBondContact O-N 2.97Å; S78-T80 PolarHBondContact O-N 2.96Å
79	A	23.8	Very low	26.1	Very low	103 Å²	103	140.4 Å²	140.4	85%	0.851	76%	0.758	S	S	*	*			trans	-73.8	115.8	169.4	0	0	0	0	0	108.8
80	T	26.3	Very low	25.5	Very low	110 Å²	110	140.7 Å²	140.7	68%	0.675	76%	0.757	S	S	*	*			trans	-117.9	140.6	160.2	48.8	0	0	0	0	107.9	S78 S82	S78-T80 PolarHBondContact O-N 2.96Å; T80-S82 PolarHBondContact O-N 3.2Å
81	E	32.6	Very low	24.8	Very low	209 Å²	209	138.3 Å²	138.3	98%	0.977	76%	0.761	S	S	*	*	S	Bend	trans	-65.4	2.9	-164.8	-73.4	-179.1	144.7	0	0	116	G83	E81-G83 PolarHBondContact O-N 3.32Å
82	S	31.4	Very low	24.5	Very low	96 Å²	96	146.7 Å²	146.7	67%	0.671	78%	0.783	S	S	*	*	S	Bend	trans	-99.3	85.6	173.9	62.5	0	0	0	0	110.4	T80 K84	T80-S82 PolarHBondContact O-N 3.2Å; S82-K84 VanDerWaalsContact C-N 3.33Å; S82-K84 PolarHBondContact O-N 3.44Å
83	G	29.4	Very low	24.3	Very low	70 Å²	70	148.7 Å²	148.7	72%	0.722	79%	0.788	S	S	*	*			trans	-59.3	76.2	-176.2	0	0	0	0	0	116.3	E81	E81-G83 PolarHBondContact O-N 3.32Å
84	K	24.9	Very low	24.2	Very low	202 Å²	202	151.6 Å²	151.6	88%	0.878	79%	0.79	S	S	*	*			trans	-111.8	106.9	161	-84.1	-173.8	174.5	-178.2	0	109.8	S82 E86	S82-K84 VanDerWaalsContact C-N 3.33Å; S82-K84 PolarHBondContact O-N 3.44Å; K84-E86 PolarHBondContact O-N 2.99Å
85	H	25.5	Very low	24.5	Very low	161 Å²	161	150 Å²	150	75%	0.745	79%	0.793	S	S	*	*			trans	-81.3	104.8	172.8	-66.5	-82.9	0	0	0	109.4	Y87	H85-Y87 HydrophobicContact CB-CE2 4.3Å
86	E	23.3	Very low	24.8	Very low	194 Å²	194	149.5 Å²	149.5	91%	0.907	80%	0.795	S	S	*	*			trans	-100.6	122.3	163.1	-106.7	179.6	177.4	0	0	109.7	K84 G88	K84-E86 PolarHBondContact O-N 2.99Å; E86-G88 PolarHBondContact O-N 3.46Å
87	Y	23.3	Very low	25.2	Very low	214 Å²	214	144 Å²	144	84%	0.839	78%	0.778	S	S	*	*			trans	-83.2	97.8	-178.3	-65	-94	0	0	0	109.1	H85	H85-Y87 HydrophobicContact CB-CE2 4.3Å
88	G	20.7	Very low	26.1	Very low	70 Å²	70	138.1 Å²	138.1	72%	0.722	78%	0.775	S	S	*	*			trans	-83.3	117.5	169.7	0	0	0	0	0	111.4	E86 V90	E86-G88 PolarHBondContact O-N 3.46Å; G88-V90 PolarHBondContact O-N 3.18Å
89	T	20.4	Very low	26.9	Very low	134 Å²	134	142.7 Å²	142.7	82%	0.822	78%	0.782	S	S	*	*			trans	-71.5	118.4	176.2	-47.3	0	0	0	0	110.6	V91	T89-V91 PolarHBondContact O-N 3.35Å
90	V	22.6	Very low	27.8	Very low	111 Å²	111	142.7 Å²	142.7	67%	0.673	77%	0.768	S	S	*	*			trans	-83.7	112.1	176.4	179	0	0	0	0	109.2	G88	G88-V90 PolarHBondContact O-N 3.18Å
91	V	20.8	Very low	28.9	Very low	127 Å²	127	141.1 Å²	141.1	77%	0.77	76%	0.755	S	S	*	*			trans	-78.6	119.5	172.5	179	0	0	0	0	108.8	T89 E93	T89-V91 PolarHBondContact O-N 3.35Å; V91-E93 PolarHBondContact O-N 3.01Å
92	R	21.4	Very low	30	Very low	241 Å²	241	135.6 Å²	135.6	91%	0.909	73%	0.729	S	S	*	*			trans	-82.3	90	176.6	-167.9	-174.2	-148	170.8	7	109	R94	R92-R94 PolarHBondContact O-N 3.41Å
93	E	22.2	Very low	31	Very low	172 Å²	172	131.7 Å²	131.7	80%	0.804	70%	0.701	S	S	*	*			trans	-85.4	112.7	172.6	-157.9	168.6	-157.8	0	0	110.1	V91 V95	V91-E93 PolarHBondContact O-N 3.01Å; E93-V95 PolarHBondContact O-N 3.5Å
94	R	23.4	Very low	32.2	Very low	211 Å²	211	129.4 Å²	129.4	80%	0.796	67%	0.673	S	S	*	*			trans	-74.9	99.9	177.3	-164.6	-173.6	-156.3	166.8	5.6	107.6	R92 T96	R92-R94 PolarHBondContact O-N 3.41Å; R94-T96 HydrophobicContact CG-CG2 3.96Å; R94-T96 PolarHBondContact O-N 2.91Å
95	V	30.9	Very low	33.7	Very low	130 Å²	130	120.1 Å²	120.1	79%	0.788	63%	0.632	S	S	*	*			trans	-74.4	74.8	171	-173	0	0	0	0	108.9	E93 G97	E93-V95 PolarHBondContact O-N 3.5Å; V95-G97 PolarHBondContact O-N 3.38Å
96	T	28	Very low	35.2	Very low	120 Å²	120	116.4 Å²	116.4	74%	0.736	62%	0.615	S	S	*	*			trans	-78	88.5	162.8	37.6	0	0	0	0	107.9	R94	R94-T96 HydrophobicContact CG-CG2 3.96Å; R94-T96 PolarHBondContact O-N 2.91Å
97	G	30.8	Very low	36.7	Very low	46 Å²	46	107.7 Å²	107.7	47%	0.474	58%	0.575	S	S	.	*			trans	177.6	72.9	-179.6	0	0	0	0	0	112.1	V95 K99	V95-G97 PolarHBondContact O-N 3.38Å; G97-K99 PolarHBondContact O-N 3.02Å
98	G	42.5	Very low	38.5	Very low	80 Å²	80	99.5 Å²	99.5	83%	0.825	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	56.8	-179	0	0	0	0	0	115.5
99	K	39.7	Very low	40	Very low	195 Å²	195	98.3 Å²	98.3	85%	0.848	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.5	-1.7	170.7	-78.2	-166.9	174.1	-176.9	0	115.9	G97	G97-K99 PolarHBondContact O-N 3.02Å
100	N	44.1	Very low	41.5	Very low	103 Å²	103	97.3 Å²	97.3	55%	0.551	51%	0.514	S	S	*	.			trans	-123.8	27.7	-170.7	-73.4	-5.3	0	0	0	114.4	A145	N100-A145 HydrophobicContact CB-CB 4Å; N100-A145 PolarHBondContact O-N 3.47Å; N100-A145 VanDerWaalsContact O-N 3.09Å
101	L	48.3	Very low	42.6	Very low	78 Å²	78	97.1 Å²	97.1	41%	0.408	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	118.6	172.4	-69.8	163.3	0	0	0	108.6	Y70 I143	Y70-L101 HydrophobicContact CD1-CD1 4.25Å; Y70-L101 HydrophobicContact CE1-CD1 3.96Å; L101-I143 CarbonylContact C-O 3.5Å; L101-I143 WeakPolarHBondContact CA-O 3.48Å
102	H	55.6	Low	44	Very low	92 Å²	92	98.2 Å²	98.2	43%	0.426	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	125.5	171.4	-65.4	62.5	0	0	0	107.8	D118 I143	H102-D118 IonicContact CD2-OD2 2.84Å; H102-I143 PolarHBondContact N-O 3.09Å; H102-I143 WeakPolarHBondContact O-CA 3.15Å; H102-I143 WeakPolarHBondContact O-CB 3.32Å; H102-I143 PolarHBondContact O-N 3.45Å
103	Q	53	Low	45.6	Very low	15 Å²	15	88.5 Å²	88.5	7%	0.07	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	126.7	177.1	-64	-170.4	-32.9	0	0	109.2	V119 S120 N142	Q103-V119 HydrophobicContact CB-CG2 4.05Å; Q103-V119 WeakPolarHBondContact O-CG2 3.39Å; Q103-V119 PolarHBondContact O-N 2.89Å; Q103-S120 PolarHBondContact O-N 3Å; Q103-N142 VanDerWaalsContact CG-OD1 3.3Å; Q103-N142 WeakPolarHBondContact CG-OD1 3.37Å; Q103-N142 PolarHBondContact NE2-OD1 3.39Å
104	T	54.5	Low	47.2	Very low	22 Å²	22	86.9 Å²	86.9	14%	0.135	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	126.8	176.3	-63.3	0	0	0	0	109.7	Q106 S116 A141 I143	T104-Q106 HydrophobicContact CG2-CG 4.28Å; T104-S116 WeakPolarHBondContact CG2-OG 3.48Å; T104-A141 PolarHBondContact N-O 2.93Å; T104-A141 PolarHBondContact O-N 2.77Å; T104-A141 VanDerWaalsContact O-N 3.07Å; T104-I143 VanDerWaalsContact OG1-CD1 3.25Å; T104-I143 WeakPolarHBondContact OG1-CD1 3.33Å
105	L	57.3	Low	49.1	Very low	6 Å²	6	82.7 Å²	82.7	3%	0.031	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	122	170.3	170.4	66.3	0	0	0	108.8	I107 S116 V117 V119 I125 A138 I140	L105-I107 HydrophobicContact CD1-CG1 4.17Å; L105-I107 HydrophobicContact CD2-CD1 3.76Å; L105-I107 HydrophobicContact CD2-CG1 4.07Å; L105-I107 HydrophobicContact CG-CD1 4Å; L105-I107 HydrophobicContact CG-CG1 3.95Å; L105-S116 CarbonylContact O-C 3.49Å; L105-S116 WeakPolarHBondContact O-CA 3.29Å; L105-V117 PolarHBondContact N-O 2.85Å; L105-V117 PolarHBondContact O-N 2.94Å; L105-V119 HydrophobicContact CB-CG1 4.12Å; L105-V119 HydrophobicContact CB-CG2 3.81Å; L105-V119 HydrophobicContact CD2-CG1 4.48Å; L105-I125 HydrophobicContact CD2-CG2 3.45Å; L105-I125 VanDerWaalsContact CD2-CG2 3.45Å; L105-A138 HydrophobicContact CD1-CB 4.17Å; L105-I140 HydrophobicContact CB-CG1 4.25Å; L105-I140 HydrophobicContact CD1-CD1 4.04Å; L105-I140 HydrophobicContact CD1-CG1 3.38Å; L105-I140 HydrophobicContact CG-CG1 4.37Å
106	Q	57.6	Low	50.8	Low	83 Å²	83	80 Å²	80	39%	0.388	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	121.2	170.2	-65.3	-175.7	-9.1	0	0	109.2	T104 Q114 A138 A139	T104-Q106 HydrophobicContact CG2-CG 4.28Å; Q106-Q114 VanDerWaalsContact OE1-NE2 3.12Å; Q106-A138 CarbonylContact O-C 3.59Å; Q106-A138 WeakPolarHBondContact O-CA 3.49Å; Q106-A139 PolarHBondContact N-O 3.14Å; Q106-A139 PolarHBondContact O-N 2.88Å
107	I	54.5	Low	52.8	Low	11 Å²	11	76.2 Å²	76.2	6%	0.056	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	122.4	173.6	-58.6	134.1	0	0	0	107.1	L105 Q114 K115 I127 Y136	L105-I107 HydrophobicContact CD1-CG1 4.17Å; L105-I107 HydrophobicContact CD2-CD1 3.76Å; L105-I107 HydrophobicContact CD2-CG1 4.07Å; L105-I107 HydrophobicContact CG-CD1 4Å; L105-I107 HydrophobicContact CG-CG1 3.95Å; I107-Q114 CarbonylContact O-C 3.58Å; I107-Q114 WeakPolarHBondContact O-CA 3.42Å; I107-K115 PolarHBondContact N-O 3.35Å; I107-K115 PolarHBondContact O-N 3.11Å; I107-I127 HydrophobicContact CD1-CD1 3.19Å; I107-I127 HydrophobicContact CD1-CG1 3.59Å; I107-I127 HydrophobicContact CD1-CG2 4.2Å; I107-I127 HydrophobicContact CG1-CD1 3.62Å; I107-Y136 HydrophobicContact CG2-CD1 4.06Å
108	S	60.4	Low	54.6	Low	42 Å²	42	78 Å²	78	29%	0.294	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	131.7	176.2	61.2	0	0	0	0	110.9	G113 Y136 V137	S108-G113 CarbonylContact C-O 3.33Å; S108-G113 WeakPolarHBondContact CA-O 3.37Å; S108-Y136 CarbonylContact O-C 3.59Å; S108-Y136 WeakPolarHBondContact O-CA 3.36Å; S108-V137 PolarHBondContact N-O 2.92Å; S108-V137 PolarHBondContact O-N 3.37Å; S108-V137 PolarHBondContact OG-O 3.4Å
109	Q	52.2	Low	56	Low	46 Å²	46	74.2 Å²	74.2	22%	0.215	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	118.9	165.2	-168.7	174.3	12.8	0	0	107.2	P111 N112 G113 N131 A134 Y136	Q109-P111 CarbonylContact O-C 3.5Å; Q109-P111 VanDerWaalsContact O-CA 3.28Å; Q109-P111 WeakPolarHBondContact O-CA 3.32Å; Q109-P111 VanDerWaalsContact O-N 3.17Å; Q109-N112 PolarHBondContact O-N 3.16Å; Q109-G113 PolarHBondContact N-O 3.17Å; Q109-N131 PolarHBondContact NE2-ND2 2.95Å; Q109-A134 HydrophobicContact CG-CB 4.48Å; Q109-Y136 HydrophobicContact CB-CD1 3.85Å; Q109-Y136 HydrophobicContact CB-CE1 3.47Å; Q109-Y136 VanDerWaalsContact CB-CE1 3.47Å; Q109-Y136 HydrophobicContact CG-CD1 4.19Å; Q109-Y136 HydrophobicContact CG-CE1 3.65Å; Q109-Y136 PolarHBondContact NE2-OH 2.9Å
110	N	52.9	Low	57.3	Low	112 Å²	112	67.5 Å²	67.5	60%	0.599	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	110.9	175.2	-166.7	0.4	0	0	0	108.4	T135	N110-T135 PolarHBondContact N-O 3.32Å
111	P	43.7	Very low	58.3	Low	107 Å²	107	67.8 Å²	67.8	70%	0.695	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	cis	-118.8	7.9	10.9	31.8	-12.9	0	0	0	117.7	Q109	Q109-P111 CarbonylContact O-C 3.5Å; Q109-P111 VanDerWaalsContact O-CA 3.28Å; Q109-P111 WeakPolarHBondContact O-CA 3.32Å; Q109-P111 VanDerWaalsContact O-N 3.17Å
112	N	50.8	Low	59.2	Low	150 Å²	150	67.7 Å²	67.7	80%	0.802	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.6	2.8	-159	-74.7	-10	0	0	0	118.6	Q109	Q109-N112 PolarHBondContact O-N 3.16Å
113	G	55.9	Low	59.9	Low	37 Å²	37	68.2 Å²	68.2	38%	0.381	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	132.8	179.6	0	0	0	0	0	113.7	S108 Q109	S108-G113 CarbonylContact C-O 3.33Å; S108-G113 WeakPolarHBondContact CA-O 3.37Å; Q109-G113 PolarHBondContact N-O 3.17Å
114	Q	55	Low	60.5	Low	138 Å²	138	70 Å²	70	65%	0.645	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121	119.4	175	-167.9	178.2	16.4	0	0	109.1	Q106 I107	Q106-Q114 VanDerWaalsContact OE1-NE2 3.12Å; I107-Q114 CarbonylContact O-C 3.58Å; I107-Q114 WeakPolarHBondContact O-CA 3.42Å
115	K	63.3	Low	61.4	Low	124 Å²	124	70.3 Å²	70.3	54%	0.539	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	117.7	173.9	-170	177.5	-177.8	178.9	0	108.2	I107 V117	I107-K115 PolarHBondContact N-O 3.35Å; I107-K115 PolarHBondContact O-N 3.11Å; K115-V117 HydrophobicContact CG-CG2 4.19Å
116	S	65.9	Low	62.1	Low	72 Å²	72	72.1 Å²	72.1	50%	0.503	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	127.9	175.7	-166.5	0	0	0	0	109.2	T104 L105	T104-S116 WeakPolarHBondContact CG2-OG 3.48Å; L105-S116 CarbonylContact O-C 3.49Å; L105-S116 WeakPolarHBondContact O-CA 3.29Å
117	V	71.1	Confident	62.9	Low	41 Å²	41	69.2 Å²	69.2	25%	0.248	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	130.8	179.3	-173.9	0	0	0	0	108.9	L105 K115 V119 I125	L105-V117 PolarHBondContact N-O 2.85Å; L105-V117 PolarHBondContact O-N 2.94Å; K115-V117 HydrophobicContact CG-CG2 4.19Å; V117-V119 HydrophobicContact CG1-CG1 4.37Å; V117-V119 PolarHBondContact O-N 3.4Å; V117-I125 HydrophobicContact CB-CD1 4.19Å; V117-I125 HydrophobicContact CG1-CD1 3.68Å; V117-I125 HydrophobicContact CG2-CD1 4.49Å
118	D	69.3	Low	63.9	Low	85 Å²	85	73.6 Å²	73.6	46%	0.455	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	121.4	169.5	-171	-16.5	0	0	0	108.9	H102 S120	H102-D118 IonicContact CD2-OD2 2.84Å; D118-S120 WeakPolarHBondContact OD1-CB 3.2Å; D118-S120 PolarHBondContact OD1-N 2.82Å; D118-S120 PolarHBondContact OD1-OG 3.2Å
119	V	70.2	Confident	64.6	Low	0 Å²	0	74.9 Å²	74.9	0%	0	45%	0.449	C	S	.	.			trans	-118.1	17.8	-177.6	-73.6	0	0	0	0	111.9	W63 Q103 L105 V117 S121 L122 I125	W63-V119 HydrophobicContact CH2-CB 4.49Å; W63-V119 HydrophobicContact CZ2-CB 4.46Å; Q103-V119 HydrophobicContact CB-CG2 4.05Å; Q103-V119 WeakPolarHBondContact O-CG2 3.39Å; Q103-V119 PolarHBondContact O-N 2.89Å; L105-V119 HydrophobicContact CB-CG1 4.12Å; L105-V119 HydrophobicContact CB-CG2 3.81Å; L105-V119 HydrophobicContact CD2-CG1 4.48Å; V117-V119 HydrophobicContact CG1-CG1 4.37Å; V117-V119 PolarHBondContact O-N 3.4Å; V119-S121 PolarHBondContact O-N 3.43Å; V119-L122 PolarHBondContact O-N 3.37Å; V119-L122 VanDerWaalsContact O-N 3.09Å; V119-I125 HydrophobicContact CG1-CB 4.32Å; V119-I125 HydrophobicContact CG1-CD1 3.89Å; V119-I125 HydrophobicContact CG1-CG2 4.27Å
120	S	67.3	Low	66	Low	53 Å²	53	74.1 Å²	74.1	37%	0.371	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-28.5	-177.8	49.8	0	0	0	0	116.1	Q103 D118	Q103-S120 PolarHBondContact O-N 3Å; D118-S120 WeakPolarHBondContact OD1-CB 3.2Å; D118-S120 PolarHBondContact OD1-N 2.82Å; D118-S120 PolarHBondContact OD1-OG 3.2Å
121	S	66.7	Low	67.3	Low	109 Å²	109	72.9 Å²	72.9	76%	0.762	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.8	3.8	-179	61.6	0	0	0	0	114.6	V119	V119-S121 PolarHBondContact O-N 3.43Å
122	L	67.2	Low	69.2	Low	77 Å²	77	70 Å²	70	40%	0.403	42%	0.421	S	S	.	.			trans	-118	139.4	-173.8	-65.3	169.9	0	0	0	110.3	W63 V119	W63-L122 WeakPolarHBondContact CZ2-O 3.5Å; V119-L122 PolarHBondContact O-N 3.37Å; V119-L122 VanDerWaalsContact O-N 3.09Å
123	N	69.5	Low	70.9	Confident	103 Å²	103	63.1 Å²	63.1	55%	0.551	39%	0.385	S	S	*	.	S	Bend	trans	-95.1	-3.5	170.1	-65.4	-1.8	0	0	0	112.4	W63	W63-N123 WeakPolarHBondContact CZ3-O 2.9Å
124	S	66.1	Low	72.1	Confident	53 Å²	53	62 Å²	62	37%	0.371	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	145.3	179.5	63.2	0	0	0	0	111.1	V61	V61-S124 WeakPolarHBondContact O-CA 3.49Å; V61-S124 WeakPolarHBondContact O-CB 3.28Å
125	I	73.3	Confident	73.4	Confident	27 Å²	27	56.3 Å²	56.3	14%	0.138	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	140.2	174.1	-173.1	168.9	0	0	0	110.3	L105 V117 V119	L105-I125 HydrophobicContact CD2-CG2 3.45Å; L105-I125 VanDerWaalsContact CD2-CG2 3.45Å; V117-I125 HydrophobicContact CB-CD1 4.19Å; V117-I125 HydrophobicContact CG1-CD1 3.68Å; V117-I125 HydrophobicContact CG2-CD1 4.49Å; V119-I125 HydrophobicContact CG1-CB 4.32Å; V119-I125 HydrophobicContact CG1-CD1 3.89Å; V119-I125 HydrophobicContact CG1-CG2 4.27Å
126	A	71.9	Confident	74.2	Confident	45 Å²	45	51.5 Å²	51.5	37%	0.372	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	129	171.4	0	0	0	0	0	109.3	Y58	Y58-A126 HydrophobicContact CD2-CB 4.11Å; Y58-A126 HydrophobicContact CE2-CB 3.54Å
127	I	74.9	Confident	74.9	Confident	21 Å²	21	49.7 Å²	49.7	11%	0.108	31%	0.31	C	S	.	.			trans	-110.9	104.8	-178.6	-52.5	153	0	0	0	107.7	I107 L130	I107-I127 HydrophobicContact CD1-CD1 3.19Å; I107-I127 HydrophobicContact CD1-CG1 3.59Å; I107-I127 HydrophobicContact CD1-CG2 4.2Å; I107-I127 HydrophobicContact CG1-CD1 3.62Å; I127-L130 HydrophobicContact CB-CD1 4.48Å; I127-L130 HydrophobicContact CG2-CD1 4.4Å; I127-L130 HydrophobicContact CG2-CD2 3.72Å; I127-L130 HydrophobicContact CG2-CG 4.16Å
128	N	75.4	Confident	75.4	Confident	103 Å²	103	48.5 Å²	48.5	55%	0.551	31%	0.305	S	S	*	.			trans	-94.7	161.9	-178.9	-55.9	-19.8	0	0	0	111.3
129	G	75	Confident	75.8	Confident	70 Å²	70	45.2 Å²	45.2	72%	0.722	29%	0.29	S	S	*	.	S	Bend	trans	73.5	30.5	175.8	0	0	0	0	0	113.5
130	L	79.8	Confident	76.3	Confident	29 Å²	29	46 Å²	46	15%	0.152	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-76.8	149.2	172.4	-60.8	175.5	0	0	0	110	L59 I127 Y136 T159	L59-L130 HydrophobicContact CD1-CD1 4.25Å; I127-L130 HydrophobicContact CB-CD1 4.48Å; I127-L130 HydrophobicContact CG2-CD1 4.4Å; I127-L130 HydrophobicContact CG2-CD2 3.72Å; I127-L130 HydrophobicContact CG2-CG 4.16Å; L130-Y136 HydrophobicContact CB-CE2 4.03Å; L130-Y136 HydrophobicContact CD2-CD1 4.09Å; L130-Y136 HydrophobicContact CD2-CE1 3.63Å; L130-Y136 HydrophobicContact CD2-CE2 4.13Å; L130-Y136 HydrophobicContact CG-CE2 4.5Å; L130-T159 HydrophobicContact CB-CG2 4.06Å; L130-T159 HydrophobicContact CD1-CG2 4.04Å
131	N	82.1	Confident	76.8	Confident	86 Å²	86	44.1 Å²	44.1	46%	0.46	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-74.8	139	172.9	-66.3	-10.2	0	0	0	109.2	Q109 A134 Y136 T159	Q109-N131 PolarHBondContact NE2-ND2 2.95Å; N131-A134 HydrophobicContact CB-CB 4.34Å; N131-Y136 PolarHBondContact N-OH 2.9Å; N131-T159 WeakPolarHBondContact O-CB 3.44Å; N131-T159 PolarHBondContact O-OG1 3.42Å
132	P	83.6	Confident	77.2	Confident	47 Å²	47	39.5 Å²	39.5	31%	0.305	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	157.5	172	30.8	-36.3	0	0	0	110.6	A134 L162	P132-A134 PolarHBondContact O-N 2.98Å; P132-L162 HydrophobicContact CB-CD1 4.25Å; P132-L162 HydrophobicContact CB-CD2 4.26Å; P132-L162 HydrophobicContact CB-CG 3.72Å; P132-L162 HydrophobicContact CG-CD1 3.77Å; P132-L162 HydrophobicContact CG-CG 3.83Å
133	S	84.8	Confident	77.5	Confident	6 Å²	6	38 Å²	38	4%	0.042	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	36	176.4	-54	0	0	0	0	115	T159 P160 P161 I190 Y238	S133-T159 PolarHBondContact N-OG1 2.63Å; S133-P160 PolarHBondContact N-O 3.49Å; S133-P161 VanDerWaalsContact OG-CA 3.31Å; S133-P161 WeakPolarHBondContact OG-CA 3.42Å; S133-P161 WeakPolarHBondContact OG-CB 3.44Å; S133-I190 WeakPolarHBondContact CB-O 3.17Å; S133-I190 PolarHBondContact OG-O 3.48Å; S133-Y238 VanDerWaalsContact C-CE1 3.42Å; S133-Y238 VanDerWaalsContact O-CE1 3.23Å; S133-Y238 WeakPolarHBondContact O-CE1 3.44Å; S133-Y238 VanDerWaalsContact O-CZ 3.26Å; S133-Y238 PolarHBondContact O-OH 3.08Å
134	A	82.6	Confident	77.5	Confident	12 Å²	12	34.5 Å²	34.5	10%	0.099	22%	0.224	C	C	.	.			trans	-124.3	148.5	-179.3	0	0	0	0	0	110.9	Q109 N131 P132 Y136 N158 T159	Q109-A134 HydrophobicContact CG-CB 4.48Å; N131-A134 HydrophobicContact CB-CB 4.34Å; P132-A134 PolarHBondContact O-N 2.98Å; A134-Y136 HydrophobicContact CB-CD2 4.31Å; A134-Y136 HydrophobicContact CB-CE2 3.68Å; A134-N158 WeakPolarHBondContact O-CA 3.22Å; A134-T159 PolarHBondContact N-OG1 3.12Å; A134-T159 PolarHBondContact O-N 2.95Å; A134-T159 PolarHBondContact O-OG1 3.24Å; A134-T159 VanDerWaalsContact O-OG1 3.08Å
135	T	82	Confident	77.4	Confident	19 Å²	19	35.4 Å²	35.4	12%	0.117	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	122.4	176.7	-53.9	0	0	0	0	109.2	N110 E156 N158	N110-T135 PolarHBondContact N-O 3.32Å; T135-E156 HydrophobicContact CG2-CG 3.41Å; T135-E156 VanDerWaalsContact CG2-CG 3.41Å; T135-E156 WeakPolarHBondContact CG2-OE1 3.34Å; T135-N158 VanDerWaalsContact CB-OD1 3.25Å; T135-N158 WeakPolarHBondContact CB-OD1 3.38Å; T135-N158 WeakPolarHBondContact CG2-OD1 3.39Å; T135-N158 PolarHBondContact OG1-OD1 3.45Å
136	Y	80.2	Confident	77.3	Confident	24 Å²	24	41.6 Å²	41.6	9%	0.094	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	134.3	178.9	-71.9	-88.7	0	0	0	109.7	I107 S108 Q109 L130 N131 A134 E156 Q157 T159	I107-Y136 HydrophobicContact CG2-CD1 4.06Å; S108-Y136 CarbonylContact O-C 3.59Å; S108-Y136 WeakPolarHBondContact O-CA 3.36Å; Q109-Y136 HydrophobicContact CB-CD1 3.85Å; Q109-Y136 HydrophobicContact CB-CE1 3.47Å; Q109-Y136 VanDerWaalsContact CB-CE1 3.47Å; Q109-Y136 HydrophobicContact CG-CD1 4.19Å; Q109-Y136 HydrophobicContact CG-CE1 3.65Å; Q109-Y136 PolarHBondContact NE2-OH 2.9Å; L130-Y136 HydrophobicContact CB-CE2 4.03Å; L130-Y136 HydrophobicContact CD2-CD1 4.09Å; L130-Y136 HydrophobicContact CD2-CE1 3.63Å; L130-Y136 HydrophobicContact CD2-CE2 4.13Å; L130-Y136 HydrophobicContact CG-CE2 4.5Å; N131-Y136 PolarHBondContact N-OH 2.9Å; A134-Y136 HydrophobicContact CB-CD2 4.31Å; A134-Y136 HydrophobicContact CB-CE2 3.68Å; Y136-E156 WeakPolarHBondContact O-CA 3.37Å; Y136-Q157 PolarHBondContact N-O 3.12Å; Y136-Q157 PolarHBondContact O-N 3.07Å; Y136-T159 HydrophobicContact CD2-CG2 3.71Å; Y136-T159 HydrophobicContact CE2-CG2 3.65Å
137	V	80.6	Confident	77.1	Confident	33 Å²	33	42.1 Å²	42.1	20%	0.2	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	115.1	173.9	-179.8	0	0	0	0	107.7	S108 I154 I155 E156	S108-V137 PolarHBondContact N-O 2.92Å; S108-V137 PolarHBondContact O-N 3.37Å; S108-V137 PolarHBondContact OG-O 3.4Å; V137-I154 HydrophobicContact CG1-CG2 3.44Å; V137-I154 VanDerWaalsContact CG1-CG2 3.44Å; V137-I155 WeakPolarHBondContact CA-O 3.47Å; V137-E156 HydrophobicContact CG2-CB 4.45Å; V137-E156 HydrophobicContact CG2-CG 4.19Å
138	A	81	Confident	76.5	Confident	16 Å²	16	46.7 Å²	46.7	13%	0.132	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	130.9	175	0	0	0	0	0	109.7	L105 Q106 I154 I155	L105-A138 HydrophobicContact CD1-CB 4.17Å; Q106-A138 CarbonylContact O-C 3.59Å; Q106-A138 WeakPolarHBondContact O-CA 3.49Å; A138-I154 CarbonylContact O-C 3.56Å; A138-I154 WeakPolarHBondContact O-CA 2.87Å; A138-I155 HydrophobicContact CB-CG2 3.97Å; A138-I155 PolarHBondContact N-O 3.09Å; A138-I155 PolarHBondContact O-N 3.33Å
139	A	78.1	Confident	76.2	Confident	17 Å²	17	44.9 Å²	44.9	14%	0.14	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	122.4	179.7	0	0	0	0	0	109.7	Q106 P152 T153 I154	Q106-A139 PolarHBondContact N-O 3.14Å; Q106-A139 PolarHBondContact O-N 2.88Å; A139-P152 HydrophobicContact CB-CB 4.17Å; A139-T153 CarbonylContact C-O 3.54Å; A139-T153 WeakPolarHBondContact CA-O 3.45Å; A139-I154 HydrophobicContact CB-CG1 4.11Å
140	I	80.3	Confident	76.3	Confident	15 Å²	15	42.4 Å²	42.4	8%	0.077	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	129.3	177.3	-62.7	172.6	0	0	0	108.9	L49 L105 P152 T153	L49-I140 HydrophobicContact CD1-CD1 4.39Å; L49-I140 HydrophobicContact CD2-CD1 3.61Å; L105-I140 HydrophobicContact CB-CG1 4.25Å; L105-I140 HydrophobicContact CD1-CD1 4.04Å; L105-I140 HydrophobicContact CD1-CG1 3.38Å; L105-I140 HydrophobicContact CG-CG1 4.37Å; I140-P152 CarbonylContact O-C 3.54Å; I140-P152 VanDerWaalsContact O-CA 3.28Å; I140-P152 WeakPolarHBondContact O-CA 3.45Å; I140-T153 PolarHBondContact N-O 2.94Å; I140-T153 PolarHBondContact O-N 2.84Å
141	A	77.5	Confident	76	Confident	15 Å²	15	47.2 Å²	47.2	12%	0.124	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	143	174.7	0	0	0	0	0	111.5	T104 S150 P152	T104-A141 PolarHBondContact N-O 2.93Å; T104-A141 PolarHBondContact O-N 2.77Å; T104-A141 VanDerWaalsContact O-N 3.07Å; A141-S150 WeakPolarHBondContact CA-OG 3.25Å; A141-P152 HydrophobicContact CB-CB 4.29Å
142	N	74.6	Confident	75.7	Confident	11 Å²	11	46.1 Å²	46.1	6%	0.059	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	127	169	-64.9	-26.8	0	0	0	108.5	Q103 A149 S150	Q103-N142 VanDerWaalsContact CG-OD1 3.3Å; Q103-N142 WeakPolarHBondContact CG-OD1 3.37Å; Q103-N142 PolarHBondContact NE2-OD1 3.39Å; N142-A149 CarbonylContact O-C 3.6Å; N142-A149 WeakPolarHBondContact O-CA 3.22Å; N142-S150 PolarHBondContact N-OG 3.45Å; N142-S150 PolarHBondContact O-N 3.02Å
143	I	74.8	Confident	75.4	Confident	45 Å²	45	46.5 Å²	46.5	23%	0.231	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	124.5	177.5	-52.2	-175.8	0	0	0	108.5	L101 H102 T104 L148 A149	L101-I143 CarbonylContact C-O 3.5Å; L101-I143 WeakPolarHBondContact CA-O 3.48Å; H102-I143 PolarHBondContact N-O 3.09Å; H102-I143 WeakPolarHBondContact O-CA 3.15Å; H102-I143 WeakPolarHBondContact O-CB 3.32Å; H102-I143 PolarHBondContact O-N 3.45Å; T104-I143 VanDerWaalsContact OG1-CD1 3.25Å; T104-I143 WeakPolarHBondContact OG1-CD1 3.33Å; I143-L148 WeakPolarHBondContact CA-O 3.47Å; I143-A149 HydrophobicContact CG1-CB 4.26Å
144	S	68.2	Low	75.1	Confident	31 Å²	31	51.4 Å²	51.4	22%	0.217	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	159.6	172.8	77.3	0	0	0	0	111.1	L146 G147 L148	S144-L146 PolarHBondContact O-N 3.16Å; S144-L146 PolarHBondContact OG-N 3.33Å; S144-G147 PolarHBondContact O-N 3.32Å; S144-L148 PolarHBondContact N-O 3.27Å; S144-L148 WeakPolarHBondContact OG-CB 3.47Å; S144-L148 PolarHBondContact OG-N 3.04Å
145	A	65.8	Low	74.8	Confident	72 Å²	72	53.2 Å²	53.2	60%	0.595	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-17.5	172.8	0	0	0	0	0	114.5	N100 G147	N100-A145 HydrophobicContact CB-CB 4Å; N100-A145 PolarHBondContact O-N 3.47Å; N100-A145 VanDerWaalsContact O-N 3.09Å; A145-G147 VanDerWaalsContact C-N 3.3Å
146	L	69.9	Low	74.7	Confident	156 Å²	156	58.1 Å²	58.1	82%	0.817	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	4.4	174.6	-69.3	163.7	0	0	0	113	S144 L148	S144-L146 PolarHBondContact O-N 3.16Å; S144-L146 PolarHBondContact OG-N 3.33Å; L146-L148 VanDerWaalsContact C-N 3.34Å
147	G	67	Low	74.7	Confident	56 Å²	56	60 Å²	60	58%	0.577	36%	0.36	S	S	*	.	S	Bend	trans	79.5	10.9	-178.8	0	0	0	0	0	114.6	S144 A145	S144-G147 PolarHBondContact O-N 3.32Å; A145-G147 VanDerWaalsContact C-N 3.3Å
148	L	62.8	Low	74.8	Confident	118 Å²	118	59.7 Å²	59.7	62%	0.618	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-83.7	119.8	177	-61.1	168.1	0	0	0	109.9	I143 S144 L146	I143-L148 WeakPolarHBondContact CA-O 3.47Å; S144-L148 PolarHBondContact N-O 3.27Å; S144-L148 WeakPolarHBondContact OG-CB 3.47Å; S144-L148 PolarHBondContact OG-N 3.04Å; L146-L148 VanDerWaalsContact C-N 3.34Å
149	A	69.4	Low	74.9	Confident	65 Å²	65	59 Å²	59	54%	0.537	35%	0.351	S	S	.	.	B	Isolated β-bridge	trans	-91	145.8	178.4	0	0	0	0	0	112.3	N142 I143	N142-A149 CarbonylContact O-C 3.6Å; N142-A149 WeakPolarHBondContact O-CA 3.22Å; I143-A149 HydrophobicContact CG1-CB 4.26Å
150	S	77.1	Confident	75.3	Confident	17 Å²	17	58.4 Å²	58.4	12%	0.119	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-68.7	165.4	167.7	73.7	0	0	0	0	111.5	C71 A141 N142	C71-S150 WeakPolarHBondContact SG-CA 2.98Å; C71-S150 WeakPolarHBondContact SG-CB 3.44Å; A141-S150 WeakPolarHBondContact CA-OG 3.25Å; N142-S150 PolarHBondContact N-OG 3.45Å; N142-S150 PolarHBondContact O-N 3.02Å
151	L	73.7	Confident	75.8	Confident	131 Å²	131	57.7 Å²	57.7	69%	0.686	34%	0.342	S	S	*	.	P	Polyproline II helix	trans	-53.9	127.6	158.2	-90.6	133.7	0	0	0	108.3	F74	F74-L151 HydrophobicContact CD2-CD1 4.15Å; F74-L151 HydrophobicContact CE2-CD1 4.38Å
152	P	75.9	Confident	76.3	Confident	63 Å²	63	59.7 Å²	59.7	41%	0.409	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-73.3	138.1	-179.5	27.7	-32.5	0	0	0	110.4	A139 I140 A141 I154	A139-P152 HydrophobicContact CB-CB 4.17Å; I140-P152 CarbonylContact O-C 3.54Å; I140-P152 VanDerWaalsContact O-CA 3.28Å; I140-P152 WeakPolarHBondContact O-CA 3.45Å; A141-P152 HydrophobicContact CB-CB 4.29Å; P152-I154 HydrophobicContact CB-CG1 4.38Å; P152-I154 HydrophobicContact CG-CD1 4.44Å; P152-I154 HydrophobicContact CG-CG1 4.42Å
153	T	76.7	Confident	77.1	Confident	55 Å²	55	60.5 Å²	60.5	34%	0.337	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	121.5	163.9	-59.3	0	0	0	0	108	L49 A139 I140	L49-T153 HydrophobicContact CD1-CG2 3.87Å; A139-T153 CarbonylContact C-O 3.54Å; A139-T153 WeakPolarHBondContact CA-O 3.45Å; I140-T153 PolarHBondContact N-O 2.94Å; I140-T153 PolarHBondContact O-N 2.84Å
154	I	78.6	Confident	77.9	Confident	109 Å²	109	60.9 Å²	60.9	56%	0.559	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.5	139.4	-174.1	-57.6	172.1	0	0	0	110	V137 A138 A139 P152	V137-I154 HydrophobicContact CG1-CG2 3.44Å; V137-I154 VanDerWaalsContact CG1-CG2 3.44Å; A138-I154 CarbonylContact O-C 3.56Å; A138-I154 WeakPolarHBondContact O-CA 2.87Å; A139-I154 HydrophobicContact CB-CG1 4.11Å; P152-I154 HydrophobicContact CB-CG1 4.38Å; P152-I154 HydrophobicContact CG-CD1 4.44Å; P152-I154 HydrophobicContact CG-CG1 4.42Å
155	I	77	Confident	79	Confident	49 Å²	49	59.6 Å²	59.6	25%	0.251	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	140.6	167.9	-169.2	175	0	0	0	110.6	F51 V137 A138	F51-I155 HydrophobicContact CD2-CD1 3.64Å; F51-I155 HydrophobicContact CE1-CG2 4.38Å; F51-I155 HydrophobicContact CE2-CB 4.45Å; F51-I155 HydrophobicContact CE2-CD1 3.26Å; F51-I155 HydrophobicContact CE2-CG1 4.32Å; F51-I155 HydrophobicContact CE2-CG2 3.69Å; F51-I155 HydrophobicContact CZ-CD1 3.91Å; F51-I155 HydrophobicContact CZ-CG2 3.37Å; V137-I155 WeakPolarHBondContact CA-O 3.47Å; A138-I155 HydrophobicContact CB-CG2 3.97Å; A138-I155 PolarHBondContact N-O 3.09Å; A138-I155 PolarHBondContact O-N 3.33Å
156	E	80.6	Confident	80.3	Confident	123 Å²	123	59.9 Å²	59.9	58%	0.575	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.1	128.4	176.1	-173.9	173.5	-173	0	0	109.1	T135 Y136 V137	T135-E156 HydrophobicContact CG2-CG 3.41Å; T135-E156 VanDerWaalsContact CG2-CG 3.41Å; T135-E156 WeakPolarHBondContact CG2-OE1 3.34Å; Y136-E156 WeakPolarHBondContact O-CA 3.37Å; V137-E156 HydrophobicContact CG2-CB 4.45Å; V137-E156 HydrophobicContact CG2-CG 4.19Å
157	Q	79.5	Confident	81.6	Confident	64 Å²	64	53 Å²	53	30%	0.299	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	134.6	-178.5	-170.1	66.7	16.3	0	0	110.2	L59 Y136	L59-Q157 HydrophobicContact CD1-CG 4.25Å; L59-Q157 HydrophobicContact CD2-CG 4.33Å; Y136-Q157 PolarHBondContact N-O 3.12Å; Y136-Q157 PolarHBondContact O-N 3.07Å
158	N	82.9	Confident	83	Confident	25 Å²	25	55.7 Å²	55.7	13%	0.134	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	137.6	175.7	-68.3	-19.2	0	0	0	110.5	A134 T135 Q239 I241	A134-N158 WeakPolarHBondContact O-CA 3.22Å; T135-N158 VanDerWaalsContact CB-OD1 3.25Å; T135-N158 WeakPolarHBondContact CB-OD1 3.38Å; T135-N158 WeakPolarHBondContact CG2-OD1 3.39Å; T135-N158 PolarHBondContact OG1-OD1 3.45Å; N158-Q239 WeakPolarHBondContact ND2-CB 3.12Å; N158-Q239 PolarHBondContact ND2-OE1 2.92Å; N158-I241 HydrophobicContact CB-CD1 3.47Å; N158-I241 VanDerWaalsContact CB-CD1 3.47Å; N158-I241 HydrophobicContact CB-CG1 4.3Å; N158-I241 WeakPolarHBondContact O-CD1 3.42Å
159	T	83.7	Confident	84.5	Confident	2 Å²	2	51.9 Å²	51.9	1%	0.012	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-79.8	144.9	169.6	50.4	0	0	0	0	110.9	L59 L130 N131 S133 A134 Y136	L59-T159 HydrophobicContact CD1-CG2 4.43Å; L130-T159 HydrophobicContact CB-CG2 4.06Å; L130-T159 HydrophobicContact CD1-CG2 4.04Å; N131-T159 WeakPolarHBondContact O-CB 3.44Å; N131-T159 PolarHBondContact O-OG1 3.42Å; S133-T159 PolarHBondContact N-OG1 2.63Å; A134-T159 PolarHBondContact N-OG1 3.12Å; A134-T159 PolarHBondContact O-N 2.95Å; A134-T159 PolarHBondContact O-OG1 3.24Å; A134-T159 VanDerWaalsContact O-OG1 3.08Å; Y136-T159 HydrophobicContact CD2-CG2 3.71Å; Y136-T159 HydrophobicContact CE2-CG2 3.65Å
160	P	86.4	Confident	85.7	Confident	5 Å²	5	54.3 Å²	54.3	3%	0.032	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-60	151.9	176.3	-21.8	34	0	0	0	112.4	S133 I241	S133-P160 PolarHBondContact N-O 3.49Å; P160-I241 HydrophobicContact CB-CG2 4.12Å; P160-I241 HydrophobicContact CG-CG2 4.07Å
161	P	89.2	Confident	86.6	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-74.9	157.9	168	31.6	-33.1	0	0	0	111.4	S133 F191 T236 I241 S243	S133-P161 VanDerWaalsContact OG-CA 3.31Å; S133-P161 WeakPolarHBondContact OG-CA 3.42Å; S133-P161 WeakPolarHBondContact OG-CB 3.44Å; P161-F191 HydrophobicContact CB-CB 3.94Å; P161-F191 HydrophobicContact CG-CB 4.4Å; P161-T236 VanDerWaalsContact CG-O 3.23Å; P161-T236 WeakPolarHBondContact CG-O 3.34Å; P161-T236 WeakPolarHBondContact CG-OG1 3.15Å; P161-I241 WeakPolarHBondContact CD-O 3.25Å; P161-S243 WeakPolarHBondContact O-CA 3.37Å; P161-S243 WeakPolarHBondContact O-CB 3.46Å
162	L	89.1	Confident	87.8	Confident	57 Å²	57	57.5 Å²	57.5	30%	0.298	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-83.4	151.5	170.5	-62.3	176.6	0	0	0	111.6	E56 P132 T236	E56-L162 HydrophobicContact CB-CD2 4.34Å; E56-L162 WeakPolarHBondContact OE2-CD2 3.31Å; P132-L162 HydrophobicContact CB-CD1 4.25Å; P132-L162 HydrophobicContact CB-CD2 4.26Å; P132-L162 HydrophobicContact CB-CG 3.72Å; P132-L162 HydrophobicContact CG-CD1 3.77Å; P132-L162 HydrophobicContact CG-CG 3.83Å; L162-T236 PolarHBondContact O-OG1 3.43Å; L162-T236 VanDerWaalsContact O-OG1 3.05Å
163	I	91.3	Very high	88.8	Confident	28 Å²	28	56.3 Å²	56.3	14%	0.144	29%	0.288	C	S	.	.			trans	-130.6	129.2	170.9	-172.9	165.4	0	0	0	111.3	L234 T236 E244 V246	I163-L234 HydrophobicContact CD1-CB 4.34Å; I163-L234 HydrophobicContact CD1-CD2 4.02Å; I163-L234 HydrophobicContact CD1-CG 3.76Å; I163-T236 HydrophobicContact CB-CG2 4.18Å; I163-T236 HydrophobicContact CD1-CG2 4.26Å; I163-T236 HydrophobicContact CG1-CG2 4.18Å; I163-E244 VanDerWaalsContact CG2-O 3.28Å; I163-E244 WeakPolarHBondContact CG2-O 3.33Å; I163-V246 HydrophobicContact CB-CG2 4.48Å; I163-V246 HydrophobicContact CD1-CB 4.45Å; I163-V246 HydrophobicContact CD1-CG2 3.73Å; I163-V246 HydrophobicContact CG1-CG2 3.78Å; I163-V246 HydrophobicContact CG2-CG2 3.92Å
164	S	90.9	Very high	89.6	Confident	52 Å²	52	56.8 Å²	56.8	36%	0.364	29%	0.286	S	S	.	.			trans	-123.8	9.9	174	66.6	0	0	0	0	112.9	D185	S164-D185 WeakPolarHBondContact CB-OD2 3.42Å; S164-D185 VanDerWaalsContact OG-CG 3.31Å; S164-D185 PolarHBondContact OG-N 2.92Å; S164-D185 PolarHBondContact OG-OD2 3.46Å
165	S	92.2	Very high	90.4	Very high	5 Å²	5	57.8 Å²	57.8	4%	0.035	29%	0.286	C	S	.	.			trans	-63.5	147.6	177.1	-68.2	0	0	0	0	112.5	T182 T184 V246	S165-T182 WeakPolarHBondContact CB-O 3.37Å; S165-T182 PolarHBondContact OG-O 3.24Å; S165-T184 PolarHBondContact OG-OG1 2.93Å; S165-V246 WeakPolarHBondContact O-CG2 3.45Å
166	V	93.8	Very high	91.4	Very high	77 Å²	77	56.4 Å²	56.4	47%	0.467	28%	0.281	S	S	.	.			trans	-110.2	137.5	171.5	-178.8	0	0	0	0	108.9	E168 F181 T182	V166-E168 HydrophobicContact CG1-CG 4.4Å; V166-F181 WeakPolarHBondContact O-CA 3.08Å; V166-F181 WeakPolarHBondContact O-CB 3.4Å; V166-T182 HydrophobicContact CB-CG2 4.38Å; V166-T182 PolarHBondContact N-OG1 3.39Å; V166-T182 PolarHBondContact O-N 2.97Å; V166-T182 VanDerWaalsContact O-N 3.13Å
167	L	96.2	Very high	92.1	Very high	11 Å²	11	50.6 Å²	50.6	6%	0.058	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	129.3	178.2	-79.1	168.7	0	0	0	111.2	I179 F181 L196 L234 V246 Q248 F250	L167-I179 HydrophobicContact CD2-CG2 3.79Å; L167-F181 HydrophobicContact CD2-CB 4.1Å; L167-L196 HydrophobicContact CD2-CD1 3.63Å; L167-L234 HydrophobicContact CD1-CB 3.99Å; L167-L234 HydrophobicContact CD2-CB 4.07Å; L167-L234 HydrophobicContact CD2-CD2 4.15Å; L167-L234 HydrophobicContact CG-CB 4.17Å; L167-L234 HydrophobicContact CG-CD2 4.39Å; L167-V246 HydrophobicContact CD1-CB 4.49Å; L167-V246 HydrophobicContact CD1-CG1 4.12Å; L167-V246 WeakPolarHBondContact CD1-O 3.3Å; L167-V246 HydrophobicContact CG-CG1 4.27Å; L167-Q248 HydrophobicContact CB-CB 3.97Å; L167-Q248 HydrophobicContact CD1-CB 4.07Å; L167-F250 HydrophobicContact CB-CZ 4.2Å
168	E	95.5	Very high	93	Very high	113 Å²	113	49.1 Å²	49.1	53%	0.528	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	151.6	178	-65.9	-178.1	173.9	0	0	111.5	V166 I179 T180	V166-E168 HydrophobicContact CG1-CG 4.4Å; E168-I179 WeakPolarHBondContact O-CA 3.24Å; E168-T180 HydrophobicContact CB-CG2 4.06Å; E168-T180 PolarHBondContact N-O 3.15Å; E168-T180 PolarHBondContact O-N 3.24Å; E168-T180 VanDerWaalsContact O-O 3.1Å
169	A	94.5	Very high	93.6	Very high	39 Å²	39	48 Å²	48	32%	0.322	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	109.8	172.7	0	0	0	0	0	110	I172 F250	A169-I172 HydrophobicContact CB-CD1 3.82Å; A169-I172 HydrophobicContact CB-CG1 3.73Å; A169-F250 HydrophobicContact CB-CD1 3.68Å; A169-F250 HydrophobicContact CB-CE1 3.64Å
170	E	95.5	Very high	94.2	Very high	115 Å²	115	49.4 Å²	49.4	54%	0.537	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	-37.9	175.6	-174.9	-175.2	157.5	0	0	111.3	L178 T180 S218	E170-L178 HydrophobicContact CB-CD2 4.05Å; E170-L178 HydrophobicContact CB-CG 4.08Å; E170-L178 HydrophobicContact CG-CD2 3.95Å; E170-L178 HydrophobicContact CG-CG 4.5Å; E170-L178 PolarHBondContact N-O 3.36Å; E170-T180 HydrophobicContact CB-CG2 4.12Å; E170-S218 VanDerWaalsContact OE2-CB 3.28Å; E170-S218 WeakPolarHBondContact OE2-CB 3.29Å; E170-S218 PolarHBondContact OE2-OG 3.22Å
171	R	96.7	Very high	94.6	Very high	170 Å²	170	49.4 Å²	49.4	64%	0.642	25%	0.25	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-150.5	132	175.7	-174.2	178.2	177.8	179.5	1.8	111.7	L178	R171-L178 HydrophobicContact CB-CB 3.92Å; R171-L178 HydrophobicContact CB-CD2 4.12Å; R171-L178 PolarHBondContact N-O 3.33Å; R171-L178 PolarHBondContact O-N 2.85Å
172	I	96.9	Very high	94.7	Very high	45 Å²	45	52.1 Å²	52.1	23%	0.231	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	136.2	176.9	-55.6	177.1	0	0	0	108.6	A169 L177 T251 Y253 L330	A169-I172 HydrophobicContact CB-CD1 3.82Å; A169-I172 HydrophobicContact CB-CG1 3.73Å; I172-L177 HydrophobicContact CB-CD2 4.28Å; I172-L177 HydrophobicContact CG1-CD2 3.99Å; I172-L177 HydrophobicContact CG2-CD2 3.85Å; I172-T251 VanDerWaalsContact CG2-O 3.3Å; I172-T251 WeakPolarHBondContact CG2-O 3.32Å; I172-Y253 HydrophobicContact CB-CD2 4.22Å; I172-Y253 HydrophobicContact CB-CE2 4.06Å; I172-Y253 HydrophobicContact CG2-CD2 3.78Å; I172-Y253 HydrophobicContact CG2-CE2 4.08Å; I172-Y253 WeakPolarHBondContact O-CE2 3.46Å; I172-L330 HydrophobicContact CG2-CD1 4.06Å
173	T	97	Very high	94.8	Very high	38 Å²	38	53.3 Å²	53.3	23%	0.233	28%	0.278	C	S	.	.			trans	-130.8	179.2	168.9	83.4	0	0	0	0	110.2	K175 S176 Y253	T173-K175 PolarHBondContact O-N 3.34Å; T173-K175 PolarHBondContact OG1-N 2.97Å; T173-S176 WeakPolarHBondContact CG2-OG 3.19Å; T173-S176 PolarHBondContact N-O 2.95Å; T173-S176 PolarHBondContact OG1-N 2.87Å; T173-S176 PolarHBondContact OG1-O 3.36Å; T173-S176 PolarHBondContact OG1-OG 3.31Å; T173-Y253 PolarHBondContact O-N 3.37Å
174	K	95.4	Very high	94.8	Very high	65 Å²	65	52.8 Å²	52.8	28%	0.283	28%	0.276	S	S	.	.	S	Bend	trans	-62.3	-23.2	175	-60.8	-178.7	-178.4	-178.2	0	113.7	E225 P226 D255 D333	K174-E225 CarbonylContact O-C 3.56Å; K174-P226 HydrophobicContact CB-CB 4.31Å; K174-P226 HydrophobicContact CB-CG 4.25Å; K174-P226 WeakPolarHBondContact O-CA 3.16Å; K174-P226 WeakPolarHBondContact O-CG 3.39Å; K174-D255 IonicContact NZ-OD1 3.8Å; K174-D255 PolarHBondContact NZ-OD1 2.91Å; K174-D333 IonicContact NZ-OD2 3.28Å; K174-D333 PolarHBondContact NZ-OD2 2.85Å
175	K	95.5	Very high	94.3	Very high	130 Å²	130	55.2 Å²	55.2	57%	0.565	29%	0.285	S	S	*	.	S	Bend	trans	-138.8	9.8	-173	-59.4	-169.3	177.5	-178.9	0	114.4	T173 G223 L224	T173-K175 PolarHBondContact O-N 3.34Å; T173-K175 PolarHBondContact OG1-N 2.97Å; K175-G223 PolarHBondContact O-N 3.41Å; K175-L224 WeakPolarHBondContact CA-O 3.42Å; K175-L224 WeakPolarHBondContact CB-O 3.4Å; K175-L224 WeakPolarHBondContact CG-O 3.39Å; K175-L224 PolarHBondContact O-N 3.45Å
176	S	96	Very high	93.1	Very high	21 Å²	21	59 Å²	59	15%	0.147	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	147.2	-179.2	72.3	0	0	0	0	112.8	T173 F221	T173-S176 WeakPolarHBondContact CG2-OG 3.19Å; T173-S176 PolarHBondContact N-O 2.95Å; T173-S176 PolarHBondContact OG1-N 2.87Å; T173-S176 PolarHBondContact OG1-O 3.36Å; T173-S176 PolarHBondContact OG1-OG 3.31Å; S176-F221 CarbonylContact C-O 3.49Å; S176-F221 WeakPolarHBondContact CA-O 3.31Å; S176-F221 WeakPolarHBondContact CB-O 3.42Å
177	L	97.2	Very high	91.7	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	122.7	172.9	-68.2	170.8	0	0	0	108.8	I172 I179 L198 L220 F221 L224 Y230 F250 T252	I172-L177 HydrophobicContact CB-CD2 4.28Å; I172-L177 HydrophobicContact CG1-CD2 3.99Å; I172-L177 HydrophobicContact CG2-CD2 3.85Å; L177-I179 HydrophobicContact CB-CD1 4.32Å; L177-I179 HydrophobicContact CB-CG1 4.09Å; L177-L198 HydrophobicContact CD1-CD1 4.46Å; L177-L198 HydrophobicContact CD1-CD2 4.44Å; L177-L220 WeakPolarHBondContact O-CA 3.3Å; L177-F221 PolarHBondContact N-O 3.37Å; L177-F221 PolarHBondContact O-N 2.85Å; L177-L224 HydrophobicContact CB-CD1 4.07Å; L177-L224 HydrophobicContact CD1-CD1 3.66Å; L177-L224 HydrophobicContact CG-CD1 3.6Å; L177-Y230 HydrophobicContact CD1-CD2 4.01Å; L177-Y230 HydrophobicContact CD1-CG 4.37Å; L177-F250 HydrophobicContact CD1-CB 3.8Å; L177-F250 HydrophobicContact CD2-CB 4.17Å; L177-T252 HydrophobicContact CD1-CG2 4.33Å; L177-T252 HydrophobicContact CD2-CG2 4.08Å; L177-T252 HydrophobicContact CG-CG2 4.03Å
178	L	96.6	Very high	89.9	Confident	34 Å²	34	63.8 Å²	63.8	18%	0.178	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	103.2	166.8	-176.2	65.9	0	0	0	107.4	E170 R171 I219 L220	E170-L178 HydrophobicContact CB-CD2 4.05Å; E170-L178 HydrophobicContact CB-CG 4.08Å; E170-L178 HydrophobicContact CG-CD2 3.95Å; E170-L178 HydrophobicContact CG-CG 4.5Å; E170-L178 PolarHBondContact N-O 3.36Å; R171-L178 HydrophobicContact CB-CB 3.92Å; R171-L178 HydrophobicContact CB-CD2 4.12Å; R171-L178 PolarHBondContact N-O 3.33Å; R171-L178 PolarHBondContact O-N 2.85Å; L178-I219 WeakPolarHBondContact CA-O 3.36Å; L178-L220 HydrophobicContact CB-CD1 4.18Å; L178-L220 HydrophobicContact CD1-CB 3.9Å; L178-L220 HydrophobicContact CD1-CD1 4.39Å
179	I	96.6	Very high	88.4	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	132.6	-176.5	-58.9	178.1	0	0	0	108.2	L167 E168 L177 L196 L198 S218 I219 F221 C232 F250	L167-I179 HydrophobicContact CD2-CG2 3.79Å; E168-I179 WeakPolarHBondContact O-CA 3.24Å; L177-I179 HydrophobicContact CB-CD1 4.32Å; L177-I179 HydrophobicContact CB-CG1 4.09Å; I179-L196 HydrophobicContact CB-CD2 4.42Å; I179-L196 HydrophobicContact CG2-CD2 4.34Å; I179-L198 HydrophobicContact CD1-CD1 4.11Å; I179-S218 CarbonylContact O-C 3.55Å; I179-S218 VanDerWaalsContact O-CA 3.27Å; I179-S218 WeakPolarHBondContact O-CA 3.28Å; I179-I219 PolarHBondContact N-O 2.98Å; I179-I219 PolarHBondContact O-N 3.32Å; I179-F221 HydrophobicContact CD1-CD2 3.95Å; I179-F221 HydrophobicContact CD1-CE2 3.87Å; I179-F221 HydrophobicContact CG1-CD2 4.36Å; I179-F221 HydrophobicContact CG1-CE2 4.43Å; I179-C232 HydrophobicContact CD1-CB 4.15Å; I179-F250 HydrophobicContact CD1-CD2 3.66Å; I179-F250 HydrophobicContact CD1-CE2 3.75Å; I179-F250 HydrophobicContact CG1-CD2 4.24Å; I179-F250 HydrophobicContact CG1-CE2 4.13Å; I179-F250 HydrophobicContact CG2-CE2 4.03Å; I179-F250 HydrophobicContact CG2-CZ 4.24Å
180	T	95.6	Very high	87.7	Confident	32 Å²	32	61.9 Å²	61.9	20%	0.196	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	159.1	174.6	-168.6	0	0	0	0	109.9	E168 E170	E168-T180 HydrophobicContact CB-CG2 4.06Å; E168-T180 PolarHBondContact N-O 3.15Å; E168-T180 PolarHBondContact O-N 3.24Å; E168-T180 VanDerWaalsContact O-O 3.1Å; E170-T180 HydrophobicContact CB-CG2 4.12Å
181	F	94.9	Very high	87.4	Confident	6 Å²	6	56.8 Å²	56.8	3%	0.026	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	147.1	178.2	58.7	-88.5	0	0	0	112.5	V166 L167 Y194 R217 I219 L234	V166-F181 WeakPolarHBondContact O-CA 3.08Å; V166-F181 WeakPolarHBondContact O-CB 3.4Å; L167-F181 HydrophobicContact CD2-CB 4.1Å; F181-Y194 HydrophobicContact CD2-CD1 4.43Å; F181-Y194 HydrophobicContact CD2-CE1 4.45Å; F181-Y194 AromaticContact CE2-CD1 3.82Å; F181-Y194 HydrophobicContact CE2-CD1 3.82Å; F181-Y194 AromaticContact CE2-CD2 3.7Å; F181-Y194 HydrophobicContact CE2-CD2 3.7Å; F181-Y194 HydrophobicContact CE2-CE1 4.06Å; F181-Y194 AromaticContact CE2-CE2 3.94Å; F181-Y194 HydrophobicContact CE2-CE2 3.94Å; F181-Y194 AromaticContact CE2-CG 3.62Å; F181-Y194 HydrophobicContact CE2-CG 3.62Å; F181-Y194 HydrophobicContact CZ-CD1 4.47Å; F181-Y194 HydrophobicContact CZ-CD2 4.09Å; F181-Y194 AromaticContact CZ-CG 3.94Å; F181-Y194 HydrophobicContact CZ-CG 3.94Å; F181-R217 WeakPolarHBondContact CD1-O 3.31Å; F181-R217 WeakPolarHBondContact CE1-O 3.49Å; F181-R217 WeakPolarHBondContact O-CB 3.44Å; F181-I219 HydrophobicContact CE1-CD1 4.22Å; F181-L234 HydrophobicContact CB-CD2 3.73Å; F181-L234 HydrophobicContact CD1-CD1 4.42Å; F181-L234 HydrophobicContact CD1-CD2 4.38Å; F181-L234 HydrophobicContact CD2-CD2 3.81Å; F181-L234 HydrophobicContact CE1-CD1 4.43Å; F181-L234 HydrophobicContact CG-CD1 4.46Å; F181-L234 HydrophobicContact CG-CD2 3.73Å; F181-L234 HydrophobicContact CZ-CD1 4.48Å
182	T	92.6	Very high	87.1	Confident	57 Å²	57	52.8 Å²	52.8	35%	0.35	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-73.2	150.4	176.4	60.6	0	0	0	0	111.3	S165 V166	S165-T182 WeakPolarHBondContact CB-O 3.37Å; S165-T182 PolarHBondContact OG-O 3.24Å; V166-T182 HydrophobicContact CB-CG2 4.38Å; V166-T182 PolarHBondContact N-OG1 3.39Å; V166-T182 PolarHBondContact O-N 2.97Å; V166-T182 VanDerWaalsContact O-N 3.13Å
183	P	90.4	Very high	86.9	Confident	81 Å²	81	53.9 Å²	53.9	53%	0.526	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-63.3	145.1	173	28	-34.1	0	0	0	110.9
184	T	90.1	Very high	86.8	Confident	17 Å²	17	52.3 Å²	52.3	10%	0.104	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-71.1	138.5	169.9	-53.6	0	0	0	0	109.1	S165 A189 Y194	S165-T184 PolarHBondContact OG-OG1 2.93Å; T184-A189 HydrophobicContact CG2-CB 3.62Å; T184-Y194 VanDerWaalsContact CB-OH 3.3Å; T184-Y194 WeakPolarHBondContact CB-OH 3.26Å; T184-Y194 PolarHBondContact N-OH 3.04Å; T184-Y194 WeakPolarHBondContact OG1-CE1 3.25Å; T184-Y194 PolarHBondContact OG1-OH 3.49Å
185	D	82.1	Confident	86.8	Confident	103 Å²	103	49.7 Å²	49.7	55%	0.551	28%	0.281	S	S	*	.	P	Polyproline II helix	trans	-60.2	150	-177.1	-60.3	-53.6	0	0	0	112.8	S164 D187 A189	S164-D185 WeakPolarHBondContact CB-OD2 3.42Å; S164-D185 VanDerWaalsContact OG-CG 3.31Å; S164-D185 PolarHBondContact OG-N 2.92Å; S164-D185 PolarHBondContact OG-OD2 3.46Å; D185-D187 VanDerWaalsContact C-N 3.29Å; D185-D187 PolarHBondContact O-N 3.15Å; D185-A189 WeakPolarHBondContact O-CB 3.43Å
186	A	66.4	Low	86.7	Confident	86 Å²	86	43.6 Å²	43.6	71%	0.711	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-67	-29.2	-174.3	0	0	0	0	0	113.3	G188	A186-G188 PolarHBondContact O-N 2.99Å
187	D	63.9	Low	86.7	Confident	169 Å²	169	44 Å²	44	90%	0.904	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-72.5	-8.6	-170.3	-65.7	-24.4	0	0	0	114.1	D185	D185-D187 VanDerWaalsContact C-N 3.29Å; D185-D187 PolarHBondContact O-N 3.15Å
188	G	59.6	Low	86.6	Confident	18 Å²	18	44 Å²	44	19%	0.186	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-130.2	1.1	-173.6	0	0	0	0	0	117.9	A186	A186-G188 PolarHBondContact O-N 2.99Å
189	A	62.6	Low	86.5	Confident	5 Å²	5	46.1 Å²	46.1	4%	0.041	27%	0.265	C	S	.	.			trans	-135.7	65.5	-147.7	0	0	0	0	0	115.8	T184 D185 F191 R212	T184-A189 HydrophobicContact CG2-CB 3.62Å; D185-A189 WeakPolarHBondContact O-CB 3.43Å; A189-F191 HydrophobicContact CB-CD1 3.55Å; A189-F191 HydrophobicContact CB-CE1 3.5Å; A189-F191 VanDerWaalsContact CB-CE1 3.5Å; A189-F191 WeakPolarHBondContact O-CD1 3.46Å; A189-F191 PolarHBondContact O-N 2.91Å; A189-R212 PolarHBondContact O-NH1 3.27Å; A189-R212 PolarHBondContact O-NH2 2.78Å
190	I	79.9	Confident	86.1	Confident	107 Å²	107	49.5 Å²	49.5	55%	0.549	28%	0.282	S	S	.	.			trans	-75.6	103.8	158.7	-56.4	176.7	0	0	0	107.3	S133 Y238	S133-I190 WeakPolarHBondContact CB-O 3.17Å; S133-I190 PolarHBondContact OG-O 3.48Å; I190-Y238 HydrophobicContact CG2-CD2 4.03Å; I190-Y238 HydrophobicContact CG2-CE2 3.68Å; I190-Y238 WeakPolarHBondContact O-CD2 3.42Å
191	F	89.4	Confident	85.4	Confident	8 Å²	8	50.7 Å²	50.7	4%	0.035	29%	0.292	C	S	.	.			trans	-148.8	160.2	175.2	67.1	-86.6	0	0	0	110.1	P161 A189 K193 Y194 R212 T236 V237	P161-F191 HydrophobicContact CB-CB 3.94Å; P161-F191 HydrophobicContact CG-CB 4.4Å; A189-F191 HydrophobicContact CB-CD1 3.55Å; A189-F191 HydrophobicContact CB-CE1 3.5Å; A189-F191 VanDerWaalsContact CB-CE1 3.5Å; A189-F191 WeakPolarHBondContact O-CD1 3.46Å; A189-F191 PolarHBondContact O-N 2.91Å; F191-K193 WeakPolarHBondContact CD2-O 3.38Å; F191-Y194 HydrophobicContact CE2-CD1 4.38Å; F191-Y194 AromaticContact CE2-CD2 3.86Å; F191-Y194 HydrophobicContact CE2-CD2 3.86Å; F191-Y194 HydrophobicContact CE2-CE1 4.05Å; F191-Y194 AromaticContact CE2-CE2 3.47Å; F191-Y194 HydrophobicContact CE2-CE2 3.47Å; F191-Y194 VanDerWaalsContact CE2-CE2 3.47Å; F191-Y194 HydrophobicContact CE2-CG 4.31Å; F191-Y194 AromaticContact CE2-CZ 3.58Å; F191-Y194 HydrophobicContact CZ-CD2 4.42Å; F191-Y194 HydrophobicContact CZ-CE1 4.07Å; F191-Y194 AromaticContact CZ-CE2 3.58Å; F191-Y194 HydrophobicContact CZ-CE2 3.58Å; F191-Y194 AromaticContact CZ-CZ 3.37Å; F191-Y194 VanDerWaalsContact CZ-OH 3.24Å; F191-Y194 WeakPolarHBondContact CZ-OH 3.25Å; F191-R212 HydrophobicContact CD2-CB 4.22Å; F191-R212 HydrophobicContact CD2-CG 4.38Å; F191-R212 HydrophobicContact CE1-CG 4.17Å; F191-R212 HydrophobicContact CE2-CB 3.69Å; F191-R212 HydrophobicContact CE2-CG 3.68Å; F191-R212 HydrophobicContact CZ-CB 4.11Å; F191-R212 HydrophobicContact CZ-CG 3.54Å; F191-R212 WeakPolarHBondContact O-CD 3.44Å; F191-T236 HydrophobicContact CD1-CG2 3.99Å; F191-T236 HydrophobicContact CD2-CG2 3.85Å; F191-T236 HydrophobicContact CE1-CG2 4.06Å; F191-T236 HydrophobicContact CE2-CG2 3.9Å; F191-T236 HydrophobicContact CG-CG2 3.91Å; F191-T236 HydrophobicContact CZ-CG2 4.02Å; F191-V237 WeakPolarHBondContact CB-O 3.4Å
192	D	90.5	Very high	84.6	Confident	87 Å²	87	59.7 Å²	59.7	47%	0.465	33%	0.334	S	S	.	.	S	Bend	trans	-89.3	-44.7	-172.4	-53.6	-38.6	0	0	0	111.3	R212 V237 Q239	D192-R212 PolarHBondContact O-N 3.32Å; D192-R212 VanDerWaalsContact O-N 3.14Å; D192-V237 PolarHBondContact N-O 3.09Å; D192-Q239 PolarHBondContact OD2-N 3.4Å
193	K	93.1	Very high	83.8	Confident	68 Å²	68	66.7 Å²	66.7	30%	0.296	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	161.9	-172.1	62.6	174.7	-178.5	140.4	0	112.8	F191 D195 S209 K210 V237	F191-K193 WeakPolarHBondContact CD2-O 3.38Å; K193-D195 WeakPolarHBondContact CD-OD1 3.39Å; K193-D195 VanDerWaalsContact CE-OD1 3.32Å; K193-D195 WeakPolarHBondContact CE-OD1 3.34Å; K193-D195 VanDerWaalsContact NZ-CG 3.34Å; K193-D195 IonicContact NZ-OD1 2.95Å; K193-D195 PolarHBondContact NZ-OD1 3.45Å; K193-D195 IonicContact NZ-OD2 3.83Å; K193-D195 PolarHBondContact NZ-OD2 3.33Å; K193-D195 VanDerWaalsContact NZ-OD2 3.07Å; K193-S209 PolarHBondContact NZ-OG 2.85Å; K193-K210 CarbonylContact C-O 3.6Å; K193-K210 WeakPolarHBondContact CA-O 3.48Å; K193-K210 WeakPolarHBondContact CB-O 3.24Å; K193-V237 HydrophobicContact CG-CB 3.85Å; K193-V237 HydrophobicContact CG-CG2 4.15Å; K193-V237 PolarHBondContact N-O 3.46Å; K193-V237 PolarHBondContact O-N 3.43Å
194	Y	94.3	Very high	83.4	Confident	5 Å²	5	64.8 Å²	64.8	2%	0.02	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	136	162.5	-68.3	-79.5	0	0	0	109.7	F181 T184 F191 S209 K210 L234 Y235 T236	F181-Y194 HydrophobicContact CD2-CD1 4.43Å; F181-Y194 HydrophobicContact CD2-CE1 4.45Å; F181-Y194 AromaticContact CE2-CD1 3.82Å; F181-Y194 HydrophobicContact CE2-CD1 3.82Å; F181-Y194 AromaticContact CE2-CD2 3.7Å; F181-Y194 HydrophobicContact CE2-CD2 3.7Å; F181-Y194 HydrophobicContact CE2-CE1 4.06Å; F181-Y194 AromaticContact CE2-CE2 3.94Å; F181-Y194 HydrophobicContact CE2-CE2 3.94Å; F181-Y194 AromaticContact CE2-CG 3.62Å; F181-Y194 HydrophobicContact CE2-CG 3.62Å; F181-Y194 HydrophobicContact CZ-CD1 4.47Å; F181-Y194 HydrophobicContact CZ-CD2 4.09Å; F181-Y194 AromaticContact CZ-CG 3.94Å; F181-Y194 HydrophobicContact CZ-CG 3.94Å; T184-Y194 VanDerWaalsContact CB-OH 3.3Å; T184-Y194 WeakPolarHBondContact CB-OH 3.26Å; T184-Y194 PolarHBondContact N-OH 3.04Å; T184-Y194 WeakPolarHBondContact OG1-CE1 3.25Å; T184-Y194 PolarHBondContact OG1-OH 3.49Å; F191-Y194 HydrophobicContact CE2-CD1 4.38Å; F191-Y194 AromaticContact CE2-CD2 3.86Å; F191-Y194 HydrophobicContact CE2-CD2 3.86Å; F191-Y194 HydrophobicContact CE2-CE1 4.05Å; F191-Y194 AromaticContact CE2-CE2 3.47Å; F191-Y194 HydrophobicContact CE2-CE2 3.47Å; F191-Y194 VanDerWaalsContact CE2-CE2 3.47Å; F191-Y194 HydrophobicContact CE2-CG 4.31Å; F191-Y194 AromaticContact CE2-CZ 3.58Å; F191-Y194 HydrophobicContact CZ-CD2 4.42Å; F191-Y194 HydrophobicContact CZ-CE1 4.07Å; F191-Y194 AromaticContact CZ-CE2 3.58Å; F191-Y194 HydrophobicContact CZ-CE2 3.58Å; F191-Y194 AromaticContact CZ-CZ 3.37Å; F191-Y194 VanDerWaalsContact CZ-OH 3.24Å; F191-Y194 WeakPolarHBondContact CZ-OH 3.25Å; Y194-S209 CarbonylContact O-C 3.6Å; Y194-S209 WeakPolarHBondContact O-CA 3.38Å; Y194-K210 PolarHBondContact N-O 3.23Å; Y194-K210 PolarHBondContact O-N 3.34Å; Y194-L234 HydrophobicContact CD1-CD1 4.01Å; Y194-L234 HydrophobicContact CD1-CG 4.41Å; Y194-L234 HydrophobicContact CG-CD1 4.47Å; Y194-Y235 CarbonylContact C-O 3.43Å; Y194-Y235 VanDerWaalsContact CA-O 3.26Å; Y194-Y235 WeakPolarHBondContact CA-O 3.37Å; Y194-T236 HydrophobicContact CD1-CG2 3.86Å; Y194-T236 HydrophobicContact CE1-CG2 3.51Å
195	D	94.6	Very high	83.3	Confident	10 Å²	10	68.7 Å²	68.7	5%	0.053	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	116.1	167.9	-80.9	0.4	0	0	0	108.3	K193 S209 Y235 V237 R242	K193-D195 WeakPolarHBondContact CD-OD1 3.39Å; K193-D195 VanDerWaalsContact CE-OD1 3.32Å; K193-D195 WeakPolarHBondContact CE-OD1 3.34Å; K193-D195 VanDerWaalsContact NZ-CG 3.34Å; K193-D195 IonicContact NZ-OD1 2.95Å; K193-D195 PolarHBondContact NZ-OD1 3.45Å; K193-D195 IonicContact NZ-OD2 3.83Å; K193-D195 PolarHBondContact NZ-OD2 3.33Å; K193-D195 VanDerWaalsContact NZ-OD2 3.07Å; D195-S209 VanDerWaalsContact OD1-CB 3.31Å; D195-S209 WeakPolarHBondContact OD1-CB 3.41Å; D195-S209 PolarHBondContact OD1-OG 3.14Å; D195-Y235 PolarHBondContact N-O 3.24Å; D195-Y235 PolarHBondContact O-N 2.84Å; D195-V237 HydrophobicContact CB-CG2 4.05Å; D195-R242 IonicContact OD2-CZ 3.46Å; D195-R242 IonicContact OD2-NE 2.63Å; D195-R242 IonicContact OD2-NH2 2.78Å; D195-R242 PolarHBondContact OD2-NH2 3.06Å; D195-R242 VanDerWaalsContact OD2-NH2 3.16Å
196	L	95.4	Very high	83.7	Confident	1 Å²	1	65.2 Å²	65.2	1%	0.005	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	129.1	174.5	-170	80.6	0	0	0	109.1	L167 I179 S207 V208 I219 F221 C232 R233 L234	L167-L196 HydrophobicContact CD2-CD1 3.63Å; I179-L196 HydrophobicContact CB-CD2 4.42Å; I179-L196 HydrophobicContact CG2-CD2 4.34Å; L196-S207 CarbonylContact O-C 3.6Å; L196-S207 VanDerWaalsContact O-CA 3.3Å; L196-S207 WeakPolarHBondContact O-CA 3.28Å; L196-V208 PolarHBondContact N-O 3.48Å; L196-V208 PolarHBondContact O-N 2.85Å; L196-I219 HydrophobicContact CB-CD1 3.71Å; L196-I219 HydrophobicContact CD2-CB 3.88Å; L196-I219 HydrophobicContact CD2-CD1 3.5Å; L196-I219 VanDerWaalsContact CD2-CD1 3.5Å; L196-I219 HydrophobicContact CD2-CG1 4.23Å; L196-I219 HydrophobicContact CD2-CG2 4.11Å; L196-I219 HydrophobicContact CG-CD1 4.22Å; L196-F221 HydrophobicContact CD2-CE2 3.44Å; L196-F221 VanDerWaalsContact CD2-CE2 3.44Å; L196-F221 HydrophobicContact CD2-CZ 3.55Å; L196-F221 HydrophobicContact CG-CE2 4.41Å; L196-F221 HydrophobicContact CG-CZ 4.14Å; L196-C232 VanDerWaalsContact CD1-SG 3.56Å; L196-R233 CarbonylContact C-O 3.58Å; L196-R233 WeakPolarHBondContact CA-O 3.32Å; L196-L234 HydrophobicContact CB-CD1 4.24Å; L196-L234 HydrophobicContact CD1-CB 3.88Å; L196-L234 HydrophobicContact CD1-CD1 3.79Å; L196-L234 HydrophobicContact CD1-CG 4.36Å
197	E	94.7	Very high	84.9	Confident	29 Å²	29	64.8 Å²	64.8	14%	0.136	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	131.8	178.8	-59.6	-171.4	163	0	0	110.4	A206 C232 R233 Y235 R242	E197-A206 CarbonylContact C-O 3.6Å; E197-A206 WeakPolarHBondContact CA-O 3.28Å; E197-C232 CarbonylContact O-C 3.47Å; E197-C232 WeakPolarHBondContact O-CA 3.27Å; E197-R233 PolarHBondContact N-O 3.46Å; E197-R233 PolarHBondContact O-N 3.24Å; E197-Y235 HydrophobicContact CG-CE2 4.37Å; E197-R242 IonicContact OE1-CZ 3.16Å; E197-R242 IonicContact OE1-NH1 3.31Å; E197-R242 PolarHBondContact OE1-NH1 3.22Å; E197-R242 IonicContact OE1-NH2 3.07Å; E197-R242 PolarHBondContact OE1-NH2 3.37Å; E197-R242 IonicContact OE2-NH1 3.56Å
198	L	95.9	Very high	86.3	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	118.7	171.8	-168.8	75.2	0	0	0	108.8	L177 I179 I200 N205 A206 F221 L224 Y230 C232	L177-L198 HydrophobicContact CD1-CD1 4.46Å; L177-L198 HydrophobicContact CD1-CD2 4.44Å; I179-L198 HydrophobicContact CD1-CD1 4.11Å; L198-I200 PolarHBondContact O-N 2.87Å; L198-N205 WeakPolarHBondContact O-CA 3.49Å; L198-A206 PolarHBondContact N-O 3.25Å; L198-A206 PolarHBondContact O-N 3.17Å; L198-F221 HydrophobicContact CB-CD1 3.88Å; L198-F221 HydrophobicContact CB-CD2 4.49Å; L198-F221 HydrophobicContact CB-CE1 3.67Å; L198-F221 HydrophobicContact CB-CE2 4.3Å; L198-F221 HydrophobicContact CB-CG 4.28Å; L198-F221 HydrophobicContact CB-CZ 3.89Å; L198-F221 HydrophobicContact CD2-CB 3.73Å; L198-F221 HydrophobicContact CD2-CD1 3.86Å; L198-F221 HydrophobicContact CD2-CD2 4.06Å; L198-F221 HydrophobicContact CD2-CE1 4.48Å; L198-F221 HydrophobicContact CD2-CG 3.6Å; L198-L224 HydrophobicContact CD2-CD1 4.13Å; L198-L224 HydrophobicContact CD2-CD2 3.93Å; L198-Y230 HydrophobicContact CD2-CG 4.47Å; L198-C232 HydrophobicContact CD1-CB 3.86Å
199	L	94	Very high	87.9	Confident	79 Å²	79	61.4 Å²	61.4	41%	0.414	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	109.2	176.3	-171.9	66.4	0	0	0	109.2	S201 Y230 L231	L199-S201 VanDerWaalsContact CD1-O 3.29Å; L199-S201 WeakPolarHBondContact CD1-O 3.38Å; L199-Y230 WeakPolarHBondContact O-CD1 3.27Å; L199-L231 HydrophobicContact CB-CB 4.17Å; L199-L231 HydrophobicContact CD2-CB 4.48Å; L199-L231 HydrophobicContact CD2-CD2 4.38Å; L199-L231 PolarHBondContact N-O 2.82Å
200	I	88.3	Confident	89.3	Confident	71 Å²	71	63.3 Å²	63.3	36%	0.364	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	-42.1	-178.4	-61.3	172.3	0	0	0	110.2	L198 A204 A206 L224 Y230	L198-I200 PolarHBondContact O-N 2.87Å; I200-A204 WeakPolarHBondContact CA-O 3.39Å; I200-A204 HydrophobicContact CB-CB 4.44Å; I200-A204 WeakPolarHBondContact CB-O 3.28Å; I200-A204 PolarHBondContact N-O 3.11Å; I200-A206 HydrophobicContact CD1-CB 3.97Å; I200-L224 HydrophobicContact CD1-CD2 4.45Å; I200-L224 HydrophobicContact CG1-CD2 4.24Å; I200-Y230 HydrophobicContact CB-CE1 4.46Å; I200-Y230 HydrophobicContact CG2-CE1 4.2Å
201	S	81.9	Confident	89.9	Confident	57 Å²	57	66.3 Å²	66.3	40%	0.399	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	175.8	174.7	70.4	0	0	0	0	109.5	L199 K203 A204	L199-S201 VanDerWaalsContact CD1-O 3.29Å; L199-S201 WeakPolarHBondContact CD1-O 3.38Å; S201-K203 PolarHBondContact O-N 3.37Å; S201-K203 PolarHBondContact OG-N 2.98Å; S201-A204 PolarHBondContact N-O 3.35Å; S201-A204 PolarHBondContact O-N 3.43Å; S201-A204 VanDerWaalsContact O-O 3.11Å; S201-A204 WeakPolarHBondContact OG-CB 3.32Å; S201-A204 PolarHBondContact OG-N 2.95Å
202	E	77.3	Confident	89.7	Confident	195 Å²	195	71.2 Å²	71.2	91%	0.911	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-25.5	175	-63.1	-176.6	168.8	0	0	113.4
203	K	75.9	Confident	89.3	Confident	204 Å²	204	70.6 Å²	70.6	89%	0.887	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.2	-11.7	-176	-62.5	-176	-178.1	179	0	114.2	S201	S201-K203 PolarHBondContact O-N 3.37Å; S201-K203 PolarHBondContact OG-N 2.98Å
204	A	82.2	Confident	88.9	Confident	42 Å²	42	68.9 Å²	68.9	35%	0.347	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	122.7	-173.8	0	0	0	0	0	111	I200 S201	I200-A204 WeakPolarHBondContact CA-O 3.39Å; I200-A204 HydrophobicContact CB-CB 4.44Å; I200-A204 WeakPolarHBondContact CB-O 3.28Å; I200-A204 PolarHBondContact N-O 3.11Å; S201-A204 PolarHBondContact N-O 3.35Å; S201-A204 PolarHBondContact O-N 3.43Å; S201-A204 VanDerWaalsContact O-O 3.11Å; S201-A204 WeakPolarHBondContact OG-CB 3.32Å; S201-A204 PolarHBondContact OG-N 2.95Å
205	N	87.7	Confident	88.4	Confident	99 Å²	99	78.8 Å²	78.8	53%	0.529	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	147	169.8	58	-5.1	0	0	0	109.8	L198	L198-N205 WeakPolarHBondContact O-CA 3.49Å
206	A	90.9	Very high	88	Confident	29 Å²	29	81.1 Å²	81.1	24%	0.24	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	120.7	169.3	0	0	0	0	0	108.1	E197 L198 I200 F221	E197-A206 CarbonylContact C-O 3.6Å; E197-A206 WeakPolarHBondContact CA-O 3.28Å; L198-A206 PolarHBondContact N-O 3.25Å; L198-A206 PolarHBondContact O-N 3.17Å; I200-A206 HydrophobicContact CD1-CB 3.97Å; A206-F221 HydrophobicContact CB-CD1 3.78Å; A206-F221 HydrophobicContact CB-CE1 3.81Å
207	S	91.2	Very high	87.7	Confident	78 Å²	78	83.4 Å²	83.4	55%	0.545	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	139.8	178	60.8	0	0	0	0	111.1	L196	L196-S207 CarbonylContact O-C 3.6Å; L196-S207 VanDerWaalsContact O-CA 3.3Å; L196-S207 WeakPolarHBondContact O-CA 3.28Å
208	V	93.3	Very high	87.6	Confident	51 Å²	51	83.6 Å²	83.6	31%	0.309	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	128.3	179	179.1	0	0	0	0	109	L196 I219 F221	L196-V208 PolarHBondContact N-O 3.48Å; L196-V208 PolarHBondContact O-N 2.85Å; V208-I219 HydrophobicContact CB-CD1 4.05Å; V208-I219 HydrophobicContact CB-CG2 3.95Å; V208-I219 HydrophobicContact CG1-CD1 3.8Å; V208-I219 HydrophobicContact CG1-CG1 4.06Å; V208-I219 HydrophobicContact CG1-CG2 4Å; V208-I219 HydrophobicContact CG2-CG2 3.83Å; V208-F221 HydrophobicContact CG2-CE1 4.24Å
209	S	93.4	Very high	87.6	Confident	64 Å²	64	84 Å²	84	45%	0.448	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	140.9	176.3	-59.5	0	0	0	0	112.1	K193 Y194 D195	K193-S209 PolarHBondContact NZ-OG 2.85Å; Y194-S209 CarbonylContact O-C 3.6Å; Y194-S209 WeakPolarHBondContact O-CA 3.38Å; D195-S209 VanDerWaalsContact OD1-CB 3.31Å; D195-S209 WeakPolarHBondContact OD1-CB 3.41Å; D195-S209 PolarHBondContact OD1-OG 3.14Å
210	K	92.6	Very high	87.6	Confident	46 Å²	46	84.4 Å²	84.4	20%	0.2	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	131.4	173.1	-67.8	-80.7	-172.7	157.5	0	109.8	K193 Y194 S216 S218 I219	K193-K210 CarbonylContact C-O 3.6Å; K193-K210 WeakPolarHBondContact CA-O 3.48Å; K193-K210 WeakPolarHBondContact CB-O 3.24Å; Y194-K210 PolarHBondContact N-O 3.23Å; Y194-K210 PolarHBondContact O-N 3.34Å; K210-S216 PolarHBondContact NZ-OG 2.67Å; K210-S216 VanDerWaalsContact NZ-OG 3.15Å; K210-S218 PolarHBondContact NZ-O 3.44Å; K210-I219 HydrophobicContact CG-CD1 3.95Å; K210-I219 HydrophobicContact CG-CG1 4.34Å
211	K	90.8	Very high	87.9	Confident	170 Å²	170	81.6 Å²	81.6	74%	0.739	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.9	147.3	174.6	-66.8	-173.1	177.6	-174.9	0	110.8	G213 S214	K211-G213 VanDerWaalsContact C-N 3.29Å; K211-G213 PolarHBondContact O-N 3.47Å; K211-S214 WeakPolarHBondContact O-CB 3.28Å; K211-S214 PolarHBondContact O-N 3.33Å
212	R	85.9	Confident	88.5	Confident	110 Å²	110	86.4 Å²	86.4	42%	0.415	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.6	-48.3	177.9	178.1	171.3	174.3	-153.7	4.1	112.6	A189 F191 D192 S214 R217	A189-R212 PolarHBondContact O-NH1 3.27Å; A189-R212 PolarHBondContact O-NH2 2.78Å; F191-R212 HydrophobicContact CD2-CB 4.22Å; F191-R212 HydrophobicContact CD2-CG 4.38Å; F191-R212 HydrophobicContact CE1-CG 4.17Å; F191-R212 HydrophobicContact CE2-CB 3.69Å; F191-R212 HydrophobicContact CE2-CG 3.68Å; F191-R212 HydrophobicContact CZ-CB 4.11Å; F191-R212 HydrophobicContact CZ-CG 3.54Å; F191-R212 WeakPolarHBondContact O-CD 3.44Å; D192-R212 PolarHBondContact O-N 3.32Å; D192-R212 VanDerWaalsContact O-N 3.14Å; R212-S214 VanDerWaalsContact C-N 3.32Å; R212-S214 PolarHBondContact O-N 2.88Å; R212-R217 PolarHBondContact O-NH1 3.1Å; R212-R217 PolarHBondContact O-NH2 2.78Å
213	G	82.1	Confident	89.3	Confident	74 Å²	74	80.5 Å²	80.5	76%	0.763	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	7.2	179.4	0	0	0	0	0	117	K211 K215	K211-G213 VanDerWaalsContact C-N 3.29Å; K211-G213 PolarHBondContact O-N 3.47Å; G213-K215 PolarHBondContact O-N 2.87Å
214	S	85.4	Confident	90.2	Very high	32 Å²	32	71 Å²	71	22%	0.224	41%	0.405	C	S	.	.			trans	-61.6	127.2	178.9	176.3	0	0	0	0	111.6	K211 R212 S216 R217	K211-S214 WeakPolarHBondContact O-CB 3.28Å; K211-S214 PolarHBondContact O-N 3.33Å; R212-S214 VanDerWaalsContact C-N 3.32Å; R212-S214 PolarHBondContact O-N 2.88Å; S214-S216 VanDerWaalsContact C-N 3.28Å; S214-S216 PolarHBondContact O-N 3.27Å; S214-S216 PolarHBondContact OG-N 2.99Å; S214-S216 PolarHBondContact OG-O 3.17Å; S214-R217 PolarHBondContact O-NH1 3.49Å; S214-R217 PolarHBondContact O-NH2 3.13Å
215	K	82.7	Confident	90.7	Very high	214 Å²	214	73.9 Å²	73.9	93%	0.93	41%	0.411	S	S	*	.	S	Bend	trans	-65.7	-31.4	173.6	-66.2	-173.3	179	-176.4	0	112.7	G213	G213-K215 PolarHBondContact O-N 2.87Å
216	S	86.3	Confident	91	Very high	58 Å²	58	70.7 Å²	70.7	41%	0.406	40%	0.396	S	S	.	.			trans	-87.8	123.1	178.3	165.6	0	0	0	0	110.2	K210 S214	K210-S216 PolarHBondContact NZ-OG 2.67Å; K210-S216 VanDerWaalsContact NZ-OG 3.15Å; S214-S216 VanDerWaalsContact C-N 3.28Å; S214-S216 PolarHBondContact O-N 3.27Å; S214-S216 PolarHBondContact OG-N 2.99Å; S214-S216 PolarHBondContact OG-O 3.17Å
217	R	89.7	Confident	91.1	Very high	50 Å²	50	69.3 Å²	69.3	19%	0.189	39%	0.385	C	S	.	.			trans	-107.1	-5.7	174.4	-60.8	-63.8	-178.1	-138	-2	113.9	F181 R212 S214	F181-R217 WeakPolarHBondContact CD1-O 3.31Å; F181-R217 WeakPolarHBondContact CE1-O 3.49Å; F181-R217 WeakPolarHBondContact O-CB 3.44Å; R212-R217 PolarHBondContact O-NH1 3.1Å; R212-R217 PolarHBondContact O-NH2 2.78Å; S214-R217 PolarHBondContact O-NH1 3.49Å; S214-R217 PolarHBondContact O-NH2 3.13Å
218	S	93.5	Very high	91.3	Very high	33 Å²	33	69.6 Å²	69.6	23%	0.231	37%	0.374	C	S	.	.			trans	-89.4	140.4	177.1	-37.3	0	0	0	0	112.3	E170 I179 K210	E170-S218 VanDerWaalsContact OE2-CB 3.28Å; E170-S218 WeakPolarHBondContact OE2-CB 3.29Å; E170-S218 PolarHBondContact OE2-OG 3.22Å; I179-S218 CarbonylContact O-C 3.55Å; I179-S218 VanDerWaalsContact O-CA 3.27Å; I179-S218 WeakPolarHBondContact O-CA 3.28Å; K210-S218 PolarHBondContact NZ-O 3.44Å
219	I	94.3	Very high	91.3	Very high	9 Å²	9	72.5 Å²	72.5	5%	0.046	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	128	176.8	-65.8	167.3	0	0	0	108.6	L178 I179 F181 L196 V208 K210 F221	L178-I219 WeakPolarHBondContact CA-O 3.36Å; I179-I219 PolarHBondContact N-O 2.98Å; I179-I219 PolarHBondContact O-N 3.32Å; F181-I219 HydrophobicContact CE1-CD1 4.22Å; L196-I219 HydrophobicContact CB-CD1 3.71Å; L196-I219 HydrophobicContact CD2-CB 3.88Å; L196-I219 HydrophobicContact CD2-CD1 3.5Å; L196-I219 VanDerWaalsContact CD2-CD1 3.5Å; L196-I219 HydrophobicContact CD2-CG1 4.23Å; L196-I219 HydrophobicContact CD2-CG2 4.11Å; L196-I219 HydrophobicContact CG-CD1 4.22Å; V208-I219 HydrophobicContact CB-CD1 4.05Å; V208-I219 HydrophobicContact CB-CG2 3.95Å; V208-I219 HydrophobicContact CG1-CD1 3.8Å; V208-I219 HydrophobicContact CG1-CG1 4.06Å; V208-I219 HydrophobicContact CG1-CG2 4Å; V208-I219 HydrophobicContact CG2-CG2 3.83Å; K210-I219 HydrophobicContact CG-CD1 3.95Å; K210-I219 HydrophobicContact CG-CG1 4.34Å; I219-F221 HydrophobicContact CB-CE2 4.29Å; I219-F221 HydrophobicContact CG2-CD2 4.2Å; I219-F221 HydrophobicContact CG2-CE1 4.34Å; I219-F221 HydrophobicContact CG2-CE2 3.63Å; I219-F221 HydrophobicContact CG2-CZ 3.72Å
220	L	94.7	Very high	91.4	Very high	87 Å²	87	69.8 Å²	69.8	46%	0.455	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	112	-179.3	-179.3	59.1	0	0	0	110.8	L177 L178 K222	L177-L220 WeakPolarHBondContact O-CA 3.3Å; L178-L220 HydrophobicContact CB-CD1 4.18Å; L178-L220 HydrophobicContact CD1-CB 3.9Å; L178-L220 HydrophobicContact CD1-CD1 4.39Å; L220-K222 HydrophobicContact CD2-CD 4.39Å; L220-K222 HydrophobicContact CD2-CG 4.27Å; L220-K222 HydrophobicContact CG-CG 3.99Å
221	F	95.4	Very high	91.5	Very high	11 Å²	11	69.8 Å²	69.8	5%	0.048	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	130.2	168.7	-61.5	-85	0	0	0	109.6	S176 L177 I179 L196 L198 A206 V208 I219 L224	S176-F221 CarbonylContact C-O 3.49Å; S176-F221 WeakPolarHBondContact CA-O 3.31Å; S176-F221 WeakPolarHBondContact CB-O 3.42Å; L177-F221 PolarHBondContact N-O 3.37Å; L177-F221 PolarHBondContact O-N 2.85Å; I179-F221 HydrophobicContact CD1-CD2 3.95Å; I179-F221 HydrophobicContact CD1-CE2 3.87Å; I179-F221 HydrophobicContact CG1-CD2 4.36Å; I179-F221 HydrophobicContact CG1-CE2 4.43Å; L196-F221 HydrophobicContact CD2-CE2 3.44Å; L196-F221 VanDerWaalsContact CD2-CE2 3.44Å; L196-F221 HydrophobicContact CD2-CZ 3.55Å; L196-F221 HydrophobicContact CG-CE2 4.41Å; L196-F221 HydrophobicContact CG-CZ 4.14Å; L198-F221 HydrophobicContact CB-CD1 3.88Å; L198-F221 HydrophobicContact CB-CD2 4.49Å; L198-F221 HydrophobicContact CB-CE1 3.67Å; L198-F221 HydrophobicContact CB-CE2 4.3Å; L198-F221 HydrophobicContact CB-CG 4.28Å; L198-F221 HydrophobicContact CB-CZ 3.89Å; L198-F221 HydrophobicContact CD2-CB 3.73Å; L198-F221 HydrophobicContact CD2-CD1 3.86Å; L198-F221 HydrophobicContact CD2-CD2 4.06Å; L198-F221 HydrophobicContact CD2-CE1 4.48Å; L198-F221 HydrophobicContact CD2-CG 3.6Å; A206-F221 HydrophobicContact CB-CD1 3.78Å; A206-F221 HydrophobicContact CB-CE1 3.81Å; V208-F221 HydrophobicContact CG2-CE1 4.24Å; I219-F221 HydrophobicContact CB-CE2 4.29Å; I219-F221 HydrophobicContact CG2-CD2 4.2Å; I219-F221 HydrophobicContact CG2-CE1 4.34Å; I219-F221 HydrophobicContact CG2-CE2 3.63Å; I219-F221 HydrophobicContact CG2-CZ 3.72Å; F221-L224 HydrophobicContact CB-CD1 4.34Å
222	K	94.4	Very high	91.8	Very high	158 Å²	158	61.7 Å²	61.7	69%	0.687	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.5	162.1	-179.9	-61.7	-176.6	-179.2	178.2	0	110.4	L220	L220-K222 HydrophobicContact CD2-CD 4.39Å; L220-K222 HydrophobicContact CD2-CG 4.27Å; L220-K222 HydrophobicContact CG-CG 3.99Å
223	G	92.3	Very high	92.3	Very high	71 Å²	71	61.3 Å²	61.3	73%	0.732	33%	0.325	S	S	*	.	S	Bend	trans	80.4	24.7	176.3	0	0	0	0	0	113.3	K175	K175-G223 PolarHBondContact O-N 3.41Å
224	L	94.5	Very high	93	Very high	6 Å²	6	57.8 Å²	57.8	3%	0.031	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-81.7	163.9	175.9	-54.2	179.1	0	0	0	111	K175 L177 L198 I200 F221 Y230 T252	K175-L224 WeakPolarHBondContact CA-O 3.42Å; K175-L224 WeakPolarHBondContact CB-O 3.4Å; K175-L224 WeakPolarHBondContact CG-O 3.39Å; K175-L224 PolarHBondContact O-N 3.45Å; L177-L224 HydrophobicContact CB-CD1 4.07Å; L177-L224 HydrophobicContact CD1-CD1 3.66Å; L177-L224 HydrophobicContact CG-CD1 3.6Å; L198-L224 HydrophobicContact CD2-CD1 4.13Å; L198-L224 HydrophobicContact CD2-CD2 3.93Å; I200-L224 HydrophobicContact CD1-CD2 4.45Å; I200-L224 HydrophobicContact CG1-CD2 4.24Å; F221-L224 HydrophobicContact CB-CD1 4.34Å; L224-Y230 HydrophobicContact CB-CE2 3.81Å; L224-Y230 HydrophobicContact CD1-CD2 4.14Å; L224-Y230 HydrophobicContact CD1-CE2 4.03Å; L224-Y230 HydrophobicContact CD2-CD1 4.31Å; L224-Y230 HydrophobicContact CD2-CE1 3.91Å; L224-Y230 HydrophobicContact CD2-CE2 4.27Å; L224-Y230 HydrophobicContact CG-CE2 4.25Å; L224-T252 HydrophobicContact CB-CG2 4.26Å; L224-T252 HydrophobicContact CD1-CG2 4.07Å
225	E	93.2	Very high	93.4	Very high	101 Å²	101	57.4 Å²	57.4	47%	0.472	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-93.8	141.4	176.6	-75	-176.2	178.8	0	0	110.7	K174 R228 Y230 T252	K174-E225 CarbonylContact O-C 3.56Å; E225-R228 HydrophobicContact CB-CG 3.68Å; E225-R228 IonicContact OE2-CZ 2.76Å; E225-R228 IonicContact OE2-NE 3.81Å; E225-R228 PolarHBondContact OE2-NE 3.35Å; E225-R228 IonicContact OE2-NH2 3.41Å; E225-R228 PolarHBondContact OE2-NH2 2.81Å; E225-R228 VanDerWaalsContact OE2-NH2 3.17Å; E225-Y230 PolarHBondContact N-OH 3.25Å; E225-T252 PolarHBondContact O-OG1 3.42Å
226	P	94.4	Very high	93.9	Very high	33 Å²	33	47.2 Å²	47.2	21%	0.214	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	145.4	178.8	-20.7	31.8	0	0	0	114	K174 R228 Y253 D255	K174-P226 HydrophobicContact CB-CB 4.31Å; K174-P226 HydrophobicContact CB-CG 4.25Å; K174-P226 WeakPolarHBondContact O-CA 3.16Å; K174-P226 WeakPolarHBondContact O-CG 3.39Å; P226-R228 PolarHBondContact O-N 2.85Å; P226-Y253 WeakPolarHBondContact CA-O 3.5Å; P226-Y253 WeakPolarHBondContact CB-O 3.4Å; P226-D255 HydrophobicContact CB-CB 4.16Å
227	G	94	Very high	94.2	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.8	11.6	174.4	0	0	0	0	0	114.3	T252 Y253 M280 Y282	G227-T252 VanDerWaalsContact CA-O 3.3Å; G227-T252 WeakPolarHBondContact CA-O 3.43Å; G227-T252 PolarHBondContact N-O 2.76Å; G227-T252 PolarHBondContact N-OG1 3.31Å; G227-Y253 PolarHBondContact N-O 3.43Å; G227-M280 WeakPolarHBondContact O-CE 3.32Å; G227-Y282 WeakPolarHBondContact O-CE2 3.26Å
228	R	93.9	Very high	94.2	Very high	84 Å²	84	43.7 Å²	43.7	32%	0.317	22%	0.216	S	C	.	.			trans	-97.4	140.5	-177.3	-66.6	-79.7	-165.8	-162.6	6	112.3	E225 P226 Y230 T251 T252 M280	E225-R228 HydrophobicContact CB-CG 3.68Å; E225-R228 IonicContact OE2-CZ 2.76Å; E225-R228 IonicContact OE2-NE 3.81Å; E225-R228 PolarHBondContact OE2-NE 3.35Å; E225-R228 IonicContact OE2-NH2 3.41Å; E225-R228 PolarHBondContact OE2-NH2 2.81Å; E225-R228 VanDerWaalsContact OE2-NH2 3.17Å; P226-R228 PolarHBondContact O-N 2.85Å; R228-Y230 HydrophobicContact CB-CD2 4.38Å; R228-Y230 HydrophobicContact CB-CE2 3.62Å; R228-Y230 WeakPolarHBondContact O-CD2 3.47Å; R228-T251 WeakPolarHBondContact O-CA 3.47Å; R228-T252 PolarHBondContact N-OG1 3.24Å; R228-T252 PolarHBondContact O-N 3.46Å; R228-T252 PolarHBondContact O-OG1 3.44Å; R228-M280 HydrophobicContact CG-CE 4.28Å; R228-M280 PolarHBondContact NH1-SD 2.78Å
229	R	94.2	Very high	94	Very high	111 Å²	111	47 Å²	47	42%	0.419	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	132.7	165.6	-77.8	173.2	178.1	-177.1	-1.9	110.7	I249 F250 T251 Y282 D328	R229-I249 HydrophobicContact CB-CG2 3.79Å; R229-I249 HydrophobicContact CG-CG2 3.81Å; R229-F250 CarbonylContact C-O 3.6Å; R229-F250 WeakPolarHBondContact CA-O 3.31Å; R229-T251 HydrophobicContact CG-CG2 4.37Å; R229-T251 WeakPolarHBondContact CG-OG1 3.34Å; R229-Y282 HydrophobicContact CG-CD2 4.38Å; R229-Y282 HydrophobicContact CG-CE1 4.19Å; R229-Y282 HydrophobicContact CG-CE2 3.79Å; R229-Y282 PolarHBondContact N-OH 3.43Å; R229-D328 IonicContact CZ-OD1 2.8Å; R229-D328 IonicContact CZ-OD2 3.66Å; R229-D328 IonicContact NE-OD1 2.99Å; R229-D328 IonicContact NE-OD2 2.97Å; R229-D328 PolarHBondContact NE-OD2 2.54Å; R229-D328 IonicContact NH2-OD1 3.13Å; R229-D328 PolarHBondContact NH2-OD1 2.79Å; R229-D328 IonicContact NH2-OD2 2.66Å
230	Y	95	Very high	93.7	Very high	7 Å²	7	49.7 Å²	49.7	3%	0.027	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	128	176.4	-67.3	-78.3	0	0	0	110.1	L177 L198 L199 I200 L224 E225 R228 I249 F250 T252	L177-Y230 HydrophobicContact CD1-CD2 4.01Å; L177-Y230 HydrophobicContact CD1-CG 4.37Å; L198-Y230 HydrophobicContact CD2-CG 4.47Å; L199-Y230 WeakPolarHBondContact O-CD1 3.27Å; I200-Y230 HydrophobicContact CB-CE1 4.46Å; I200-Y230 HydrophobicContact CG2-CE1 4.2Å; L224-Y230 HydrophobicContact CB-CE2 3.81Å; L224-Y230 HydrophobicContact CD1-CD2 4.14Å; L224-Y230 HydrophobicContact CD1-CE2 4.03Å; L224-Y230 HydrophobicContact CD2-CD1 4.31Å; L224-Y230 HydrophobicContact CD2-CE1 3.91Å; L224-Y230 HydrophobicContact CD2-CE2 4.27Å; L224-Y230 HydrophobicContact CG-CE2 4.25Å; E225-Y230 PolarHBondContact N-OH 3.25Å; R228-Y230 HydrophobicContact CB-CD2 4.38Å; R228-Y230 HydrophobicContact CB-CE2 3.62Å; R228-Y230 WeakPolarHBondContact O-CD2 3.47Å; Y230-I249 WeakPolarHBondContact O-CA 3.4Å; Y230-F250 PolarHBondContact N-O 3.48Å; Y230-F250 PolarHBondContact O-N 3.45Å; Y230-T252 HydrophobicContact CD2-CG2 3.96Å; Y230-T252 HydrophobicContact CE2-CG2 3.69Å
231	L	95.5	Very high	93.4	Very high	46 Å²	46	47.2 Å²	47.2	24%	0.241	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	118.7	175.7	-172.6	68.9	0	0	0	109.3	L199 T247 I249	L199-L231 HydrophobicContact CB-CB 4.17Å; L199-L231 HydrophobicContact CD2-CB 4.48Å; L199-L231 HydrophobicContact CD2-CD2 4.38Å; L199-L231 PolarHBondContact N-O 2.82Å; L231-T247 HydrophobicContact CD1-CG2 3.26Å; L231-T247 HydrophobicContact CD2-CG2 4.41Å; L231-T247 HydrophobicContact CG-CG2 3.95Å; L231-I249 HydrophobicContact CD1-CD1 4.45Å; L231-I249 HydrophobicContact CD1-CG1 3.71Å
232	C	96.8	Very high	93.2	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	135.9	175.9	-167.6	0	0	0	0	110.4	I179 L196 E197 L198 T247 Q248 F250	I179-C232 HydrophobicContact CD1-CB 4.15Å; L196-C232 VanDerWaalsContact CD1-SG 3.56Å; E197-C232 CarbonylContact O-C 3.47Å; E197-C232 WeakPolarHBondContact O-CA 3.27Å; L198-C232 HydrophobicContact CD1-CB 3.86Å; C232-T247 VanDerWaalsContact O-CA 3.32Å; C232-T247 WeakPolarHBondContact O-CA 3.08Å; C232-Q248 PolarHBondContact N-O 2.99Å; C232-Q248 PolarHBondContact O-N 3.3Å; C232-F250 HydrophobicContact CB-CD2 3.8Å; C232-F250 HydrophobicContact CB-CE2 3.76Å
233	R	96.3	Very high	93.1	Very high	103 Å²	103	43.3 Å²	43.3	39%	0.389	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	132	177.2	-64.8	-176.3	174.9	164.4	-4.9	109.9	L196 E197 Y235 P245 V246 T247	L196-R233 CarbonylContact C-O 3.58Å; L196-R233 WeakPolarHBondContact CA-O 3.32Å; E197-R233 PolarHBondContact N-O 3.46Å; E197-R233 PolarHBondContact O-N 3.24Å; R233-Y235 HydrophobicContact CB-CE2 3.72Å; R233-Y235 VanDerWaalsContact CD-OH 3.3Å; R233-Y235 WeakPolarHBondContact CD-OH 3.36Å; R233-P245 HydrophobicContact CB-CB 4.19Å; R233-P245 HydrophobicContact CG-CB 4.32Å; R233-V246 CarbonylContact C-O 3.58Å; R233-V246 WeakPolarHBondContact CA-O 3.32Å; R233-T247 HydrophobicContact CG-CG2 4.26Å
234	L	96.1	Very high	93.1	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	135.7	175	179	66.6	0	0	0	109.9	I163 L167 F181 Y194 L196 P245 V246	I163-L234 HydrophobicContact CD1-CB 4.34Å; I163-L234 HydrophobicContact CD1-CD2 4.02Å; I163-L234 HydrophobicContact CD1-CG 3.76Å; L167-L234 HydrophobicContact CD1-CB 3.99Å; L167-L234 HydrophobicContact CD2-CB 4.07Å; L167-L234 HydrophobicContact CD2-CD2 4.15Å; L167-L234 HydrophobicContact CG-CB 4.17Å; L167-L234 HydrophobicContact CG-CD2 4.39Å; F181-L234 HydrophobicContact CB-CD2 3.73Å; F181-L234 HydrophobicContact CD1-CD1 4.42Å; F181-L234 HydrophobicContact CD1-CD2 4.38Å; F181-L234 HydrophobicContact CD2-CD2 3.81Å; F181-L234 HydrophobicContact CE1-CD1 4.43Å; F181-L234 HydrophobicContact CG-CD1 4.46Å; F181-L234 HydrophobicContact CG-CD2 3.73Å; F181-L234 HydrophobicContact CZ-CD1 4.48Å; Y194-L234 HydrophobicContact CD1-CD1 4.01Å; Y194-L234 HydrophobicContact CD1-CG 4.41Å; Y194-L234 HydrophobicContact CG-CD1 4.47Å; L196-L234 HydrophobicContact CB-CD1 4.24Å; L196-L234 HydrophobicContact CD1-CB 3.88Å; L196-L234 HydrophobicContact CD1-CD1 3.79Å; L196-L234 HydrophobicContact CD1-CG 4.36Å; L234-P245 WeakPolarHBondContact O-CA 3.32Å; L234-V246 HydrophobicContact CB-CB 4.37Å; L234-V246 PolarHBondContact N-O 3.24Å; L234-V246 PolarHBondContact O-N 2.95Å
235	Y	94.6	Very high	93.1	Very high	23 Å²	23	45.2 Å²	45.2	9%	0.09	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	144.8	178.8	-56.3	-89.4	0	0	0	110.4	Y194 D195 E197 R233 R242 S243 P245	Y194-Y235 CarbonylContact C-O 3.43Å; Y194-Y235 VanDerWaalsContact CA-O 3.26Å; Y194-Y235 WeakPolarHBondContact CA-O 3.37Å; D195-Y235 PolarHBondContact N-O 3.24Å; D195-Y235 PolarHBondContact O-N 2.84Å; E197-Y235 HydrophobicContact CG-CE2 4.37Å; R233-Y235 HydrophobicContact CB-CE2 3.72Å; R233-Y235 VanDerWaalsContact CD-OH 3.3Å; R233-Y235 WeakPolarHBondContact CD-OH 3.36Å; Y235-R242 HydrophobicContact CD1-CB 3.93Å; Y235-R242 HydrophobicContact CD1-CG 4.45Å; Y235-R242 HydrophobicContact CG-CB 4.3Å; Y235-R242 HydrophobicContact CG-CG 4.4Å; Y235-S243 WeakPolarHBondContact CD1-O 3.37Å; Y235-P245 HydrophobicContact CD1-CB 4.1Å; Y235-P245 HydrophobicContact CE1-CB 3.45Å; Y235-P245 VanDerWaalsContact CE1-CB 3.45Å; Y235-P245 HydrophobicContact CE1-CG 3.97Å; Y235-P245 HydrophobicContact CE2-CB 4.46Å
236	T	93.3	Very high	93.2	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	145.2	156	44.8	0	0	0	0	109.4	P161 L162 I163 F191 Y194 R242 S243	P161-T236 VanDerWaalsContact CG-O 3.23Å; P161-T236 WeakPolarHBondContact CG-O 3.34Å; P161-T236 WeakPolarHBondContact CG-OG1 3.15Å; L162-T236 PolarHBondContact O-OG1 3.43Å; L162-T236 VanDerWaalsContact O-OG1 3.05Å; I163-T236 HydrophobicContact CB-CG2 4.18Å; I163-T236 HydrophobicContact CD1-CG2 4.26Å; I163-T236 HydrophobicContact CG1-CG2 4.18Å; F191-T236 HydrophobicContact CD1-CG2 3.99Å; F191-T236 HydrophobicContact CD2-CG2 3.85Å; F191-T236 HydrophobicContact CE1-CG2 4.06Å; F191-T236 HydrophobicContact CE2-CG2 3.9Å; F191-T236 HydrophobicContact CG-CG2 3.91Å; F191-T236 HydrophobicContact CZ-CG2 4.02Å; Y194-T236 HydrophobicContact CD1-CG2 3.86Å; Y194-T236 HydrophobicContact CE1-CG2 3.51Å; T236-R242 CarbonylContact O-C 3.21Å; T236-R242 WeakPolarHBondContact O-CA 3.21Å; T236-S243 PolarHBondContact N-OG 3.24Å; T236-S243 PolarHBondContact O-N 2.88Å; T236-S243 VanDerWaalsContact OG1-CB 3.24Å; T236-S243 WeakPolarHBondContact OG1-CB 3.23Å; T236-S243 PolarHBondContact OG1-OG 2.86Å
237	V	93	Very high	93.3	Very high	4 Å²	4	43.6 Å²	43.6	2%	0.024	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	126.1	-177.5	-170.3	0	0	0	0	110.9	F191 D192 K193 D195 I241 R242	F191-V237 WeakPolarHBondContact CB-O 3.4Å; D192-V237 PolarHBondContact N-O 3.09Å; K193-V237 HydrophobicContact CG-CB 3.85Å; K193-V237 HydrophobicContact CG-CG2 4.15Å; K193-V237 PolarHBondContact N-O 3.46Å; K193-V237 PolarHBondContact O-N 3.43Å; D195-V237 HydrophobicContact CB-CG2 4.05Å; V237-I241 CarbonylContact C-O 3.58Å; V237-I241 VanDerWaalsContact CA-O 3.26Å; V237-I241 WeakPolarHBondContact CA-O 3.03Å; V237-R242 HydrophobicContact CG2-CG 4.04Å
238	Y	89.1	Confident	93.4	Very high	30 Å²	30	48 Å²	48	12%	0.118	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	119.6	174.8	176.4	-108	0	0	0	109.7	S133 I190 G240 I241	S133-Y238 VanDerWaalsContact C-CE1 3.42Å; S133-Y238 VanDerWaalsContact O-CE1 3.23Å; S133-Y238 WeakPolarHBondContact O-CE1 3.44Å; S133-Y238 VanDerWaalsContact O-CZ 3.26Å; S133-Y238 PolarHBondContact O-OH 3.08Å; I190-Y238 HydrophobicContact CG2-CD2 4.03Å; I190-Y238 HydrophobicContact CG2-CE2 3.68Å; I190-Y238 WeakPolarHBondContact O-CD2 3.42Å; Y238-G240 PolarHBondContact O-N 3.43Å; Y238-G240 VanDerWaalsContact O-N 3.1Å; Y238-I241 PolarHBondContact N-O 2.97Å; Y238-I241 PolarHBondContact O-N 2.91Å
239	Q	88.2	Confident	93.5	Very high	103 Å²	103	48.2 Å²	48.2	48%	0.481	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.9	40.7	-178.9	-62.1	-169.4	-3.8	0	0	113.5	N158 D192 I241	N158-Q239 WeakPolarHBondContact ND2-CB 3.12Å; N158-Q239 PolarHBondContact ND2-OE1 2.92Å; D192-Q239 PolarHBondContact OD2-N 3.4Å; Q239-I241 VanDerWaalsContact C-N 3.35Å; Q239-I241 PolarHBondContact O-N 3.3Å
240	G	88.1	Confident	93.6	Very high	65 Å²	65	43.8 Å²	43.8	67%	0.67	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	86.3	-8.7	-179.7	0	0	0	0	0	115.8	Y238	Y238-G240 PolarHBondContact O-N 3.43Å; Y238-G240 VanDerWaalsContact O-N 3.1Å
241	I	88.2	Confident	93.6	Very high	36 Å²	36	44.1 Å²	44.1	19%	0.185	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	131.1	178.5	-57.9	-164.7	0	0	0	111	N158 P160 P161 V237 Y238 Q239	N158-I241 HydrophobicContact CB-CD1 3.47Å; N158-I241 VanDerWaalsContact CB-CD1 3.47Å; N158-I241 HydrophobicContact CB-CG1 4.3Å; N158-I241 WeakPolarHBondContact O-CD1 3.42Å; P160-I241 HydrophobicContact CB-CG2 4.12Å; P160-I241 HydrophobicContact CG-CG2 4.07Å; P161-I241 WeakPolarHBondContact CD-O 3.25Å; V237-I241 CarbonylContact C-O 3.58Å; V237-I241 VanDerWaalsContact CA-O 3.26Å; V237-I241 WeakPolarHBondContact CA-O 3.03Å; Y238-I241 PolarHBondContact N-O 2.97Å; Y238-I241 PolarHBondContact O-N 2.91Å; Q239-I241 VanDerWaalsContact C-N 3.35Å; Q239-I241 PolarHBondContact O-N 3.3Å
242	R	92.5	Very high	93.6	Very high	83 Å²	83	42 Å²	42	31%	0.313	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	143.7	178.2	-66.4	180	170.3	-175.6	-8.6	112.1	R53 D195 E197 Y235 T236 V237	R53-R242 PolarHBondContact NH1-O 3.38Å; R53-R242 PolarHBondContact NH2-O 2.84Å; D195-R242 IonicContact OD2-CZ 3.46Å; D195-R242 IonicContact OD2-NE 2.63Å; D195-R242 IonicContact OD2-NH2 2.78Å; D195-R242 PolarHBondContact OD2-NH2 3.06Å; D195-R242 VanDerWaalsContact OD2-NH2 3.16Å; E197-R242 IonicContact OE1-CZ 3.16Å; E197-R242 IonicContact OE1-NH1 3.31Å; E197-R242 PolarHBondContact OE1-NH1 3.22Å; E197-R242 IonicContact OE1-NH2 3.07Å; E197-R242 PolarHBondContact OE1-NH2 3.37Å; E197-R242 IonicContact OE2-NH1 3.56Å; Y235-R242 HydrophobicContact CD1-CB 3.93Å; Y235-R242 HydrophobicContact CD1-CG 4.45Å; Y235-R242 HydrophobicContact CG-CB 4.3Å; Y235-R242 HydrophobicContact CG-CG 4.4Å; T236-R242 CarbonylContact O-C 3.21Å; T236-R242 WeakPolarHBondContact O-CA 3.21Å; V237-R242 HydrophobicContact CG2-CG 4.04Å
243	S	92.5	Very high	93.6	Very high	3 Å²	3	46.2 Å²	46.2	2%	0.021	24%	0.235	C	C	.	.			trans	-62.7	179.7	165.5	63	0	0	0	0	112	P161 Y235 T236	P161-S243 WeakPolarHBondContact O-CA 3.37Å; P161-S243 WeakPolarHBondContact O-CB 3.46Å; Y235-S243 WeakPolarHBondContact CD1-O 3.37Å; T236-S243 PolarHBondContact N-OG 3.24Å; T236-S243 PolarHBondContact O-N 2.88Å; T236-S243 VanDerWaalsContact OG1-CB 3.24Å; T236-S243 WeakPolarHBondContact OG1-CB 3.23Å; T236-S243 PolarHBondContact OG1-OG 2.86Å
244	E	91.1	Very high	93.7	Very high	76 Å²	76	41.3 Å²	41.3	36%	0.355	22%	0.217	S	C	.	.	P	Polyproline II helix	trans	-63.2	152	158.6	-66.4	-53	124.3	0	0	110.7	R53 E56 I163	R53-E244 IonicContact CZ-OE1 3.53Å; R53-E244 IonicContact NE-OE1 3.46Å; R53-E244 IonicContact NH2-OE1 3.56Å; R53-E244 PolarHBondContact NH2-OE1 3.42Å; E56-E244 HydrophobicContact CG-CB 4.42Å; E56-E244 HydrophobicContact CG-CG 3.7Å; E56-E244 PolarHBondContact OE1-N 2.91Å; I163-E244 VanDerWaalsContact CG2-O 3.28Å; I163-E244 WeakPolarHBondContact CG2-O 3.33Å
245	P	94.7	Very high	93.6	Very high	42 Å²	42	43.5 Å²	43.5	27%	0.273	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-80.4	133.1	-179.6	25.9	-28.3	0	0	0	112.8	R233 L234 Y235 T247	R233-P245 HydrophobicContact CB-CB 4.19Å; R233-P245 HydrophobicContact CG-CB 4.32Å; L234-P245 WeakPolarHBondContact O-CA 3.32Å; Y235-P245 HydrophobicContact CD1-CB 4.1Å; Y235-P245 HydrophobicContact CE1-CB 3.45Å; Y235-P245 VanDerWaalsContact CE1-CB 3.45Å; Y235-P245 HydrophobicContact CE1-CG 3.97Å; Y235-P245 HydrophobicContact CE2-CB 4.46Å; P245-T247 PolarHBondContact O-N 2.9Å
246	V	95	Very high	93.6	Very high	36 Å²	36	46.7 Å²	46.7	22%	0.218	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	119	155.8	-179	0	0	0	0	107.6	I163 S165 L167 R233 L234	I163-V246 HydrophobicContact CB-CG2 4.48Å; I163-V246 HydrophobicContact CD1-CB 4.45Å; I163-V246 HydrophobicContact CD1-CG2 3.73Å; I163-V246 HydrophobicContact CG1-CG2 3.78Å; I163-V246 HydrophobicContact CG2-CG2 3.92Å; S165-V246 WeakPolarHBondContact O-CG2 3.45Å; L167-V246 HydrophobicContact CD1-CB 4.49Å; L167-V246 HydrophobicContact CD1-CG1 4.12Å; L167-V246 WeakPolarHBondContact CD1-O 3.3Å; L167-V246 HydrophobicContact CG-CG1 4.27Å; R233-V246 CarbonylContact C-O 3.58Å; R233-V246 WeakPolarHBondContact CA-O 3.32Å; L234-V246 HydrophobicContact CB-CB 4.37Å; L234-V246 PolarHBondContact N-O 3.24Å; L234-V246 PolarHBondContact O-N 2.95Å
247	T	96.4	Very high	93.6	Very high	64 Å²	64	47 Å²	47	39%	0.393	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	129.6	-172.1	-57.9	0	0	0	0	111.2	L231 C232 R233 P245	L231-T247 HydrophobicContact CD1-CG2 3.26Å; L231-T247 HydrophobicContact CD2-CG2 4.41Å; L231-T247 HydrophobicContact CG-CG2 3.95Å; C232-T247 VanDerWaalsContact O-CA 3.32Å; C232-T247 WeakPolarHBondContact O-CA 3.08Å; R233-T247 HydrophobicContact CG-CG2 4.26Å; P245-T247 PolarHBondContact O-N 2.9Å
248	Q	96.4	Very high	93.6	Very high	92 Å²	92	50.7 Å²	50.7	43%	0.43	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	144.1	177	-173.6	59.6	36.3	0	0	110.6	L167 C232 F250	L167-Q248 HydrophobicContact CB-CB 3.97Å; L167-Q248 HydrophobicContact CD1-CB 4.07Å; C232-Q248 PolarHBondContact N-O 2.99Å; C232-Q248 PolarHBondContact O-N 3.3Å; Q248-F250 HydrophobicContact CB-CE2 4Å; Q248-F250 HydrophobicContact CB-CZ 4.05Å; Q248-F250 HydrophobicContact CG-CD1 4.48Å; Q248-F250 HydrophobicContact CG-CE1 3.87Å; Q248-F250 HydrophobicContact CG-CE2 3.93Å; Q248-F250 HydrophobicContact CG-CZ 3.57Å
249	I	95.7	Very high	93.7	Very high	89 Å²	89	57.5 Å²	57.5	46%	0.456	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	131.2	173.6	-62.8	172.7	0	0	0	108.9	R229 Y230 L231	R229-I249 HydrophobicContact CB-CG2 3.79Å; R229-I249 HydrophobicContact CG-CG2 3.81Å; Y230-I249 WeakPolarHBondContact O-CA 3.4Å; L231-I249 HydrophobicContact CD1-CD1 4.45Å; L231-I249 HydrophobicContact CD1-CG1 3.71Å
250	F	96.2	Very high	93.9	Very high	17 Å²	17	53.8 Å²	53.8	8%	0.075	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	131	174.2	-64.1	-70.1	0	0	0	110.7	L167 A169 L177 I179 R229 Y230 C232 Q248	L167-F250 HydrophobicContact CB-CZ 4.2Å; A169-F250 HydrophobicContact CB-CD1 3.68Å; A169-F250 HydrophobicContact CB-CE1 3.64Å; L177-F250 HydrophobicContact CD1-CB 3.8Å; L177-F250 HydrophobicContact CD2-CB 4.17Å; I179-F250 HydrophobicContact CD1-CD2 3.66Å; I179-F250 HydrophobicContact CD1-CE2 3.75Å; I179-F250 HydrophobicContact CG1-CD2 4.24Å; I179-F250 HydrophobicContact CG1-CE2 4.13Å; I179-F250 HydrophobicContact CG2-CE2 4.03Å; I179-F250 HydrophobicContact CG2-CZ 4.24Å; R229-F250 CarbonylContact C-O 3.6Å; R229-F250 WeakPolarHBondContact CA-O 3.31Å; Y230-F250 PolarHBondContact N-O 3.48Å; Y230-F250 PolarHBondContact O-N 3.45Å; C232-F250 HydrophobicContact CB-CD2 3.8Å; C232-F250 HydrophobicContact CB-CE2 3.76Å; Q248-F250 HydrophobicContact CB-CE2 4Å; Q248-F250 HydrophobicContact CB-CZ 4.05Å; Q248-F250 HydrophobicContact CG-CD1 4.48Å; Q248-F250 HydrophobicContact CG-CE1 3.87Å; Q248-F250 HydrophobicContact CG-CE2 3.93Å; Q248-F250 HydrophobicContact CG-CZ 3.57Å
251	T	95.9	Very high	94.1	Very high	15 Å²	15	56 Å²	56	9%	0.092	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	136.1	176.4	-54.1	0	0	0	0	109.2	I172 R228 R229 Y282 A327 D328 L330	I172-T251 VanDerWaalsContact CG2-O 3.3Å; I172-T251 WeakPolarHBondContact CG2-O 3.32Å; R228-T251 WeakPolarHBondContact O-CA 3.47Å; R229-T251 HydrophobicContact CG-CG2 4.37Å; R229-T251 WeakPolarHBondContact CG-OG1 3.34Å; T251-Y282 HydrophobicContact CG2-CE2 4.31Å; T251-A327 HydrophobicContact CG2-CB 3.99Å; T251-D328 PolarHBondContact OG1-OD2 3.2Å; T251-L330 HydrophobicContact CG2-CD1 4.32Å; T251-L330 WeakPolarHBondContact O-CD1 3.42Å
252	T	96.1	Very high	94.3	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-85.5	153.4	172.4	46.9	0	0	0	0	110.6	L177 L224 E225 G227 R228 Y230	L177-T252 HydrophobicContact CD1-CG2 4.33Å; L177-T252 HydrophobicContact CD2-CG2 4.08Å; L177-T252 HydrophobicContact CG-CG2 4.03Å; L224-T252 HydrophobicContact CB-CG2 4.26Å; L224-T252 HydrophobicContact CD1-CG2 4.07Å; E225-T252 PolarHBondContact O-OG1 3.42Å; G227-T252 VanDerWaalsContact CA-O 3.3Å; G227-T252 WeakPolarHBondContact CA-O 3.43Å; G227-T252 PolarHBondContact N-O 2.76Å; G227-T252 PolarHBondContact N-OG1 3.31Å; R228-T252 PolarHBondContact N-OG1 3.24Å; R228-T252 PolarHBondContact O-N 3.46Å; R228-T252 PolarHBondContact O-OG1 3.44Å; Y230-T252 HydrophobicContact CD2-CG2 3.96Å; Y230-T252 HydrophobicContact CE2-CG2 3.69Å
253	Y	97.2	Very high	94.3	Very high	90 Å²	90	50.6 Å²	50.6	35%	0.353	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-56.8	133.7	176	-85.2	-82.3	0	0	0	110.8	I172 T173 P226 G227 L330 E331	I172-Y253 HydrophobicContact CB-CD2 4.22Å; I172-Y253 HydrophobicContact CB-CE2 4.06Å; I172-Y253 HydrophobicContact CG2-CD2 3.78Å; I172-Y253 HydrophobicContact CG2-CE2 4.08Å; I172-Y253 WeakPolarHBondContact O-CE2 3.46Å; T173-Y253 PolarHBondContact O-N 3.37Å; P226-Y253 WeakPolarHBondContact CA-O 3.5Å; P226-Y253 WeakPolarHBondContact CB-O 3.4Å; G227-Y253 PolarHBondContact N-O 3.43Å; Y253-L330 HydrophobicContact CD1-CB 4.05Å; Y253-L330 HydrophobicContact CE1-CB 4.18Å; Y253-L330 HydrophobicContact CE1-CD2 4.04Å; Y253-L330 HydrophobicContact CE2-CD2 4.38Å; Y253-E331 VanDerWaalsContact CD1-O 3.29Å; Y253-E331 WeakPolarHBondContact CD1-O 3.47Å; Y253-E331 WeakPolarHBondContact CE1-O 3.39Å
254	P	96.8	Very high	94.4	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-65.6	159.1	171.7	22.9	-24.3	0	0	0	110.7	V325 A327 L330 S332	P254-V325 HydrophobicContact CB-CB 4.05Å; P254-V325 HydrophobicContact CB-CG1 3.7Å; P254-V325 HydrophobicContact CG-CB 4.27Å; P254-V325 HydrophobicContact CG-CG1 4.16Å; P254-V325 WeakPolarHBondContact CG-O 3.13Å; P254-A327 HydrophobicContact CB-CB 4.21Å; P254-A327 HydrophobicContact CG-CB 3.87Å; P254-L330 WeakPolarHBondContact CG-O 3.4Å; P254-S332 WeakPolarHBondContact O-CB 3.46Å
255	D	94.9	Very high	94.5	Very high	45 Å²	45	49.5 Å²	49.5	24%	0.241	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-78.3	164.5	168.7	-158.1	16	0	0	0	109.5	K174 P226 Q258 Y276 V325 S332	K174-D255 IonicContact NZ-OD1 3.8Å; K174-D255 PolarHBondContact NZ-OD1 2.91Å; P226-D255 HydrophobicContact CB-CB 4.16Å; D255-Q258 PolarHBondContact OD2-NE2 3.3Å; D255-Y276 WeakPolarHBondContact CA-OH 3.38Å; D255-Y276 WeakPolarHBondContact CB-OH 3.43Å; D255-Y276 PolarHBondContact N-OH 2.89Å; D255-Y276 PolarHBondContact O-OH 2.87Å; D255-V325 WeakPolarHBondContact O-CG2 3.2Å; D255-S332 WeakPolarHBondContact O-CB 3.2Å; D255-S332 PolarHBondContact O-OG 2.86Å
256	K	94.4	Very high	94.3	Very high	91 Å²	91	49.1 Å²	49.1	40%	0.396	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-62.6	161	172	70.6	171.3	-168	158.1	0	110.2	Q258 D333 D335	K256-Q258 PolarHBondContact O-N 2.95Å; K256-D333 HydrophobicContact CB-CB 4.42Å; K256-D333 WeakPolarHBondContact CB-O 3.25Å; K256-D335 IonicContact NZ-OD1 2.8Å
257	I	93.9	Very high	94.2	Very high	5 Å²	5	50.3 Å²	50.3	3%	0.026	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-54.2	136.6	178.4	-159.9	162.2	0	0	0	110.7	L260 W273 A323 V325 D335	I257-L260 HydrophobicContact CD1-CD1 4.25Å; I257-L260 HydrophobicContact CG2-CB 4.29Å; I257-L260 HydrophobicContact CG2-CD2 4.38Å; I257-W273 HydrophobicContact CD1-CB 3.63Å; I257-W273 HydrophobicContact CD1-CD2 3.83Å; I257-W273 HydrophobicContact CD1-CE3 4.25Å; I257-W273 HydrophobicContact CD1-CG 3.55Å; I257-W273 HydrophobicContact CG1-CB 3.56Å; I257-W273 HydrophobicContact CG1-CG 3.86Å; I257-A323 HydrophobicContact CD1-CB 3.51Å; I257-A323 HydrophobicContact CG2-CB 4.21Å; I257-V325 HydrophobicContact CB-CG2 4.26Å; I257-D335 HydrophobicContact CG2-CB 3.45Å; I257-D335 VanDerWaalsContact CG2-CB 3.45Å
258	Q	92.3	Very high	94	Very high	82 Å²	82	47.9 Å²	47.9	38%	0.383	22%	0.219	S	C	.	.			trans	-110.4	141.8	-176.4	-64.6	-170.6	-7.8	0	0	110.9	D255 K256 L260 Q274	D255-Q258 PolarHBondContact OD2-NE2 3.3Å; K256-Q258 PolarHBondContact O-N 2.95Å; Q258-L260 VanDerWaalsContact C-N 3.28Å; Q258-L260 PolarHBondContact O-N 3.14Å; Q258-Q274 HydrophobicContact CB-CB 4.28Å; Q258-Q274 WeakPolarHBondContact O-CB 3.24Å; Q258-Q274 PolarHBondContact O-N 3.21Å
259	R	90.5	Very high	93.9	Very high	174 Å²	174	43.5 Å²	43.5	66%	0.657	20%	0.199	S	C	*	.	S	Bend	trans	52.4	44.4	178	-54.9	-178.4	-176.3	165.9	3.6	112.8	R261 Q274	R259-R261 PolarHBondContact O-N 3.06Å; R259-Q274 HydrophobicContact CB-CB 4.32Å; R259-Q274 VanDerWaalsContact CD-OE1 3.25Å; R259-Q274 VanDerWaalsContact CZ-OE1 3.24Å; R259-Q274 VanDerWaalsContact NE-OE1 3.11Å
260	L	92.3	Very high	93.8	Very high	24 Å²	24	40 Å²	40	13%	0.126	18%	0.18	C	C	.	.			trans	-60.5	125.1	172.2	-174.9	60.7	0	0	0	109.2	I257 Q258 L271 F272 W273 I337	I257-L260 HydrophobicContact CD1-CD1 4.25Å; I257-L260 HydrophobicContact CG2-CB 4.29Å; I257-L260 HydrophobicContact CG2-CD2 4.38Å; Q258-L260 VanDerWaalsContact C-N 3.28Å; Q258-L260 PolarHBondContact O-N 3.14Å; L260-L271 HydrophobicContact CD1-CB 4.45Å; L260-L271 HydrophobicContact CD1-CD2 4.2Å; L260-F272 CarbonylContact C-O 3.51Å; L260-F272 WeakPolarHBondContact CA-O 3.3Å; L260-W273 HydrophobicContact CD1-CB 4.45Å; L260-W273 HydrophobicContact CD1-CE3 4.38Å; L260-I337 HydrophobicContact CD2-CG2 3.75Å
261	R	92.4	Very high	93.8	Very high	111 Å²	111	39.2 Å²	39.2	42%	0.419	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	144.4	176.4	-60.9	-177.8	-179.7	158.6	-1.3	108.6	R259 L271 F272 M466	R259-R261 PolarHBondContact O-N 3.06Å; R261-L271 WeakPolarHBondContact O-CA 3.18Å; R261-F272 HydrophobicContact CB-CB 4.39Å; R261-F272 PolarHBondContact N-O 2.93Å; R261-F272 PolarHBondContact O-N 2.76Å; R261-M466 HydrophobicContact CG-CB 4.06Å
262	I	93.6	Very high	93.7	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	137.4	-178.9	-69.9	-166	0	0	0	109	V269 L271 F321 I337 V339 M466 C468	I262-V269 HydrophobicContact CG2-CG1 3.62Å; I262-L271 HydrophobicContact CD1-CD2 3.92Å; I262-L271 HydrophobicContact CD1-CG 4.39Å; I262-L271 HydrophobicContact CG1-CD2 4.14Å; I262-L271 HydrophobicContact CG1-CG 4.25Å; I262-F321 HydrophobicContact CD1-CD2 4.16Å; I262-I337 HydrophobicContact CD1-CB 4.29Å; I262-I337 HydrophobicContact CD1-CD1 3.98Å; I262-I337 HydrophobicContact CD1-CG1 4.1Å; I262-I337 HydrophobicContact CD1-CG2 3.26Å; I262-I337 HydrophobicContact CG1-CD1 4.39Å; I262-I337 HydrophobicContact CG1-CG2 4.33Å; I262-V339 HydrophobicContact CD1-CG1 4.47Å; I262-V339 HydrophobicContact CG2-CG1 4.29Å; I262-V339 HydrophobicContact CG2-CG2 4.28Å; I262-M466 PolarHBondContact N-O 2.78Å; I262-C468 PolarHBondContact O-N 2.69Å
263	V	93.1	Very high	93.6	Very high	7 Å²	7	39.9 Å²	39.9	4%	0.042	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	110.7	166.5	-171.2	0	0	0	0	108.7	V269 K270 F272 F392 C468 E470	V263-V269 WeakPolarHBondContact O-CA 3.05Å; V263-K270 PolarHBondContact N-O 2.85Å; V263-K270 PolarHBondContact O-N 3.31Å; V263-F272 HydrophobicContact CB-CE2 4.39Å; V263-F272 HydrophobicContact CG2-CD2 4.27Å; V263-F272 HydrophobicContact CG2-CE2 3.72Å; V263-F392 HydrophobicContact CB-CE2 3.83Å; V263-F392 HydrophobicContact CB-CZ 3.83Å; V263-F392 HydrophobicContact CG1-CE2 3.55Å; V263-F392 HydrophobicContact CG1-CZ 3.74Å; V263-F392 HydrophobicContact CG2-CE2 4.44Å; V263-C468 CarbonylContact C-O 3.55Å; V263-C468 WeakPolarHBondContact CA-O 3.27Å; V263-C468 HydrophobicContact CG1-CB 4.44Å; V263-C468 HydrophobicContact CG2-CB 4.15Å; V263-E470 HydrophobicContact CG1-CB 4.02Å; V263-E470 VanDerWaalsContact CG1-CD 3.42Å; V263-E470 HydrophobicContact CG1-CG 3.49Å; V263-E470 VanDerWaalsContact CG1-CG 3.49Å; V263-E470 WeakPolarHBondContact CG1-OE1 3.44Å
264	S	93.8	Very high	93.4	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	127.5	-178.4	-176.3	0	0	0	0	110.8	M340 T341 C468 M469 E470	S264-M340 PolarHBondContact OG-O 2.9Å; S264-T341 WeakPolarHBondContact OG-CA 3.43Å; S264-C468 PolarHBondContact N-O 2.81Å; S264-M469 CarbonylContact O-C 3.56Å; S264-M469 WeakPolarHBondContact O-CA 3.47Å; S264-E470 PolarHBondContact O-N 2.68Å
265	R	92.1	Very high	93.1	Very high	56 Å²	56	44.1 Å²	44.1	21%	0.211	20%	0.197	C	C	.	.			trans	-115.2	-175.8	170.1	-66.1	-179.4	178.4	179.9	-1.3	109	S268 T341 I342 D390 F392 E470	R265-S268 WeakPolarHBondContact CA-O 3.44Å; R265-S268 WeakPolarHBondContact CB-O 3.33Å; R265-S268 PolarHBondContact N-O 3.17Å; R265-T341 WeakPolarHBondContact O-CB 3.5Å; R265-I342 VanDerWaalsContact C-CG1 3.42Å; R265-I342 PolarHBondContact O-N 2.86Å; R265-D390 IonicContact NH2-OD2 3.75Å; R265-D390 PolarHBondContact NH2-OD2 3.47Å; R265-D390 VanDerWaalsContact NH2-OD2 3.09Å; R265-F392 HydrophobicContact CG-CZ 4.34Å; R265-F392 VanDerWaalsContact NH2-CD2 3.25Å; R265-E470 HydrophobicContact CG-CB 4Å; R265-E470 IonicContact CZ-OE2 2.72Å; R265-E470 IonicContact NE-OE2 3.48Å; R265-E470 PolarHBondContact NE-OE2 3.31Å; R265-E470 IonicContact NH2-OE2 3.39Å; R265-E470 PolarHBondContact NH2-OE2 3.21Å
266	S	91.3	Very high	92.8	Very high	34 Å²	34	44 Å²	44	24%	0.238	19%	0.193	C	C	.	.	S	Bend	trans	-68.7	-34.8	-177.3	54.2	0	0	0	0	113.2	P315 I342	S266-P315 WeakPolarHBondContact O-CA 3.26Å; S266-P315 WeakPolarHBondContact O-CG 3.43Å; S266-I342 WeakPolarHBondContact CA-O 3.42Å; S266-I342 VanDerWaalsContact N-CG1 3.33Å
267	T	92.2	Very high	92.2	Very high	60 Å²	60	41.8 Å²	41.8	37%	0.368	20%	0.196	S	C	.	.	S	Bend	trans	-133.4	11.7	-176.6	58	0	0	0	0	113.5	E311 K312 L313 P315	T267-E311 CarbonylContact O-C 3.6Å; T267-K312 PolarHBondContact O-N 3.32Å; T267-K312 VanDerWaalsContact O-N 3.08Å; T267-L313 VanDerWaalsContact CA-O 3.27Å; T267-L313 WeakPolarHBondContact CA-O 3.43Å; T267-L313 WeakPolarHBondContact CB-O 3.42Å; T267-L313 WeakPolarHBondContact CG2-O 3.37Å; T267-L313 PolarHBondContact O-N 3.15Å; T267-P315 HydrophobicContact CG2-CG 4.01Å
268	S	92.8	Very high	91.5	Very high	13 Å²	13	47.2 Å²	47.2	9%	0.091	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	152.2	177.9	60.9	0	0	0	0	111.7	R265 I310	R265-S268 WeakPolarHBondContact CA-O 3.44Å; R265-S268 WeakPolarHBondContact CB-O 3.33Å; R265-S268 PolarHBondContact N-O 3.17Å; S268-I310 CarbonylContact C-O 3.58Å; S268-I310 WeakPolarHBondContact CA-O 3.37Å; S268-I310 VanDerWaalsContact CB-O 3.3Å; S268-I310 WeakPolarHBondContact CB-O 3.22Å
269	V	94.5	Very high	91.1	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	130.6	175.1	173.7	0	0	0	0	107.8	I262 V263 L271 I310 L313 F321 V339 T341	I262-V269 HydrophobicContact CG2-CG1 3.62Å; V263-V269 WeakPolarHBondContact O-CA 3.05Å; V269-L271 HydrophobicContact CG1-CD1 4.39Å; V269-I310 PolarHBondContact N-O 3.25Å; V269-I310 PolarHBondContact O-N 2.78Å; V269-L313 HydrophobicContact CB-CD1 3.93Å; V269-L313 HydrophobicContact CG2-CD1 3.61Å; V269-F321 HydrophobicContact CB-CE1 4.43Å; V269-F321 HydrophobicContact CB-CE2 4.11Å; V269-F321 HydrophobicContact CB-CZ 3.67Å; V269-F321 HydrophobicContact CG1-CD2 4.43Å; V269-F321 HydrophobicContact CG1-CE1 4.37Å; V269-F321 HydrophobicContact CG1-CE2 3.74Å; V269-F321 HydrophobicContact CG1-CZ 3.7Å; V269-F321 HydrophobicContact CG2-CE2 4.1Å; V269-F321 HydrophobicContact CG2-CZ 3.92Å; V269-V339 HydrophobicContact CG2-CG1 4.44Å; V269-T341 HydrophobicContact CG2-CG2 4.2Å
270	K	94	Very high	91.1	Very high	15 Å²	15	42.3 Å²	42.3	7%	0.065	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	127.8	172.4	-168.6	164.5	-178	175.2	0	110.8	V263 F272 N307 L308 L309 K391 F392	V263-K270 PolarHBondContact N-O 2.85Å; V263-K270 PolarHBondContact O-N 3.31Å; K270-F272 HydrophobicContact CB-CE2 4.02Å; K270-F272 HydrophobicContact CB-CZ 4.36Å; K270-F272 HydrophobicContact CD-CE1 4.08Å; K270-F272 HydrophobicContact CD-CE2 4.01Å; K270-F272 HydrophobicContact CD-CZ 3.48Å; K270-F272 VanDerWaalsContact CD-CZ 3.48Å; K270-F272 HydrophobicContact CG-CD2 4.35Å; K270-F272 HydrophobicContact CG-CE1 4.27Å; K270-F272 HydrophobicContact CG-CE2 3.65Å; K270-F272 HydrophobicContact CG-CZ 3.63Å; K270-N307 VanDerWaalsContact CE-OD1 3.3Å; K270-N307 WeakPolarHBondContact CE-OD1 3.46Å; K270-L308 WeakPolarHBondContact CA-O 3.39Å; K270-L309 HydrophobicContact CB-CD1 3.96Å; K270-L309 HydrophobicContact CD-CB 4.33Å; K270-L309 HydrophobicContact CD-CD1 4.45Å; K270-L309 HydrophobicContact CG-CB 4.36Å; K270-L309 HydrophobicContact CG-CD1 4.47Å; K270-K391 PolarHBondContact NZ-O 3.21Å; K270-F392 HydrophobicContact CB-CD1 3.75Å; K270-F392 HydrophobicContact CB-CE1 3.21Å; K270-F392 HydrophobicContact CB-CE2 4.4Å; K270-F392 HydrophobicContact CB-CZ 3.59Å; K270-F392 HydrophobicContact CD-CB 3.98Å; K270-F392 HydrophobicContact CD-CD1 3.19Å; K270-F392 HydrophobicContact CD-CD2 4.24Å; K270-F392 HydrophobicContact CD-CE1 3.67Å; K270-F392 HydrophobicContact CD-CG 3.51Å; K270-F392 HydrophobicContact CD-CZ 4.35Å; K270-F392 WeakPolarHBondContact CD-O 3.31Å; K270-F392 VanDerWaalsContact CE-O 3.27Å; K270-F392 WeakPolarHBondContact CE-O 3.23Å; K270-F392 HydrophobicContact CG-CD1 4.1Å; K270-F392 HydrophobicContact CG-CE1 4.07Å; K270-F392 PolarHBondContact NZ-O 3.42Å
271	L	95.4	Very high	91	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.005	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	141	176.8	-59.9	103.1	0	0	0	109	L260 R261 I262 V269 W273 I287 N307 L308 I310 F321	L260-L271 HydrophobicContact CD1-CB 4.45Å; L260-L271 HydrophobicContact CD1-CD2 4.2Å; R261-L271 WeakPolarHBondContact O-CA 3.18Å; I262-L271 HydrophobicContact CD1-CD2 3.92Å; I262-L271 HydrophobicContact CD1-CG 4.39Å; I262-L271 HydrophobicContact CG1-CD2 4.14Å; I262-L271 HydrophobicContact CG1-CG 4.25Å; V269-L271 HydrophobicContact CG1-CD1 4.39Å; L271-W273 HydrophobicContact CB-CE3 4.14Å; L271-W273 HydrophobicContact CB-CZ3 3.78Å; L271-I287 HydrophobicContact CD1-CG2 4.47Å; L271-N307 CarbonylContact O-C 3.58Å; L271-N307 WeakPolarHBondContact O-CA 3.48Å; L271-N307 VanDerWaalsContact O-CB 3.27Å; L271-N307 WeakPolarHBondContact O-CB 3.42Å; L271-L308 PolarHBondContact N-O 3.24Å; L271-L308 PolarHBondContact O-N 2.85Å; L271-I310 HydrophobicContact CD1-CD1 3.9Å; L271-F321 HydrophobicContact CD1-CD1 3.86Å; L271-F321 HydrophobicContact CD1-CE1 4.16Å; L271-F321 HydrophobicContact CD1-CG 4.37Å; L271-F321 HydrophobicContact CD2-CB 3.69Å; L271-F321 HydrophobicContact CD2-CD1 4.17Å; L271-F321 HydrophobicContact CD2-CG 3.92Å
272	F	94.1	Very high	91.1	Very high	17 Å²	17	42.6 Å²	42.6	8%	0.075	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	143.1	173.6	-57.5	-94.5	0	0	0	108.9	L260 R261 V263 K270 D306 N307 F392 A394	L260-F272 CarbonylContact C-O 3.51Å; L260-F272 WeakPolarHBondContact CA-O 3.3Å; R261-F272 HydrophobicContact CB-CB 4.39Å; R261-F272 PolarHBondContact N-O 2.93Å; R261-F272 PolarHBondContact O-N 2.76Å; V263-F272 HydrophobicContact CB-CE2 4.39Å; V263-F272 HydrophobicContact CG2-CD2 4.27Å; V263-F272 HydrophobicContact CG2-CE2 3.72Å; K270-F272 HydrophobicContact CB-CE2 4.02Å; K270-F272 HydrophobicContact CB-CZ 4.36Å; K270-F272 HydrophobicContact CD-CE1 4.08Å; K270-F272 HydrophobicContact CD-CE2 4.01Å; K270-F272 HydrophobicContact CD-CZ 3.48Å; K270-F272 VanDerWaalsContact CD-CZ 3.48Å; K270-F272 HydrophobicContact CG-CD2 4.35Å; K270-F272 HydrophobicContact CG-CE1 4.27Å; K270-F272 HydrophobicContact CG-CE2 3.65Å; K270-F272 HydrophobicContact CG-CZ 3.63Å; F272-D306 WeakPolarHBondContact CA-O 3.49Å; F272-N307 HydrophobicContact CD1-CB 3.58Å; F272-N307 HydrophobicContact CE1-CB 3.96Å; F272-N307 HydrophobicContact CG-CB 4.28Å; F272-F392 WeakPolarHBondContact CZ-O 3.17Å; F272-A394 HydrophobicContact CB-CB 4.47Å; F272-A394 HydrophobicContact CD1-CB 3.7Å; F272-A394 HydrophobicContact CD2-CB 4.21Å; F272-A394 HydrophobicContact CE1-CB 3.83Å; F272-A394 HydrophobicContact CE2-CB 4.33Å; F272-A394 HydrophobicContact CG-CB 3.88Å; F272-A394 HydrophobicContact CZ-CB 4.13Å
273	W	94.3	Very high	91.2	Very high	12 Å²	12	42.9 Å²	42.9	5%	0.045	23%	0.23	C	C	.	.			trans	-146.3	167.3	176.2	53.7	94.9	0	0	0	110.5	I257 L260 L271 R275 Y285 I287 T303 K305 D306 L308	I257-W273 HydrophobicContact CD1-CB 3.63Å; I257-W273 HydrophobicContact CD1-CD2 3.83Å; I257-W273 HydrophobicContact CD1-CE3 4.25Å; I257-W273 HydrophobicContact CD1-CG 3.55Å; I257-W273 HydrophobicContact CG1-CB 3.56Å; I257-W273 HydrophobicContact CG1-CG 3.86Å; L260-W273 HydrophobicContact CD1-CB 4.45Å; L260-W273 HydrophobicContact CD1-CE3 4.38Å; L271-W273 HydrophobicContact CB-CE3 4.14Å; L271-W273 HydrophobicContact CB-CZ3 3.78Å; W273-R275 PolarHBondContact O-N 3.46Å; W273-Y285 AromaticContact CD1-CD1 3.95Å; W273-Y285 AromaticContact CD1-CE1 3.73Å; W273-Y285 AromaticContact CD1-CZ 3.88Å; W273-Y285 AromaticContact CE2-CD2 3.87Å; W273-Y285 AromaticContact CE2-CG 3.82Å; W273-Y285 AromaticContact CZ2-CD2 3.87Å; W273-Y285 HydrophobicContact CZ2-CD2 3.87Å; W273-Y285 AromaticContact CZ2-CG 3.91Å; W273-Y285 HydrophobicContact CZ2-CG 3.91Å; W273-Y285 AromaticContact NE1-CD1 3.46Å; W273-Y285 AromaticContact NE1-CD2 3.27Å; W273-Y285 VanDerWaalsContact NE1-CD2 3.27Å; W273-Y285 AromaticContact NE1-CE1 3.5Å; W273-Y285 AromaticContact NE1-CE2 3.34Å; W273-Y285 VanDerWaalsContact NE1-CE2 3.34Å; W273-Y285 AromaticContact NE1-CG 3.35Å; W273-Y285 AromaticContact NE1-CZ 3.46Å; W273-I287 HydrophobicContact CH2-CD1 4.03Å; W273-I287 HydrophobicContact CH2-CG1 4.03Å; W273-I287 HydrophobicContact CZ3-CD1 4.14Å; W273-I287 HydrophobicContact CZ3-CG1 4.4Å; W273-T303 HydrophobicContact CH2-CG2 3.91Å; W273-T303 HydrophobicContact CZ2-CG2 3.79Å; W273-K305 WeakPolarHBondContact CZ2-O 3.31Å; W273-K305 PolarHBondContact NE1-O 3.19Å; W273-D306 PolarHBondContact N-O 2.9Å; W273-L308 HydrophobicContact CH2-CB 3.74Å; W273-L308 HydrophobicContact CZ3-CB 4.03Å
274	Q	92.4	Very high	91.3	Very high	74 Å²	74	46.3 Å²	46.3	35%	0.346	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-75.3	117.9	172.5	-176.1	172.2	-12.6	0	0	109.6	Q258 R259	Q258-Q274 HydrophobicContact CB-CB 4.28Å; Q258-Q274 WeakPolarHBondContact O-CB 3.24Å; Q258-Q274 PolarHBondContact O-N 3.21Å; R259-Q274 HydrophobicContact CB-CB 4.32Å; R259-Q274 VanDerWaalsContact CD-OE1 3.25Å; R259-Q274 VanDerWaalsContact CZ-OE1 3.24Å; R259-Q274 VanDerWaalsContact NE-OE1 3.11Å
275	R	90.7	Very high	91.4	Very high	105 Å²	105	46.4 Å²	46.4	40%	0.396	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-64.2	139.3	171.3	-151.8	-169.7	172	176.9	-0.3	110.1	W273 D278 Y285 D306	W273-R275 PolarHBondContact O-N 3.46Å; R275-D278 IonicContact CZ-OD1 3.45Å; R275-D278 IonicContact NE-OD1 2.85Å; R275-D278 IonicContact NH1-OD1 3.21Å; R275-D278 PolarHBondContact NH1-OD1 3.42Å; R275-Y285 WeakPolarHBondContact CA-OH 3.42Å; R275-Y285 HydrophobicContact CG-CE2 4.45Å; R275-D306 HydrophobicContact CB-CB 3.94Å; R275-D306 HydrophobicContact CG-CB 4.35Å
276	Y	88.3	Confident	91.7	Very high	43 Å²	43	46.6 Å²	46.6	17%	0.169	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-56.3	145.9	155.4	-79.8	-96.3	0	0	0	109.4	D255 I283 Y285 V325	D255-Y276 WeakPolarHBondContact CA-OH 3.38Å; D255-Y276 WeakPolarHBondContact CB-OH 3.43Å; D255-Y276 PolarHBondContact N-OH 2.89Å; D255-Y276 PolarHBondContact O-OH 2.87Å; Y276-I283 HydrophobicContact CD1-CD1 3.51Å; Y276-I283 HydrophobicContact CD2-CD1 4.13Å; Y276-I283 HydrophobicContact CD2-CG2 3.95Å; Y276-I283 HydrophobicContact CE1-CD1 4.23Å; Y276-I283 HydrophobicContact CG-CD1 3.45Å; Y276-I283 VanDerWaalsContact CG-CD1 3.45Å; Y276-I283 HydrophobicContact CG-CG2 4.17Å; Y276-Y285 HydrophobicContact CD2-CE1 4.22Å; Y276-Y285 PolarHBondContact N-OH 2.84Å; Y276-V325 HydrophobicContact CD2-CG1 4.05Å; Y276-V325 HydrophobicContact CE2-CB 4.44Å; Y276-V325 HydrophobicContact CE2-CG1 3.64Å; Y276-V325 HydrophobicContact CE2-CG2 4.12Å
277	G	82.2	Confident	91.9	Very high	44 Å²	44	45 Å²	45	45%	0.454	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-50.3	150.8	-172.9	0	0	0	0	0	113.3	D279 M280	G277-D279 PolarHBondContact O-N 3.34Å; G277-M280 VanDerWaalsContact O-CB 3.3Å; G277-M280 WeakPolarHBondContact O-CB 3.19Å; G277-M280 WeakPolarHBondContact O-CG 3.37Å; G277-M280 PolarHBondContact O-N 2.95Å; G277-M280 VanDerWaalsContact O-N 3.12Å
278	D	78.4	Confident	92	Very high	119 Å²	119	43.6 Å²	43.6	64%	0.636	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-18.6	-171.8	-67.2	-43.9	0	0	0	113.9	R275 M280	R275-D278 IonicContact CZ-OD1 3.45Å; R275-D278 IonicContact NE-OD1 2.85Å; R275-D278 IonicContact NH1-OD1 3.21Å; R275-D278 PolarHBondContact NH1-OD1 3.42Å; D278-M280 PolarHBondContact O-N 2.88Å
279	D	84.2	Confident	92.1	Very high	142 Å²	142	43.5 Å²	43.5	76%	0.759	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.3	6	176	-51.4	-34.8	0	0	0	114.1	G277 P281	G277-D279 PolarHBondContact O-N 3.34Å; D279-P281 VanDerWaalsContact C-CD 3.41Å; D279-P281 VanDerWaalsContact O-CD 3.29Å; D279-P281 WeakPolarHBondContact O-CD 3.26Å
280	M	91.3	Very high	92	Very high	11 Å²	11	47.7 Å²	47.7	5%	0.054	24%	0.241	C	C	.	.			trans	-123.2	62.8	-168.4	-55.7	-73.2	-75.2	0	0	112.5	G227 R228 G277 D278 Y282 I283	G227-M280 WeakPolarHBondContact O-CE 3.32Å; R228-M280 HydrophobicContact CG-CE 4.28Å; R228-M280 PolarHBondContact NH1-SD 2.78Å; G277-M280 VanDerWaalsContact O-CB 3.3Å; G277-M280 WeakPolarHBondContact O-CB 3.19Å; G277-M280 WeakPolarHBondContact O-CG 3.37Å; G277-M280 PolarHBondContact O-N 2.95Å; G277-M280 VanDerWaalsContact O-N 3.12Å; D278-M280 PolarHBondContact O-N 2.88Å; M280-Y282 HydrophobicContact CB-CE1 4.42Å; M280-Y282 HydrophobicContact CE-CE1 4.15Å; M280-Y282 HydrophobicContact CE-CE2 3.79Å; M280-Y282 WeakPolarHBondContact CE-OH 3.49Å; M280-Y282 PolarHBondContact O-N 3.49Å; M280-Y282 VanDerWaalsContact O-N 3.14Å; M280-Y282 HydrophobicContact SD-CE1 3.86Å; M280-Y282 PolarHBondContact SD-OH 2.91Å; M280-I283 HydrophobicContact CB-CD1 3.99Å; M280-I283 HydrophobicContact CB-CG1 4.25Å; M280-I283 HydrophobicContact CE-CD1 3.63Å; M280-I283 HydrophobicContact CE-CG1 4.42Å; M280-I283 PolarHBondContact O-N 2.96Å; M280-I283 VanDerWaalsContact O-N 3.17Å
281	P	90.8	Very high	91.6	Very high	110 Å²	110	47.8 Å²	47.8	71%	0.714	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-15.1	-174.1	28.5	-36.7	0	0	0	114.2	D279 I283	D279-P281 VanDerWaalsContact C-CD 3.41Å; D279-P281 VanDerWaalsContact O-CD 3.29Å; D279-P281 WeakPolarHBondContact O-CD 3.26Å; P281-I283 VanDerWaalsContact C-N 3.28Å
282	Y	93.8	Very high	90.7	Very high	31 Å²	31	51 Å²	51	12%	0.122	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-1.3	178.3	55.5	-87.6	0	0	0	113.7	G227 R229 T251 M280 A327 D328	G227-Y282 WeakPolarHBondContact O-CE2 3.26Å; R229-Y282 HydrophobicContact CG-CD2 4.38Å; R229-Y282 HydrophobicContact CG-CE1 4.19Å; R229-Y282 HydrophobicContact CG-CE2 3.79Å; R229-Y282 PolarHBondContact N-OH 3.43Å; T251-Y282 HydrophobicContact CG2-CE2 4.31Å; M280-Y282 HydrophobicContact CB-CE1 4.42Å; M280-Y282 HydrophobicContact CE-CE1 4.15Å; M280-Y282 HydrophobicContact CE-CE2 3.79Å; M280-Y282 WeakPolarHBondContact CE-OH 3.49Å; M280-Y282 PolarHBondContact O-N 3.49Å; M280-Y282 VanDerWaalsContact O-N 3.14Å; M280-Y282 HydrophobicContact SD-CE1 3.86Å; M280-Y282 PolarHBondContact SD-OH 2.91Å; Y282-A327 HydrophobicContact CD2-CB 4.47Å; Y282-D328 WeakPolarHBondContact CB-OD1 3.49Å; Y282-D328 PolarHBondContact O-N 2.88Å
283	I	95.3	Very high	89.7	Confident	7 Å²	7	55.1 Å²	55.1	4%	0.036	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	126.8	174	-63.9	-176.9	0	0	0	110.1	Y276 M280 P281 Y285 V325 I326 A327	Y276-I283 HydrophobicContact CD1-CD1 3.51Å; Y276-I283 HydrophobicContact CD2-CD1 4.13Å; Y276-I283 HydrophobicContact CD2-CG2 3.95Å; Y276-I283 HydrophobicContact CE1-CD1 4.23Å; Y276-I283 HydrophobicContact CG-CD1 3.45Å; Y276-I283 VanDerWaalsContact CG-CD1 3.45Å; Y276-I283 HydrophobicContact CG-CG2 4.17Å; M280-I283 HydrophobicContact CB-CD1 3.99Å; M280-I283 HydrophobicContact CB-CG1 4.25Å; M280-I283 HydrophobicContact CE-CD1 3.63Å; M280-I283 HydrophobicContact CE-CG1 4.42Å; M280-I283 PolarHBondContact O-N 2.96Å; M280-I283 VanDerWaalsContact O-N 3.17Å; P281-I283 VanDerWaalsContact C-N 3.28Å; I283-Y285 HydrophobicContact CG2-CE1 4.4Å; I283-V325 HydrophobicContact CG2-CG1 3.65Å; I283-I326 WeakPolarHBondContact CA-O 3.24Å; I283-A327 HydrophobicContact CG1-CB 4.02Å
284	R	95.7	Very high	88.3	Confident	78 Å²	78	57 Å²	57	29%	0.294	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	162	173.3	63.6	-170.8	-179.2	-78.2	2.9	110.6	E302 I326 D328	R284-E302 WeakPolarHBondContact CD-OE2 3.44Å; R284-E302 IonicContact NE-OE2 3.74Å; R284-E302 PolarHBondContact NE-OE2 3.37Å; R284-I326 HydrophobicContact CG-CB 3.82Å; R284-I326 HydrophobicContact CG-CD1 4.3Å; R284-I326 HydrophobicContact CG-CG2 4.35Å; R284-I326 PolarHBondContact N-O 2.86Å; R284-I326 PolarHBondContact O-N 2.92Å; R284-D328 PolarHBondContact NH1-O 2.83Å; R284-D328 PolarHBondContact NH2-O 2.83Å
285	Y	96.4	Very high	87.1	Confident	3 Å²	3	58 Å²	58	1%	0.012	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	126.2	-179.7	-50.9	-83.8	0	0	0	109.1	W273 R275 Y276 I283 E302 T303 K305 T324 V325	W273-Y285 AromaticContact CD1-CD1 3.95Å; W273-Y285 AromaticContact CD1-CE1 3.73Å; W273-Y285 AromaticContact CD1-CZ 3.88Å; W273-Y285 AromaticContact CE2-CD2 3.87Å; W273-Y285 AromaticContact CE2-CG 3.82Å; W273-Y285 AromaticContact CZ2-CD2 3.87Å; W273-Y285 HydrophobicContact CZ2-CD2 3.87Å; W273-Y285 AromaticContact CZ2-CG 3.91Å; W273-Y285 HydrophobicContact CZ2-CG 3.91Å; W273-Y285 AromaticContact NE1-CD1 3.46Å; W273-Y285 AromaticContact NE1-CD2 3.27Å; W273-Y285 VanDerWaalsContact NE1-CD2 3.27Å; W273-Y285 AromaticContact NE1-CE1 3.5Å; W273-Y285 AromaticContact NE1-CE2 3.34Å; W273-Y285 VanDerWaalsContact NE1-CE2 3.34Å; W273-Y285 AromaticContact NE1-CG 3.35Å; W273-Y285 AromaticContact NE1-CZ 3.46Å; R275-Y285 WeakPolarHBondContact CA-OH 3.42Å; R275-Y285 HydrophobicContact CG-CE2 4.45Å; Y276-Y285 HydrophobicContact CD2-CE1 4.22Å; Y276-Y285 PolarHBondContact N-OH 2.84Å; I283-Y285 HydrophobicContact CG2-CE1 4.4Å; Y285-E302 CarbonylContact O-C 3.51Å; Y285-E302 VanDerWaalsContact O-CA 3.31Å; Y285-E302 WeakPolarHBondContact O-CA 3.35Å; Y285-T303 WeakPolarHBondContact CD2-O 3.29Å; Y285-T303 PolarHBondContact N-O 3.41Å; Y285-T303 PolarHBondContact O-N 3.29Å; Y285-K305 VanDerWaalsContact CD2-O 3.27Å; Y285-K305 WeakPolarHBondContact CD2-O 3.4Å; Y285-K305 WeakPolarHBondContact CE2-O 3.4Å; Y285-T324 WeakPolarHBondContact CA-O 3Å; Y285-V325 HydrophobicContact CD1-CB 4.49Å; Y285-V325 HydrophobicContact CD1-CG1 4.36Å; Y285-V325 HydrophobicContact CD1-CG2 4Å; Y285-V325 HydrophobicContact CE1-CG1 4.11Å; Y285-V325 HydrophobicContact CE1-CG2 4.02Å
286	R	96.9	Very high	86.3	Confident	59 Å²	59	60.9 Å²	60.9	22%	0.223	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	118.1	170.4	-175.6	-172.7	-59.5	142.7	2	108.7	V300 L301 E302 A323 T324 I326 E331	R286-V300 HydrophobicContact CG-CG1 3.73Å; R286-L301 CarbonylContact C-O 3.52Å; R286-L301 WeakPolarHBondContact CA-O 3.31Å; R286-E302 HydrophobicContact CB-CG 4.09Å; R286-E302 HydrophobicContact CG-CG 4.07Å; R286-E302 IonicContact CZ-OE1 3.6Å; R286-E302 IonicContact NE-OE1 3.64Å; R286-E302 PolarHBondContact NE-OE1 2.97Å; R286-E302 IonicContact NH2-OE1 3.13Å; R286-E302 PolarHBondContact NH2-OE1 3.3Å; R286-A323 WeakPolarHBondContact O-CA 3.39Å; R286-T324 PolarHBondContact N-O 3.1Å; R286-T324 PolarHBondContact O-N 2.89Å; R286-I326 HydrophobicContact CB-CD1 3.75Å; R286-I326 VanDerWaalsContact NH2-CD1 3.29Å; R286-E331 IonicContact CZ-OE1 3.63Å; R286-E331 IonicContact NH1-OE1 3.2Å; R286-E331 PolarHBondContact NH1-OE1 3.48Å; R286-E331 IonicContact NH1-OE2 2.73Å; R286-E331 PolarHBondContact NH1-OE2 2.84Å; R286-E331 IonicContact NH2-OE1 2.95Å; R286-E331 PolarHBondContact NH2-OE1 2.85Å
287	I	96.7	Very high	85.9	Confident	1 Å²	1	63.2 Å²	63.2	1%	0.005	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	128.8	176.9	-49.2	-58.7	0	0	0	108.1	L271 W273 L301 L308 I310 S322 A323	L271-I287 HydrophobicContact CD1-CG2 4.47Å; W273-I287 HydrophobicContact CH2-CD1 4.03Å; W273-I287 HydrophobicContact CH2-CG1 4.03Å; W273-I287 HydrophobicContact CZ3-CD1 4.14Å; W273-I287 HydrophobicContact CZ3-CG1 4.4Å; I287-L301 PolarHBondContact N-O 3.45Å; I287-L301 PolarHBondContact O-N 2.96Å; I287-L308 HydrophobicContact CB-CD2 3.63Å; I287-L308 HydrophobicContact CG1-CD2 3.7Å; I287-L308 HydrophobicContact CG2-CD2 3.92Å; I287-I310 HydrophobicContact CG2-CD1 4.42Å; I287-S322 CarbonylContact C-O 3.56Å; I287-S322 WeakPolarHBondContact CA-O 3.22Å; I287-A323 HydrophobicContact CD1-CB 3.44Å; I287-A323 VanDerWaalsContact CD1-CB 3.44Å
288	T	94.8	Very high	86.2	Confident	31 Å²	31	64.2 Å²	64.2	19%	0.19	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	135	174.1	60.4	0	0	0	0	108.9	L299 V300 F321 S322	T288-L299 CarbonylContact C-O 3.55Å; T288-L299 VanDerWaalsContact CA-O 3.25Å; T288-L299 WeakPolarHBondContact CA-O 3.41Å; T288-V300 HydrophobicContact CG2-CB 4.48Å; T288-V300 HydrophobicContact CG2-CG1 4.18Å; T288-V300 HydrophobicContact CG2-CG2 3.98Å; T288-F321 CarbonylContact O-C 3.55Å; T288-F321 VanDerWaalsContact O-CA 3.25Å; T288-F321 WeakPolarHBondContact O-CA 3.45Å; T288-S322 PolarHBondContact N-O 2.78Å; T288-S322 PolarHBondContact O-N 2.88Å; T288-S322 WeakPolarHBondContact OG1-CB 3.16Å; T288-S322 PolarHBondContact OG1-O 3.46Å; T288-S322 VanDerWaalsContact OG1-O 3.13Å; T288-S322 PolarHBondContact OG1-OG 2.85Å
289	C	93.8	Very high	86.7	Confident	11 Å²	11	62.6 Å²	62.6	7%	0.074	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	122	171.7	178.2	0	0	0	0	108.2	P298 L299 I310 F321	C289-P298 WeakPolarHBondContact O-CA 3.24Å; C289-L299 HydrophobicContact CB-CB 4.26Å; C289-L299 PolarHBondContact N-O 3.24Å; C289-L299 PolarHBondContact O-N 3.31Å; C289-I310 HydrophobicContact CB-CD1 4.02Å; C289-F321 HydrophobicContact CB-CD1 3.93Å; C289-F321 HydrophobicContact CB-CE1 3.78Å; C289-F321 WeakPolarHBondContact SG-CE1 3.32Å
290	F	91.9	Very high	87.2	Confident	88 Å²	88	59.5 Å²	59.5	39%	0.386	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	125.7	179.9	176.5	-109.6	0	0	0	109.8	P292 P298 T320	F290-P292 HydrophobicContact CE1-CB 4.01Å; F290-P298 HydrophobicContact CB-CB 4.42Å; F290-P298 HydrophobicContact CD2-CB 4.43Å; F290-T320 PolarHBondContact N-O 2.81Å; F290-T320 PolarHBondContact O-N 2.86Å
291	D	86.7	Confident	87.4	Confident	16 Å²	16	61.9 Å²	61.9	9%	0.086	36%	0.356	C	S	.	.			trans	-89.3	116.7	167.6	-167.1	-36.3	0	0	0	108.1	T293 E294 Y319	D291-T293 PolarHBondContact O-N 3.33Å; D291-T293 WeakPolarHBondContact OD1-CA 3.33Å; D291-T293 WeakPolarHBondContact OD1-CB 3.34Å; D291-T293 PolarHBondContact OD1-N 3.04Å; D291-T293 PolarHBondContact OD1-OG1 2.91Å; D291-E294 HydrophobicContact CB-CB 4.37Å; D291-E294 VanDerWaalsContact O-O 3.11Å; D291-E294 PolarHBondContact OD1-N 3.46Å; D291-Y319 HydrophobicContact CB-CD1 4Å; D291-Y319 HydrophobicContact CB-CE1 3.71Å; D291-Y319 WeakPolarHBondContact OD2-CE1 3.45Å; D291-Y319 PolarHBondContact OD2-OH 3.5Å
292	P	75.8	Confident	87.6	Confident	69 Å²	69	61.2 Å²	61.2	45%	0.448	34%	0.343	S	S	.	.	S	Bend	trans	-70.4	-16.2	177.8	29.8	-31.4	0	0	0	113.5	F290 W318	F290-P292 HydrophobicContact CE1-CB 4.01Å; P292-W318 WeakPolarHBondContact CD-O 3.45Å; P292-W318 HydrophobicContact CG-CB 4.04Å
293	T	72.4	Confident	87.7	Confident	103 Å²	103	60.9 Å²	60.9	63%	0.632	35%	0.345	S	S	*	.	S	Bend	trans	-90.4	-31.6	-176.4	68.7	0	0	0	0	112.7	D291	D291-T293 PolarHBondContact O-N 3.33Å; D291-T293 WeakPolarHBondContact OD1-CA 3.33Å; D291-T293 WeakPolarHBondContact OD1-CB 3.34Å; D291-T293 PolarHBondContact OD1-N 3.04Å; D291-T293 PolarHBondContact OD1-OG1 2.91Å
294	E	66.1	Low	87.5	Confident	51 Å²	51	63 Å²	63	24%	0.238	36%	0.363	C	S	.	.	S	Bend	trans	-99	127	176.3	-69.4	-170.8	140.7	0	0	110.7	D291 R296	D291-E294 HydrophobicContact CB-CB 4.37Å; D291-E294 VanDerWaalsContact O-O 3.11Å; D291-E294 PolarHBondContact OD1-N 3.46Å; E294-R296 HydrophobicContact CB-CB 4.37Å; E294-R296 HydrophobicContact CB-CG 4.12Å; E294-R296 VanDerWaalsContact CD-NH1 3.3Å; E294-R296 PolarHBondContact O-N 3.23Å; E294-R296 IonicContact OE1-CZ 3.61Å; E294-R296 IonicContact OE1-NE 3.77Å; E294-R296 IonicContact OE1-NH1 2.77Å; E294-R296 PolarHBondContact OE1-NH1 2.98Å; E294-R296 VanDerWaalsContact OE1-NH1 3.13Å; E294-R296 IonicContact OE1-NH2 2.71Å; E294-R296 PolarHBondContact OE1-NH2 2.86Å; E294-R296 WeakPolarHBondContact OE2-CD 3.28Å; E294-R296 IonicContact OE2-CZ 2.76Å; E294-R296 IonicContact OE2-NE 3.68Å; E294-R296 PolarHBondContact OE2-NE 3.25Å; E294-R296 IonicContact OE2-NH1 3.09Å; E294-R296 PolarHBondContact OE2-NH1 3.46Å; E294-R296 IonicContact OE2-NH2 3.81Å
295	G	66.8	Low	87.4	Confident	95 Å²	95	65.9 Å²	65.9	98%	0.979	38%	0.378	S	S	*	.			trans	-67.6	26.9	170.8	0	0	0	0	0	114.6
296	R	73.8	Confident	87.1	Confident	167 Å²	167	69.2 Å²	69.2	63%	0.63	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-76.3	153.4	177.7	-72.7	-174.2	-172.3	151.1	6.9	110.4	E294	E294-R296 HydrophobicContact CB-CB 4.37Å; E294-R296 HydrophobicContact CB-CG 4.12Å; E294-R296 VanDerWaalsContact CD-NH1 3.3Å; E294-R296 PolarHBondContact O-N 3.23Å; E294-R296 IonicContact OE1-CZ 3.61Å; E294-R296 IonicContact OE1-NE 3.77Å; E294-R296 IonicContact OE1-NH1 2.77Å; E294-R296 PolarHBondContact OE1-NH1 2.98Å; E294-R296 VanDerWaalsContact OE1-NH1 3.13Å; E294-R296 IonicContact OE1-NH2 2.71Å; E294-R296 PolarHBondContact OE1-NH2 2.86Å; E294-R296 WeakPolarHBondContact OE2-CD 3.28Å; E294-R296 IonicContact OE2-CZ 2.76Å; E294-R296 IonicContact OE2-NE 3.68Å; E294-R296 PolarHBondContact OE2-NE 3.25Å; E294-R296 IonicContact OE2-NH1 3.09Å; E294-R296 PolarHBondContact OE2-NH1 3.46Å; E294-R296 IonicContact OE2-NH2 3.81Å
297	A	80.8	Confident	87	Confident	91 Å²	91	68.2 Å²	68.2	75%	0.752	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-62.4	140.9	171	0	0	0	0	0	110.1
298	P	87.4	Confident	86.9	Confident	66 Å²	66	69.5 Å²	69.5	43%	0.429	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-62.4	139.7	179.3	26.3	-34	0	0	0	110.6	C289 F290 V300	C289-P298 WeakPolarHBondContact O-CA 3.24Å; F290-P298 HydrophobicContact CB-CB 4.42Å; F290-P298 HydrophobicContact CD2-CB 4.43Å; P298-V300 PolarHBondContact O-N 2.91Å
299	L	90.3	Very high	86.9	Confident	85 Å²	85	71 Å²	71	45%	0.445	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	118	171.7	173.9	66.6	0	0	0	108.4	T288 C289 L301 I310	T288-L299 CarbonylContact C-O 3.55Å; T288-L299 VanDerWaalsContact CA-O 3.25Å; T288-L299 WeakPolarHBondContact CA-O 3.41Å; C289-L299 HydrophobicContact CB-CB 4.26Å; C289-L299 PolarHBondContact N-O 3.24Å; C289-L299 PolarHBondContact O-N 3.31Å; L299-L301 HydrophobicContact CD1-CD2 4.24Å; L299-L301 HydrophobicContact CD1-CG 4.26Å; L299-L301 HydrophobicContact CD2-CD1 3.99Å; L299-L301 HydrophobicContact CD2-CG 4.45Å; L299-L301 HydrophobicContact CG-CD1 4.19Å; L299-L301 HydrophobicContact CG-CG 4.1Å; L299-I310 HydrophobicContact CD2-CG2 4.28Å
300	V	94.2	Very high	86.9	Confident	76 Å²	76	70.8 Å²	70.8	46%	0.461	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	124.1	178.6	-173.7	0	0	0	0	109.4	R286 T288 P298	R286-V300 HydrophobicContact CG-CG1 3.73Å; T288-V300 HydrophobicContact CG2-CB 4.48Å; T288-V300 HydrophobicContact CG2-CG1 4.18Å; T288-V300 HydrophobicContact CG2-CG2 3.98Å; P298-V300 PolarHBondContact O-N 2.91Å
301	L	95.7	Very high	86.9	Confident	61 Å²	61	72.6 Å²	72.6	32%	0.319	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	134.7	-179.6	-64.5	172.4	0	0	0	109.8	R286 I287 L299 L308 I310	R286-L301 CarbonylContact C-O 3.52Å; R286-L301 WeakPolarHBondContact CA-O 3.31Å; I287-L301 PolarHBondContact N-O 3.45Å; I287-L301 PolarHBondContact O-N 2.96Å; L299-L301 HydrophobicContact CD1-CD2 4.24Å; L299-L301 HydrophobicContact CD1-CG 4.26Å; L299-L301 HydrophobicContact CD2-CD1 3.99Å; L299-L301 HydrophobicContact CD2-CG 4.45Å; L299-L301 HydrophobicContact CG-CD1 4.19Å; L299-L301 HydrophobicContact CG-CG 4.1Å; L301-L308 HydrophobicContact CB-CD2 4.04Å; L301-L308 HydrophobicContact CD1-CD1 4.31Å; L301-L308 HydrophobicContact CD1-CD2 3.91Å; L301-L308 HydrophobicContact CD1-CG 4.48Å; L301-I310 HydrophobicContact CD1-CG1 4.39Å
302	E	94.7	Very high	87.1	Confident	96 Å²	96	81.3 Å²	81.3	45%	0.449	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	136.5	171.5	-63.1	-162.2	169.1	0	0	110.6	R284 Y285 R286	R284-E302 WeakPolarHBondContact CD-OE2 3.44Å; R284-E302 IonicContact NE-OE2 3.74Å; R284-E302 PolarHBondContact NE-OE2 3.37Å; Y285-E302 CarbonylContact O-C 3.51Å; Y285-E302 VanDerWaalsContact O-CA 3.31Å; Y285-E302 WeakPolarHBondContact O-CA 3.35Å; R286-E302 HydrophobicContact CB-CG 4.09Å; R286-E302 HydrophobicContact CG-CG 4.07Å; R286-E302 IonicContact CZ-OE1 3.6Å; R286-E302 IonicContact NE-OE1 3.64Å; R286-E302 PolarHBondContact NE-OE1 2.97Å; R286-E302 IonicContact NH2-OE1 3.13Å; R286-E302 PolarHBondContact NH2-OE1 3.3Å
303	T	94.6	Very high	87.9	Confident	25 Å²	25	78.9 Å²	78.9	15%	0.153	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	149.2	-179.1	-177.7	0	0	0	0	111.3	W273 Y285 K305	W273-T303 HydrophobicContact CH2-CG2 3.91Å; W273-T303 HydrophobicContact CZ2-CG2 3.79Å; Y285-T303 WeakPolarHBondContact CD2-O 3.29Å; Y285-T303 PolarHBondContact N-O 3.41Å; Y285-T303 PolarHBondContact O-N 3.29Å; T303-K305 WeakPolarHBondContact OG1-CB 3.44Å; T303-K305 PolarHBondContact OG1-N 2.97Å; T303-K305 VanDerWaalsContact OG1-N 3.1Å
304	A	92.5	Very high	88.8	Confident	51 Å²	51	78.9 Å²	78.9	42%	0.421	43%	0.429	S	S	.	.	S	Bend	trans	-96	-2.6	169.7	0	0	0	0	0	112.8
305	K	92.4	Very high	90.1	Very high	139 Å²	139	78 Å²	78	60%	0.604	43%	0.428	S	S	*	.	S	Bend	trans	-76.1	168.8	178	-60.2	-179	-179.1	176	0	110.9	W273 Y285 T303	W273-K305 WeakPolarHBondContact CZ2-O 3.31Å; W273-K305 PolarHBondContact NE1-O 3.19Å; Y285-K305 VanDerWaalsContact CD2-O 3.27Å; Y285-K305 WeakPolarHBondContact CD2-O 3.4Å; Y285-K305 WeakPolarHBondContact CE2-O 3.4Å; T303-K305 WeakPolarHBondContact OG1-CB 3.44Å; T303-K305 PolarHBondContact OG1-N 2.97Å; T303-K305 VanDerWaalsContact OG1-N 3.1Å
306	D	91.9	Very high	91.2	Very high	73 Å²	73	76.9 Å²	76.9	39%	0.39	41%	0.405	S	S	.	.	S	Bend	trans	-94.7	4.4	176.9	67.2	-15.1	0	0	0	113.3	F272 W273 R275	F272-D306 WeakPolarHBondContact CA-O 3.49Å; W273-D306 PolarHBondContact N-O 2.9Å; R275-D306 HydrophobicContact CB-CB 3.94Å; R275-D306 HydrophobicContact CG-CB 4.35Å
307	N	93.6	Very high	92.1	Very high	38 Å²	38	69.9 Å²	69.9	20%	0.203	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	156.7	178.9	67.6	84.8	0	0	0	111.4	K270 L271 F272	K270-N307 VanDerWaalsContact CE-OD1 3.3Å; K270-N307 WeakPolarHBondContact CE-OD1 3.46Å; L271-N307 CarbonylContact O-C 3.58Å; L271-N307 WeakPolarHBondContact O-CA 3.48Å; L271-N307 VanDerWaalsContact O-CB 3.27Å; L271-N307 WeakPolarHBondContact O-CB 3.42Å; F272-N307 HydrophobicContact CD1-CB 3.58Å; F272-N307 HydrophobicContact CE1-CB 3.96Å; F272-N307 HydrophobicContact CG-CB 4.28Å
308	L	95	Very high	92.7	Very high	27 Å²	27	70.4 Å²	70.4	14%	0.141	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	128.7	175.8	-178.1	67.3	0	0	0	110	K270 L271 W273 I287 L301 I310	K270-L308 WeakPolarHBondContact CA-O 3.39Å; L271-L308 PolarHBondContact N-O 3.24Å; L271-L308 PolarHBondContact O-N 2.85Å; W273-L308 HydrophobicContact CH2-CB 3.74Å; W273-L308 HydrophobicContact CZ3-CB 4.03Å; I287-L308 HydrophobicContact CB-CD2 3.63Å; I287-L308 HydrophobicContact CG1-CD2 3.7Å; I287-L308 HydrophobicContact CG2-CD2 3.92Å; L301-L308 HydrophobicContact CB-CD2 4.04Å; L301-L308 HydrophobicContact CD1-CD1 4.31Å; L301-L308 HydrophobicContact CD1-CD2 3.91Å; L301-L308 HydrophobicContact CD1-CG 4.48Å; L308-I310 HydrophobicContact CD2-CD1 4.24Å; L308-I310 HydrophobicContact CD2-CG1 4.3Å; L308-I310 HydrophobicContact CG-CG1 4.29Å
309	L	93.6	Very high	93	Very high	62 Å²	62	67.9 Å²	67.9	33%	0.325	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	126.8	172.8	176.6	64.5	0	0	0	108.9	K270 E311 F392	K270-L309 HydrophobicContact CB-CD1 3.96Å; K270-L309 HydrophobicContact CD-CB 4.33Å; K270-L309 HydrophobicContact CD-CD1 4.45Å; K270-L309 HydrophobicContact CG-CB 4.36Å; K270-L309 HydrophobicContact CG-CD1 4.47Å; L309-E311 HydrophobicContact CD1-CG 4.29Å; L309-E311 HydrophobicContact CD2-CG 3.81Å; L309-E311 HydrophobicContact CG-CG 3.69Å; L309-F392 HydrophobicContact CD1-CD1 3.87Å; L309-F392 HydrophobicContact CD1-CE1 3.67Å
310	I	94.2	Very high	93.2	Very high	8 Å²	8	65.2 Å²	65.2	4%	0.041	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	119.8	173.3	-64.5	170.8	0	0	0	107	S268 V269 L271 I287 C289 L299 L301 L308 L313 F321	S268-I310 CarbonylContact C-O 3.58Å; S268-I310 WeakPolarHBondContact CA-O 3.37Å; S268-I310 VanDerWaalsContact CB-O 3.3Å; S268-I310 WeakPolarHBondContact CB-O 3.22Å; V269-I310 PolarHBondContact N-O 3.25Å; V269-I310 PolarHBondContact O-N 2.78Å; L271-I310 HydrophobicContact CD1-CD1 3.9Å; I287-I310 HydrophobicContact CG2-CD1 4.42Å; C289-I310 HydrophobicContact CB-CD1 4.02Å; L299-I310 HydrophobicContact CD2-CG2 4.28Å; L301-I310 HydrophobicContact CD1-CG1 4.39Å; L308-I310 HydrophobicContact CD2-CD1 4.24Å; L308-I310 HydrophobicContact CD2-CG1 4.3Å; L308-I310 HydrophobicContact CG-CG1 4.29Å; I310-L313 HydrophobicContact CG2-CD1 4.25Å; I310-L313 HydrophobicContact CG2-CD2 3.93Å; I310-L313 HydrophobicContact CG2-CG 4.26Å; I310-F321 HydrophobicContact CB-CE1 4.43Å; I310-F321 HydrophobicContact CD1-CD1 3.77Å; I310-F321 HydrophobicContact CD1-CE1 3.45Å; I310-F321 VanDerWaalsContact CD1-CE1 3.45Å; I310-F321 HydrophobicContact CG1-CE1 4.49Å
311	E	92.5	Very high	93.2	Very high	125 Å²	125	61.6 Å²	61.6	58%	0.584	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.5	175.6	-175.3	-54.9	-173.8	117.8	0	0	111	T267 L309 L313	T267-E311 CarbonylContact O-C 3.6Å; L309-E311 HydrophobicContact CD1-CG 4.29Å; L309-E311 HydrophobicContact CD2-CG 3.81Å; L309-E311 HydrophobicContact CG-CG 3.69Å; E311-L313 VanDerWaalsContact C-N 3.29Å; E311-L313 PolarHBondContact O-N 2.59Å
312	K	90.3	Very high	93.2	Very high	199 Å²	199	59.9 Å²	59.9	87%	0.865	31%	0.305	S	S	*	.	S	Bend	trans	62.5	34.5	177.9	-52.6	178.2	179.6	178.2	0	113.3	T267	T267-K312 PolarHBondContact O-N 3.32Å; T267-K312 VanDerWaalsContact O-N 3.08Å
313	L	92.3	Very high	93.2	Very high	18 Å²	18	55.3 Å²	55.3	9%	0.094	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-85.3	158.1	172.1	-57	178.5	0	0	0	110.7	T267 V269 I310 E311 Y319 F321 T341	T267-L313 VanDerWaalsContact CA-O 3.27Å; T267-L313 WeakPolarHBondContact CA-O 3.43Å; T267-L313 WeakPolarHBondContact CB-O 3.42Å; T267-L313 WeakPolarHBondContact CG2-O 3.37Å; T267-L313 PolarHBondContact O-N 3.15Å; V269-L313 HydrophobicContact CB-CD1 3.93Å; V269-L313 HydrophobicContact CG2-CD1 3.61Å; I310-L313 HydrophobicContact CG2-CD1 4.25Å; I310-L313 HydrophobicContact CG2-CD2 3.93Å; I310-L313 HydrophobicContact CG2-CG 4.26Å; E311-L313 VanDerWaalsContact C-N 3.29Å; E311-L313 PolarHBondContact O-N 2.59Å; L313-Y319 HydrophobicContact CB-CE2 3.8Å; L313-Y319 HydrophobicContact CD1-CD2 4.24Å; L313-Y319 HydrophobicContact CD1-CE2 4.33Å; L313-Y319 HydrophobicContact CD2-CD1 4.14Å; L313-Y319 HydrophobicContact CD2-CD2 4.46Å; L313-Y319 HydrophobicContact CD2-CE1 3.8Å; L313-Y319 HydrophobicContact CD2-CE2 4.13Å; L313-Y319 HydrophobicContact CD2-CG 4.47Å; L313-Y319 HydrophobicContact CG-CE2 4.3Å; L313-F321 HydrophobicContact CD1-CZ 4.31Å; L313-T341 HydrophobicContact CB-CG2 4.11Å; L313-T341 HydrophobicContact CD1-CG2 4.2Å
314	E	92.4	Very high	93.3	Very high	103 Å²	103	54.7 Å²	54.7	48%	0.481	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-84	142.4	174.9	-61.5	-163.2	160.7	0	0	111.1	S317 Y319 T341	E314-S317 WeakPolarHBondContact O-CB 3.36Å; E314-Y319 PolarHBondContact N-OH 3.3Å; E314-T341 WeakPolarHBondContact O-CB 3.35Å; E314-T341 PolarHBondContact O-OG1 2.95Å
315	P	92.5	Very high	93.6	Very high	33 Å²	33	52.2 Å²	52.2	21%	0.214	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	154.3	173.4	-20.1	32.3	0	0	0	113.4	S266 T267 S317 T341	S266-P315 WeakPolarHBondContact O-CA 3.26Å; S266-P315 WeakPolarHBondContact O-CG 3.43Å; T267-P315 HydrophobicContact CG2-CG 4.01Å; P315-S317 PolarHBondContact O-N 3.23Å; P315-S317 VanDerWaalsContact O-N 3.13Å; P315-S317 PolarHBondContact O-OG 3.43Å; P315-T341 VanDerWaalsContact C-OG1 3.26Å; P315-T341 WeakPolarHBondContact CA-OG1 3.3Å
316	S	91.2	Very high	93.7	Very high	71 Å²	71	45.7 Å²	45.7	50%	0.497	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.1	31.2	178.1	-47.5	0	0	0	0	114.4	T341 I342 G343	S316-T341 VanDerWaalsContact CA-O 3.23Å; S316-T341 WeakPolarHBondContact CA-O 3.26Å; S316-T341 PolarHBondContact N-O 3.13Å; S316-T341 VanDerWaalsContact N-O 3.17Å; S316-T341 PolarHBondContact N-OG1 3.27Å; S316-I342 PolarHBondContact N-O 3.47Å; S316-G343 WeakPolarHBondContact OG-CA 3.14Å
317	S	92.5	Very high	93.9	Very high	21 Å²	21	42.2 Å²	42.2	15%	0.147	21%	0.212	C	C	.	.			trans	-122.1	144	-172.7	-61.6	0	0	0	0	110.6	E314 P315 M340 T341	E314-S317 WeakPolarHBondContact O-CB 3.36Å; P315-S317 PolarHBondContact O-N 3.23Å; P315-S317 VanDerWaalsContact O-N 3.13Å; P315-S317 PolarHBondContact O-OG 3.43Å; S317-M340 CarbonylContact O-C 3.57Å; S317-M340 WeakPolarHBondContact O-CA 3.28Å; S317-T341 PolarHBondContact N-OG1 3.08Å; S317-T341 PolarHBondContact O-N 2.69Å; S317-T341 PolarHBondContact O-OG1 3.21Å
318	W	93.2	Very high	93.9	Very high	101 Å²	101	42.1 Å²	42.1	38%	0.383	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	135.8	-178	-71.6	99.5	0	0	0	110.7	P292 T338 M340 S372	P292-W318 WeakPolarHBondContact CD-O 3.45Å; P292-W318 HydrophobicContact CG-CB 4.04Å; W318-T338 HydrophobicContact CE3-CG2 3.68Å; W318-T338 HydrophobicContact CZ3-CG2 4.18Å; W318-M340 HydrophobicContact CD2-CB 3.95Å; W318-M340 HydrophobicContact CD2-CG 4.2Å; W318-M340 HydrophobicContact CE3-CB 3.84Å; W318-M340 HydrophobicContact CG-CG 4.5Å; W318-M340 HydrophobicContact CH2-CB 4.24Å; W318-M340 HydrophobicContact CZ2-CB 4.27Å; W318-M340 HydrophobicContact CZ2-SD 4.16Å; W318-M340 HydrophobicContact CZ3-CB 4.01Å; W318-S372 WeakPolarHBondContact CH2-O 3.43Å
319	Y	93.9	Very high	93.7	Very high	13 Å²	13	47.8 Å²	47.8	5%	0.051	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	139.9	172	-67.4	-80.8	0	0	0	109.5	D291 L313 E314 T338 V339 T341	D291-Y319 HydrophobicContact CB-CD1 4Å; D291-Y319 HydrophobicContact CB-CE1 3.71Å; D291-Y319 WeakPolarHBondContact OD2-CE1 3.45Å; D291-Y319 PolarHBondContact OD2-OH 3.5Å; L313-Y319 HydrophobicContact CB-CE2 3.8Å; L313-Y319 HydrophobicContact CD1-CD2 4.24Å; L313-Y319 HydrophobicContact CD1-CE2 4.33Å; L313-Y319 HydrophobicContact CD2-CD1 4.14Å; L313-Y319 HydrophobicContact CD2-CD2 4.46Å; L313-Y319 HydrophobicContact CD2-CE1 3.8Å; L313-Y319 HydrophobicContact CD2-CE2 4.13Å; L313-Y319 HydrophobicContact CD2-CG 4.47Å; L313-Y319 HydrophobicContact CG-CE2 4.3Å; E314-Y319 PolarHBondContact N-OH 3.3Å; Y319-T338 CarbonylContact O-C 3.51Å; Y319-T338 WeakPolarHBondContact O-CA 3.4Å; Y319-V339 PolarHBondContact N-O 3.18Å; Y319-V339 PolarHBondContact O-N 2.93Å; Y319-T341 HydrophobicContact CD2-CG2 3.91Å; Y319-T341 HydrophobicContact CE2-CG2 3.88Å
320	T	94	Very high	93.8	Very high	29 Å²	29	46.2 Å²	46.2	18%	0.178	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	119	173.2	-59.6	0	0	0	0	109.3	F290 T338	F290-T320 PolarHBondContact N-O 2.81Å; F290-T320 PolarHBondContact O-N 2.86Å; T320-T338 PolarHBondContact OG1-OG1 2.83Å
321	F	95	Very high	93.9	Very high	1 Å²	1	49.8 Å²	49.8	0%	0.004	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	124.7	176.2	-60.5	-84.6	0	0	0	109.5	I262 V269 L271 T288 C289 I310 L313 A336 I337 V339	I262-F321 HydrophobicContact CD1-CD2 4.16Å; V269-F321 HydrophobicContact CB-CE1 4.43Å; V269-F321 HydrophobicContact CB-CE2 4.11Å; V269-F321 HydrophobicContact CB-CZ 3.67Å; V269-F321 HydrophobicContact CG1-CD2 4.43Å; V269-F321 HydrophobicContact CG1-CE1 4.37Å; V269-F321 HydrophobicContact CG1-CE2 3.74Å; V269-F321 HydrophobicContact CG1-CZ 3.7Å; V269-F321 HydrophobicContact CG2-CE2 4.1Å; V269-F321 HydrophobicContact CG2-CZ 3.92Å; L271-F321 HydrophobicContact CD1-CD1 3.86Å; L271-F321 HydrophobicContact CD1-CE1 4.16Å; L271-F321 HydrophobicContact CD1-CG 4.37Å; L271-F321 HydrophobicContact CD2-CB 3.69Å; L271-F321 HydrophobicContact CD2-CD1 4.17Å; L271-F321 HydrophobicContact CD2-CG 3.92Å; T288-F321 CarbonylContact O-C 3.55Å; T288-F321 VanDerWaalsContact O-CA 3.25Å; T288-F321 WeakPolarHBondContact O-CA 3.45Å; C289-F321 HydrophobicContact CB-CD1 3.93Å; C289-F321 HydrophobicContact CB-CE1 3.78Å; C289-F321 WeakPolarHBondContact SG-CE1 3.32Å; I310-F321 HydrophobicContact CB-CE1 4.43Å; I310-F321 HydrophobicContact CD1-CD1 3.77Å; I310-F321 HydrophobicContact CD1-CE1 3.45Å; I310-F321 VanDerWaalsContact CD1-CE1 3.45Å; I310-F321 HydrophobicContact CG1-CE1 4.49Å; L313-F321 HydrophobicContact CD1-CZ 4.31Å; F321-A336 CarbonylContact O-C 3.59Å; F321-A336 VanDerWaalsContact O-CA 3.3Å; F321-A336 WeakPolarHBondContact O-CA 3.37Å; F321-I337 HydrophobicContact CB-CG2 4.18Å; F321-I337 PolarHBondContact N-O 2.79Å; F321-I337 PolarHBondContact O-N 3.35Å; F321-V339 HydrophobicContact CD2-CG1 3.77Å; F321-V339 HydrophobicContact CE2-CG1 3.41Å; F321-V339 VanDerWaalsContact CE2-CG1 3.41Å
322	S	94.5	Very high	94.1	Very high	24 Å²	24	44.4 Å²	44.4	17%	0.168	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	129.9	175.4	-25.8	0	0	0	0	110.2	I287 T288 T334 D335	I287-S322 CarbonylContact C-O 3.56Å; I287-S322 WeakPolarHBondContact CA-O 3.22Å; T288-S322 PolarHBondContact N-O 2.78Å; T288-S322 PolarHBondContact O-N 2.88Å; T288-S322 WeakPolarHBondContact OG1-CB 3.16Å; T288-S322 PolarHBondContact OG1-O 3.46Å; T288-S322 VanDerWaalsContact OG1-O 3.13Å; T288-S322 PolarHBondContact OG1-OG 2.85Å; S322-T334 VanDerWaalsContact CB-CG2 3.49Å; S322-D335 CarbonylContact C-O 3.59Å; S322-D335 VanDerWaalsContact CA-O 3.32Å; S322-D335 WeakPolarHBondContact CA-O 3.3Å
323	A	96.1	Very high	94.4	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.008	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	126.3	-173.8	0	0	0	0	0	111.2	I257 R286 I287 D335	I257-A323 HydrophobicContact CD1-CB 3.51Å; I257-A323 HydrophobicContact CG2-CB 4.21Å; R286-A323 WeakPolarHBondContact O-CA 3.39Å; I287-A323 HydrophobicContact CD1-CB 3.44Å; I287-A323 VanDerWaalsContact CD1-CB 3.44Å; A323-D335 PolarHBondContact N-O 2.88Å; A323-D335 PolarHBondContact O-N 3.33Å
324	T	96.6	Very high	94.5	Very high	11 Å²	11	42.4 Å²	42.4	7%	0.067	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	135.9	179.2	-55.4	0	0	0	0	109.6	Y285 R286 E331 S332 T334	Y285-T324 WeakPolarHBondContact CA-O 3Å; R286-T324 PolarHBondContact N-O 3.1Å; R286-T324 PolarHBondContact O-N 2.89Å; T324-E331 HydrophobicContact CG2-CB 3.94Å; T324-S332 WeakPolarHBondContact CG2-O 3.45Å; T324-T334 PolarHBondContact OG1-OG1 3.47Å
325	V	97.2	Very high	94.6	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	132.9	173.7	-172.7	0	0	0	0	108.3	P254 D255 I257 Y276 I283 Y285 E331 S332	P254-V325 HydrophobicContact CB-CB 4.05Å; P254-V325 HydrophobicContact CB-CG1 3.7Å; P254-V325 HydrophobicContact CG-CB 4.27Å; P254-V325 HydrophobicContact CG-CG1 4.16Å; P254-V325 WeakPolarHBondContact CG-O 3.13Å; D255-V325 WeakPolarHBondContact O-CG2 3.2Å; I257-V325 HydrophobicContact CB-CG2 4.26Å; Y276-V325 HydrophobicContact CD2-CG1 4.05Å; Y276-V325 HydrophobicContact CE2-CB 4.44Å; Y276-V325 HydrophobicContact CE2-CG1 3.64Å; Y276-V325 HydrophobicContact CE2-CG2 4.12Å; I283-V325 HydrophobicContact CG2-CG1 3.65Å; Y285-V325 HydrophobicContact CD1-CB 4.49Å; Y285-V325 HydrophobicContact CD1-CG1 4.36Å; Y285-V325 HydrophobicContact CD1-CG2 4Å; Y285-V325 HydrophobicContact CE1-CG1 4.11Å; Y285-V325 HydrophobicContact CE1-CG2 4.02Å; V325-E331 WeakPolarHBondContact O-CA 3.49Å; V325-S332 VanDerWaalsContact CB-OG 3.3Å; V325-S332 WeakPolarHBondContact CB-OG 3.07Å; V325-S332 PolarHBondContact N-OG 2.87Å; V325-S332 PolarHBondContact O-N 2.85Å; V325-S332 PolarHBondContact O-OG 2.77Å
326	I	96.3	Very high	94.6	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	119.1	-179.9	-51.3	168.9	0	0	0	108	I283 R284 R286 D328 L330 E331	I283-I326 WeakPolarHBondContact CA-O 3.24Å; R284-I326 HydrophobicContact CG-CB 3.82Å; R284-I326 HydrophobicContact CG-CD1 4.3Å; R284-I326 HydrophobicContact CG-CG2 4.35Å; R284-I326 PolarHBondContact N-O 2.86Å; R284-I326 PolarHBondContact O-N 2.92Å; R286-I326 HydrophobicContact CB-CD1 3.75Å; R286-I326 VanDerWaalsContact NH2-CD1 3.29Å; I326-D328 WeakPolarHBondContact CG2-O 2.98Å; I326-L330 WeakPolarHBondContact CA-O 3.39Å; I326-E331 HydrophobicContact CG1-CG 4.23Å; I326-E331 HydrophobicContact CG2-CG 4.48Å
327	A	95.7	Very high	94.7	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	110.9	173.5	0	0	0	0	0	108.2	T251 P254 Y282 I283 D329 L330	T251-A327 HydrophobicContact CG2-CB 3.99Å; P254-A327 HydrophobicContact CB-CB 4.21Å; P254-A327 HydrophobicContact CG-CB 3.87Å; Y282-A327 HydrophobicContact CD2-CB 4.47Å; I283-A327 HydrophobicContact CG1-CB 4.02Å; A327-D329 PolarHBondContact O-N 3.32Å; A327-D329 VanDerWaalsContact O-N 3.07Å; A327-L330 PolarHBondContact N-O 3.07Å; A327-L330 WeakPolarHBondContact O-CB 3.23Å; A327-L330 PolarHBondContact O-N 2.78Å
328	D	92.9	Very high	94.7	Very high	37 Å²	37	41.6 Å²	41.6	20%	0.198	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.5	-107.6	-167.1	-63.4	-42.9	0	0	0	111.3	R229 T251 Y282 R284 I326	R229-D328 IonicContact CZ-OD1 2.8Å; R229-D328 IonicContact CZ-OD2 3.66Å; R229-D328 IonicContact NE-OD1 2.99Å; R229-D328 IonicContact NE-OD2 2.97Å; R229-D328 PolarHBondContact NE-OD2 2.54Å; R229-D328 IonicContact NH2-OD1 3.13Å; R229-D328 PolarHBondContact NH2-OD1 2.79Å; R229-D328 IonicContact NH2-OD2 2.66Å; T251-D328 PolarHBondContact OG1-OD2 3.2Å; Y282-D328 WeakPolarHBondContact CB-OD1 3.49Å; Y282-D328 PolarHBondContact O-N 2.88Å; R284-D328 PolarHBondContact NH1-O 2.83Å; R284-D328 PolarHBondContact NH2-O 2.83Å; I326-D328 WeakPolarHBondContact CG2-O 2.98Å
329	D	90.6	Very high	94.7	Very high	145 Å²	145	36.8 Å²	36.8	78%	0.775	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.9	3.9	176.7	-58.2	-41.6	0	0	0	112.5	A327	A327-D329 PolarHBondContact O-N 3.32Å; A327-D329 VanDerWaalsContact O-N 3.07Å
330	L	96.5	Very high	94.7	Very high	30 Å²	30	37.2 Å²	37.2	16%	0.157	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	122.1	-179	-59.6	178.7	0	0	0	110.7	I172 T251 Y253 P254 I326 A327	I172-L330 HydrophobicContact CG2-CD1 4.06Å; T251-L330 HydrophobicContact CG2-CD1 4.32Å; T251-L330 WeakPolarHBondContact O-CD1 3.42Å; Y253-L330 HydrophobicContact CD1-CB 4.05Å; Y253-L330 HydrophobicContact CE1-CB 4.18Å; Y253-L330 HydrophobicContact CE1-CD2 4.04Å; Y253-L330 HydrophobicContact CE2-CD2 4.38Å; P254-L330 WeakPolarHBondContact CG-O 3.4Å; I326-L330 WeakPolarHBondContact CA-O 3.39Å; A327-L330 PolarHBondContact N-O 3.07Å; A327-L330 WeakPolarHBondContact O-CB 3.23Å; A327-L330 PolarHBondContact O-N 2.78Å
331	E	96.5	Very high	94.7	Very high	83 Å²	83	35.8 Å²	35.8	39%	0.388	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	138.7	177.9	-52.9	-163.8	171.8	0	0	111	Y253 R286 T324 V325 I326	Y253-E331 VanDerWaalsContact CD1-O 3.29Å; Y253-E331 WeakPolarHBondContact CD1-O 3.47Å; Y253-E331 WeakPolarHBondContact CE1-O 3.39Å; R286-E331 IonicContact CZ-OE1 3.63Å; R286-E331 IonicContact NH1-OE1 3.2Å; R286-E331 PolarHBondContact NH1-OE1 3.48Å; R286-E331 IonicContact NH1-OE2 2.73Å; R286-E331 PolarHBondContact NH1-OE2 2.84Å; R286-E331 IonicContact NH2-OE1 2.95Å; R286-E331 PolarHBondContact NH2-OE1 2.85Å; T324-E331 HydrophobicContact CG2-CB 3.94Å; V325-E331 WeakPolarHBondContact O-CA 3.49Å; I326-E331 HydrophobicContact CG1-CG 4.23Å; I326-E331 HydrophobicContact CG2-CG 4.48Å
332	S	96.3	Very high	94.5	Very high	12 Å²	12	36 Å²	36	8%	0.084	21%	0.206	C	C	.	.			trans	-80.3	175.1	171.6	64.2	0	0	0	0	112.2	P254 D255 T324 V325 T334	P254-S332 WeakPolarHBondContact O-CB 3.46Å; D255-S332 WeakPolarHBondContact O-CB 3.2Å; D255-S332 PolarHBondContact O-OG 2.86Å; T324-S332 WeakPolarHBondContact CG2-O 3.45Å; V325-S332 VanDerWaalsContact CB-OG 3.3Å; V325-S332 WeakPolarHBondContact CB-OG 3.07Å; V325-S332 PolarHBondContact N-OG 2.87Å; V325-S332 PolarHBondContact O-N 2.85Å; V325-S332 PolarHBondContact O-OG 2.77Å; S332-T334 PolarHBondContact O-N 3.24Å
333	D	95.3	Very high	94.2	Very high	96 Å²	96	35.8 Å²	35.8	51%	0.513	21%	0.208	S	C	.	.	P	Polyproline II helix	trans	-60	136.6	165.6	-49.4	-54	0	0	0	109.6	K174 K256	K174-D333 IonicContact NZ-OD2 3.28Å; K174-D333 PolarHBondContact NZ-OD2 2.85Å; K256-D333 HydrophobicContact CB-CB 4.42Å; K256-D333 WeakPolarHBondContact CB-O 3.25Å
334	T	95.4	Very high	93.7	Very high	79 Å²	79	44.4 Å²	44.4	49%	0.485	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-77	133.3	177.3	-54.9	0	0	0	0	111	S322 T324 S332	S322-T334 VanDerWaalsContact CB-CG2 3.49Å; T324-T334 PolarHBondContact OG1-OG1 3.47Å; S332-T334 PolarHBondContact O-N 3.24Å
335	D	93.6	Very high	92.9	Very high	45 Å²	45	48.1 Å²	48.1	24%	0.241	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	133.5	168.1	-153.2	31.2	0	0	0	108.6	K256 I257 S322 A323	K256-D335 IonicContact NZ-OD1 2.8Å; I257-D335 HydrophobicContact CG2-CB 3.45Å; I257-D335 VanDerWaalsContact CG2-CB 3.45Å; S322-D335 CarbonylContact C-O 3.59Å; S322-D335 VanDerWaalsContact CA-O 3.32Å; S322-D335 WeakPolarHBondContact CA-O 3.3Å; A323-D335 PolarHBondContact N-O 2.88Å; A323-D335 PolarHBondContact O-N 3.33Å
336	A	92.9	Very high	92.2	Very high	63 Å²	63	48.9 Å²	48.9	52%	0.521	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	140.9	-176.6	0	0	0	0	0	110.9	F321	F321-A336 CarbonylContact O-C 3.59Å; F321-A336 VanDerWaalsContact O-CA 3.3Å; F321-A336 WeakPolarHBondContact O-CA 3.37Å
337	I	92.7	Very high	91.1	Very high	34 Å²	34	50.3 Å²	50.3	17%	0.174	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	130.7	-178.8	-177	164.2	0	0	0	110	L260 I262 F321 I467	L260-I337 HydrophobicContact CD2-CG2 3.75Å; I262-I337 HydrophobicContact CD1-CB 4.29Å; I262-I337 HydrophobicContact CD1-CD1 3.98Å; I262-I337 HydrophobicContact CD1-CG1 4.1Å; I262-I337 HydrophobicContact CD1-CG2 3.26Å; I262-I337 HydrophobicContact CG1-CD1 4.39Å; I262-I337 HydrophobicContact CG1-CG2 4.33Å; F321-I337 HydrophobicContact CB-CG2 4.18Å; F321-I337 PolarHBondContact N-O 2.79Å; F321-I337 PolarHBondContact O-N 3.35Å; I337-I467 HydrophobicContact CD1-CD1 3.97Å; I337-I467 HydrophobicContact CD1-CG1 3.81Å; I337-I467 HydrophobicContact CG1-CD1 4.35Å
338	T	92.9	Very high	90.1	Very high	68 Å²	68	60 Å²	60	42%	0.417	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	130.3	179.5	-54.5	0	0	0	0	108.9	W318 Y319 T320	W318-T338 HydrophobicContact CE3-CG2 3.68Å; W318-T338 HydrophobicContact CZ3-CG2 4.18Å; Y319-T338 CarbonylContact O-C 3.51Å; Y319-T338 WeakPolarHBondContact O-CA 3.4Å; T320-T338 PolarHBondContact OG1-OG1 2.83Å
339	V	94.4	Very high	89.5	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	144.6	-176.7	65.2	0	0	0	0	109.7	I262 V269 Y319 F321 N373 I467	I262-V339 HydrophobicContact CD1-CG1 4.47Å; I262-V339 HydrophobicContact CG2-CG1 4.29Å; I262-V339 HydrophobicContact CG2-CG2 4.28Å; V269-V339 HydrophobicContact CG2-CG1 4.44Å; Y319-V339 PolarHBondContact N-O 3.18Å; Y319-V339 PolarHBondContact O-N 2.93Å; F321-V339 HydrophobicContact CD2-CG1 3.77Å; F321-V339 HydrophobicContact CE2-CG1 3.41Å; F321-V339 VanDerWaalsContact CE2-CG1 3.41Å; V339-N373 WeakPolarHBondContact CG2-OD1 3.42Å; V339-I467 HydrophobicContact CG2-CG2 3.69Å
340	M	93.1	Very high	89.5	Confident	22 Å²	22	55.1 Å²	55.1	11%	0.108	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	131.9	171.3	-160.8	177.3	74.3	0	0	109.5	S264 S317 W318 P370 S372 N373	S264-M340 PolarHBondContact OG-O 2.9Å; S317-M340 CarbonylContact O-C 3.57Å; S317-M340 WeakPolarHBondContact O-CA 3.28Å; W318-M340 HydrophobicContact CD2-CB 3.95Å; W318-M340 HydrophobicContact CD2-CG 4.2Å; W318-M340 HydrophobicContact CE3-CB 3.84Å; W318-M340 HydrophobicContact CG-CG 4.5Å; W318-M340 HydrophobicContact CH2-CB 4.24Å; W318-M340 HydrophobicContact CZ2-CB 4.27Å; W318-M340 HydrophobicContact CZ2-SD 4.16Å; W318-M340 HydrophobicContact CZ3-CB 4.01Å; M340-P370 HydrophobicContact CE-CB 4.18Å; M340-P370 HydrophobicContact CE-CG 3.78Å; M340-S372 VanDerWaalsContact CE-CB 3.41Å; M340-S372 VanDerWaalsContact CE-OG 3.28Å; M340-S372 WeakPolarHBondContact CE-OG 3.45Å; M340-N373 PolarHBondContact N-OD1 3.32Å; M340-N373 PolarHBondContact O-ND2 2.89Å
341	T	93.5	Very high	89.3	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-64.5	146	166.4	51.9	0	0	0	0	109.8	S264 R265 V269 L313 E314 P315 S316 S317 Y319	S264-T341 WeakPolarHBondContact OG-CA 3.43Å; R265-T341 WeakPolarHBondContact O-CB 3.5Å; V269-T341 HydrophobicContact CG2-CG2 4.2Å; L313-T341 HydrophobicContact CB-CG2 4.11Å; L313-T341 HydrophobicContact CD1-CG2 4.2Å; E314-T341 WeakPolarHBondContact O-CB 3.35Å; E314-T341 PolarHBondContact O-OG1 2.95Å; P315-T341 VanDerWaalsContact C-OG1 3.26Å; P315-T341 WeakPolarHBondContact CA-OG1 3.3Å; S316-T341 VanDerWaalsContact CA-O 3.23Å; S316-T341 WeakPolarHBondContact CA-O 3.26Å; S316-T341 PolarHBondContact N-O 3.13Å; S316-T341 VanDerWaalsContact N-O 3.17Å; S316-T341 PolarHBondContact N-OG1 3.27Å; S317-T341 PolarHBondContact N-OG1 3.08Å; S317-T341 PolarHBondContact O-N 2.69Å; S317-T341 PolarHBondContact O-OG1 3.21Å; Y319-T341 HydrophobicContact CD2-CG2 3.91Å; Y319-T341 HydrophobicContact CE2-CG2 3.88Å
342	I	91.2	Very high	89.2	Confident	5 Å²	5	55.9 Å²	55.9	3%	0.026	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-74.3	161.4	-179.3	61.5	162.8	0	0	0	111.9	R265 S266 S316 V346 F369 M469 E470	R265-I342 VanDerWaalsContact C-CG1 3.42Å; R265-I342 PolarHBondContact O-N 2.86Å; S266-I342 WeakPolarHBondContact CA-O 3.42Å; S266-I342 VanDerWaalsContact N-CG1 3.33Å; S316-I342 PolarHBondContact N-O 3.47Å; I342-V346 HydrophobicContact CB-CG2 4.3Å; I342-V346 HydrophobicContact CD1-CB 4.18Å; I342-V346 HydrophobicContact CD1-CG1 4.18Å; I342-F369 HydrophobicContact CG2-CD1 4.35Å; I342-M469 HydrophobicContact CG2-CB 3.8Å; I342-M469 HydrophobicContact CG2-CG 3.75Å; I342-M469 HydrophobicContact CG2-SD 3.99Å; I342-E470 WeakPolarHBondContact CD1-O 3.42Å
343	G	89	Confident	89	Confident	19 Å²	19	59.7 Å²	59.7	20%	0.196	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-64.3	149.8	174.4	0	0	0	0	0	112.9	S316 D345 V346	S316-G343 WeakPolarHBondContact OG-CA 3.14Å; G343-D345 VanDerWaalsContact C-N 3.27Å; G343-D345 PolarHBondContact O-N 2.91Å; G343-V346 WeakPolarHBondContact O-CB 3.47Å; G343-V346 VanDerWaalsContact O-CG2 3.28Å; G343-V346 WeakPolarHBondContact O-CG2 3.24Å; G343-V346 PolarHBondContact O-N 3.39Å
344	R	85.3	Confident	88.9	Confident	183 Å²	183	59.1 Å²	59.1	69%	0.691	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-63.1	-34.8	179.8	-168.7	-178.8	-69.4	-160	0.8	112.3	V346	R344-V346 VanDerWaalsContact C-N 3.32Å; R344-V346 PolarHBondContact O-N 3.31Å
345	D	80.3	Confident	88.6	Confident	89 Å²	89	58.2 Å²	58.2	48%	0.476	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-86.2	3.1	-175.9	-64.6	-57.5	0	0	0	114.5	G343 A347 R348	G343-D345 VanDerWaalsContact C-N 3.27Å; G343-D345 PolarHBondContact O-N 2.91Å; D345-A347 VanDerWaalsContact C-N 3.27Å; D345-A347 PolarHBondContact O-N 3.28Å; D345-R348 WeakPolarHBondContact O-CB 3.27Å; D345-R348 PolarHBondContact O-N 2.99Å; D345-R348 WeakPolarHBondContact OD1-CD 3.49Å; D345-R348 IonicContact OD1-CZ 2.7Å; D345-R348 IonicContact OD1-NE 2.84Å; D345-R348 IonicContact OD1-NH1 2.74Å; D345-R348 PolarHBondContact OD1-NH1 3.02Å
346	V	81.6	Confident	88.4	Confident	16 Å²	16	60.4 Å²	60.4	10%	0.097	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-57.6	-42.2	179.9	172.3	0	0	0	0	110.5	I342 G343 R344 R348 S349 F368 F369 T471	I342-V346 HydrophobicContact CB-CG2 4.3Å; I342-V346 HydrophobicContact CD1-CB 4.18Å; I342-V346 HydrophobicContact CD1-CG1 4.18Å; G343-V346 WeakPolarHBondContact O-CB 3.47Å; G343-V346 VanDerWaalsContact O-CG2 3.28Å; G343-V346 WeakPolarHBondContact O-CG2 3.24Å; G343-V346 PolarHBondContact O-N 3.39Å; R344-V346 VanDerWaalsContact C-N 3.32Å; R344-V346 PolarHBondContact O-N 3.31Å; V346-R348 PolarHBondContact O-N 3.16Å; V346-R348 VanDerWaalsContact O-N 3.09Å; V346-S349 PolarHBondContact O-N 2.93Å; V346-F368 HydrophobicContact CB-CZ 4.46Å; V346-F368 HydrophobicContact CG1-CD1 4.15Å; V346-F368 HydrophobicContact CG1-CD2 4.36Å; V346-F368 HydrophobicContact CG1-CE1 3.47Å; V346-F368 VanDerWaalsContact CG1-CE1 3.47Å; V346-F368 HydrophobicContact CG1-CE2 3.75Å; V346-F368 HydrophobicContact CG1-CZ 3.22Å; V346-F368 WeakPolarHBondContact O-CE2 3.34Å; V346-F368 VanDerWaalsContact O-CZ 3.28Å; V346-F368 WeakPolarHBondContact O-CZ 3.49Å; V346-F369 HydrophobicContact CG1-CD1 4.37Å; V346-F369 HydrophobicContact CG1-CE1 4.22Å; V346-T471 HydrophobicContact CG1-CG2 4.25Å
347	A	74.2	Confident	88.1	Confident	31 Å²	31	63.4 Å²	63.4	26%	0.256	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-58.6	-27.7	178.2	0	0	0	0	0	114.3	D345 S349 V350 I474	D345-A347 VanDerWaalsContact C-N 3.27Å; D345-A347 PolarHBondContact O-N 3.28Å; A347-S349 PolarHBondContact O-N 3.45Å; A347-V350 PolarHBondContact O-N 3.19Å; A347-I474 HydrophobicContact CB-CG1 4.43Å
348	R	73.9	Confident	88.1	Confident	204 Å²	204	64 Å²	64	77%	0.77	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-72.5	-12.3	-179.8	-65.3	177	169.3	170.5	-12.2	113.6	D345 V346	D345-R348 WeakPolarHBondContact O-CB 3.27Å; D345-R348 PolarHBondContact O-N 2.99Å; D345-R348 WeakPolarHBondContact OD1-CD 3.49Å; D345-R348 IonicContact OD1-CZ 2.7Å; D345-R348 IonicContact OD1-NE 2.84Å; D345-R348 IonicContact OD1-NH1 2.74Å; D345-R348 PolarHBondContact OD1-NH1 3.02Å; V346-R348 PolarHBondContact O-N 3.16Å; V346-R348 VanDerWaalsContact O-N 3.09Å
349	S	81.1	Confident	88.1	Confident	71 Å²	71	62.7 Å²	62.7	50%	0.497	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-94.7	4.4	-178.4	-58.5	0	0	0	0	113.4	V346 A347 F368	V346-S349 PolarHBondContact O-N 2.93Å; A347-S349 PolarHBondContact O-N 3.45Å; S349-F368 VanDerWaalsContact CB-CD2 3.45Å
350	V	90.2	Very high	88.1	Confident	8 Å²	8	62.7 Å²	62.7	5%	0.048	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	130.9	172	172.9	0	0	0	0	109.1	A347 V362 S363 F364 F368 V457 V459 I474	A347-V350 PolarHBondContact O-N 3.19Å; V350-V362 HydrophobicContact CG1-CG1 3.94Å; V350-S363 CarbonylContact C-O 3.52Å; V350-S363 WeakPolarHBondContact CA-O 3.45Å; V350-F364 HydrophobicContact CG2-CB 3.85Å; V350-F368 HydrophobicContact CB-CE2 4.4Å; V350-F368 HydrophobicContact CG2-CD2 4.14Å; V350-F368 HydrophobicContact CG2-CE1 4.17Å; V350-F368 HydrophobicContact CG2-CE2 3.31Å; V350-F368 HydrophobicContact CG2-CZ 3.34Å; V350-V457 HydrophobicContact CG1-CG1 4.46Å; V350-V459 HydrophobicContact CG1-CG2 4.2Å; V350-V459 HydrophobicContact CG2-CG2 3.96Å; V350-I474 HydrophobicContact CB-CD1 3.71Å; V350-I474 HydrophobicContact CG1-CD1 3.8Å; V350-I474 HydrophobicContact CG2-CD1 4.32Å
351	Q	91.3	Very high	88.2	Confident	125 Å²	125	61.7 Å²	61.7	58%	0.584	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104	133.9	172	-54.1	177.4	-24.8	0	0	109.1	V362 S363	Q351-V362 VanDerWaalsContact O-CA 3.3Å; Q351-V362 WeakPolarHBondContact O-CA 3.49Å; Q351-S363 WeakPolarHBondContact CB-OG 3.5Å; Q351-S363 PolarHBondContact N-O 3.02Å; Q351-S363 PolarHBondContact O-N 2.87Å; Q351-S363 PolarHBondContact OE1-OG 2.82Å
352	F	94	Very high	88.2	Confident	3 Å²	3	61.7 Å²	61.7	1%	0.013	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	97.2	176.4	-175.2	-146.6	0	0	0	109.9	A360 A361 V362 I433 V457 I474 L476 T477	F352-A360 HydrophobicContact CD2-CB 4.16Å; F352-A360 HydrophobicContact CE2-CB 3.37Å; F352-A360 HydrophobicContact CZ-CB 3.97Å; F352-A361 WeakPolarHBondContact CA-O 3.01Å; F352-V362 HydrophobicContact CD2-CG2 3.37Å; F352-V362 HydrophobicContact CE2-CG2 3.77Å; F352-V362 HydrophobicContact CG-CG2 4.25Å; F352-I433 HydrophobicContact CE2-CD1 3.77Å; F352-I433 HydrophobicContact CZ-CD1 4.42Å; F352-V457 HydrophobicContact CB-CG1 3.54Å; F352-V457 HydrophobicContact CD1-CB 3.84Å; F352-V457 HydrophobicContact CD1-CG1 3.54Å; F352-V457 HydrophobicContact CD2-CB 4.26Å; F352-V457 HydrophobicContact CD2-CG1 3.98Å; F352-V457 HydrophobicContact CE1-CB 3.94Å; F352-V457 HydrophobicContact CE1-CG1 4.18Å; F352-V457 HydrophobicContact CE2-CB 4.32Å; F352-V457 HydrophobicContact CG-CB 4Å; F352-V457 HydrophobicContact CG-CG1 3.42Å; F352-V457 VanDerWaalsContact CG-CG1 3.42Å; F352-V457 HydrophobicContact CZ-CB 4.19Å; F352-I474 HydrophobicContact CB-CG2 4.14Å; F352-I474 WeakPolarHBondContact CD1-O 3.44Å; F352-L476 HydrophobicContact CD1-CB 3.78Å; F352-L476 HydrophobicContact CD1-CD1 3.94Å; F352-L476 HydrophobicContact CD2-CD1 3.86Å; F352-L476 HydrophobicContact CE1-CB 3.54Å; F352-L476 HydrophobicContact CE1-CD1 3.8Å; F352-L476 HydrophobicContact CE1-CG 4.23Å; F352-L476 HydrophobicContact CE2-CD1 3.73Å; F352-L476 HydrophobicContact CG-CD1 3.98Å; F352-L476 HydrophobicContact CZ-CB 4.18Å; F352-L476 HydrophobicContact CZ-CD1 3.69Å; F352-L476 HydrophobicContact CZ-CG 4.43Å; F352-T477 PolarHBondContact O-N 3.37Å; F352-T477 PolarHBondContact O-OG1 3.33Å; F352-T477 VanDerWaalsContact O-OG1 3.06Å
353	R	93.2	Very high	88.3	Confident	93 Å²	93	62.3 Å²	62.3	35%	0.351	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	144.8	-171.7	62.3	-177.9	-180	151.2	-3.3	111.5	A355 A360 A361 E430 E479	R353-A355 PolarHBondContact O-N 3.26Å; R353-A360 CarbonylContact O-C 3.57Å; R353-A360 WeakPolarHBondContact O-CA 3.37Å; R353-A361 HydrophobicContact CG-CB 3.82Å; R353-A361 PolarHBondContact N-O 3.28Å; R353-A361 PolarHBondContact O-N 2.63Å; R353-E430 IonicContact CZ-OE1 3.18Å; R353-E430 IonicContact NE-OE1 3.67Å; R353-E430 PolarHBondContact NE-OE1 3.04Å; R353-E430 IonicContact NH2-OE1 3.85Å; R353-E430 PolarHBondContact NH2-OE1 3.45Å; R353-E430 IonicContact NH2-OE2 3.45Å; R353-E479 IonicContact NH1-OE1 2.77Å
354	K	92.1	Very high	88.4	Confident	84 Å²	84	61.6 Å²	61.6	37%	0.365	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	124.9	170.5	-169.2	175.8	-178.4	-179.7	0	109.1	D356 L476 T477	K354-D356 WeakPolarHBondContact CE-O 3.36Å; K354-D356 VanDerWaalsContact CG-O 3.22Å; K354-D356 WeakPolarHBondContact CG-O 3.36Å; K354-L476 HydrophobicContact CB-CD1 4.27Å; K354-L476 HydrophobicContact CB-CD2 4.43Å; K354-L476 HydrophobicContact CB-CG 4.39Å; K354-T477 PolarHBondContact N-O 3.22Å
355	A	90	Very high	88.6	Confident	60 Å²	60	54.2 Å²	54.2	50%	0.496	28%	0.284	S	S	.	.			trans	-100.3	-36.2	176	0	0	0	0	0	111.3	R353 I359	R353-A355 PolarHBondContact O-N 3.26Å; A355-I359 HydrophobicContact CB-CB 4.38Å; A355-I359 HydrophobicContact CB-CG2 4.03Å; A355-I359 PolarHBondContact N-O 3.08Å
356	D	89.3	Confident	88.8	Confident	90 Å²	90	55.2 Å²	55.2	48%	0.481	28%	0.281	S	S	.	.	S	Bend	trans	-151.5	-177.9	175.6	-161.9	-1.7	0	0	0	110	K354 T358 I359	K354-D356 WeakPolarHBondContact CE-O 3.36Å; K354-D356 VanDerWaalsContact CG-O 3.22Å; K354-D356 WeakPolarHBondContact CG-O 3.36Å; D356-T358 PolarHBondContact O-N 3.1Å; D356-I359 HydrophobicContact CB-CB 3.86Å; D356-I359 HydrophobicContact CB-CD1 4.27Å; D356-I359 HydrophobicContact CB-CG1 4.11Å; D356-I359 PolarHBondContact N-O 3.2Å; D356-I359 VanDerWaalsContact O-O 3.06Å
357	Q	87.6	Confident	88.6	Confident	126 Å²	126	59.9 Å²	59.9	59%	0.589	31%	0.305	S	S	*	.	S	Bend	trans	-58.1	-34.2	176.8	-67	-170.8	-14.6	0	0	113.1
358	T	91.8	Very high	89	Confident	47 Å²	47	59 Å²	59	29%	0.288	30%	0.296	S	S	.	.	S	Bend	trans	-119.3	4.2	-177.4	59.8	0	0	0	0	113.1	D356 L449	D356-T358 PolarHBondContact O-N 3.1Å; T358-L449 WeakPolarHBondContact CB-O 3.42Å; T358-L449 WeakPolarHBondContact CG2-O 3.46Å; T358-L449 VanDerWaalsContact O-CB 3.3Å; T358-L449 WeakPolarHBondContact O-CB 3.29Å; T358-L449 WeakPolarHBondContact O-CG 3.34Å; T358-L449 PolarHBondContact O-N 2.95Å
359	I	93.3	Very high	89.8	Confident	40 Å²	40	49.4 Å²	49.4	21%	0.205	26%	0.259	C	S	.	.			trans	-126.4	135.4	-174.6	-52.4	178.4	0	0	0	110	A355 D356 L432 I433	A355-I359 HydrophobicContact CB-CB 4.38Å; A355-I359 HydrophobicContact CB-CG2 4.03Å; A355-I359 PolarHBondContact N-O 3.08Å; D356-I359 HydrophobicContact CB-CB 3.86Å; D356-I359 HydrophobicContact CB-CD1 4.27Å; D356-I359 HydrophobicContact CB-CG1 4.11Å; D356-I359 PolarHBondContact N-O 3.2Å; D356-I359 VanDerWaalsContact O-O 3.06Å; I359-L432 HydrophobicContact CG2-CB 4.35Å; I359-L432 HydrophobicContact CG2-CD2 4.42Å; I359-I433 VanDerWaalsContact CA-O 3.26Å; I359-I433 WeakPolarHBondContact CA-O 3.47Å; I359-I433 WeakPolarHBondContact CG2-O 3.01Å
360	A	94	Very high	89.9	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	146	173.7	0	0	0	0	0	111	F352 R353 L432 I433 L449 L476	F352-A360 HydrophobicContact CD2-CB 4.16Å; F352-A360 HydrophobicContact CE2-CB 3.37Å; F352-A360 HydrophobicContact CZ-CB 3.97Å; R353-A360 CarbonylContact O-C 3.57Å; R353-A360 WeakPolarHBondContact O-CA 3.37Å; A360-L432 CarbonylContact O-C 3.56Å; A360-I433 PolarHBondContact N-O 3.37Å; A360-I433 PolarHBondContact O-N 3.01Å; A360-L449 HydrophobicContact CB-CD1 3.76Å; A360-L476 HydrophobicContact CB-CD1 3.67Å
361	A	94.2	Very high	89.8	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.008	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	132.4	178.5	0	0	0	0	0	110.6	F352 R353 E430 Y431 L432	F352-A361 WeakPolarHBondContact CA-O 3.01Å; R353-A361 HydrophobicContact CG-CB 3.82Å; R353-A361 PolarHBondContact N-O 3.28Å; R353-A361 PolarHBondContact O-N 2.63Å; A361-E430 HydrophobicContact CB-CG 4.4Å; A361-E430 WeakPolarHBondContact CB-OE1 3.5Å; A361-Y431 WeakPolarHBondContact CA-O 3.29Å; A361-L432 HydrophobicContact CB-CD2 3.76Å
362	V	94.5	Very high	89.7	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	121.4	174.4	175.7	0	0	0	0	108.4	V350 Q351 F352 F364 I381 E430 Y431 I433 V457 V459	V350-V362 HydrophobicContact CG1-CG1 3.94Å; Q351-V362 VanDerWaalsContact O-CA 3.3Å; Q351-V362 WeakPolarHBondContact O-CA 3.49Å; F352-V362 HydrophobicContact CD2-CG2 3.37Å; F352-V362 HydrophobicContact CE2-CG2 3.77Å; F352-V362 HydrophobicContact CG-CG2 4.25Å; V362-F364 HydrophobicContact CG1-CD1 4.24Å; V362-I381 HydrophobicContact CG1-CD1 4.41Å; V362-I381 HydrophobicContact CG1-CG2 4.45Å; V362-I381 HydrophobicContact CG2-CG2 4.3Å; V362-E430 CarbonylContact O-C 3.46Å; V362-E430 VanDerWaalsContact O-CA 3.32Å; V362-E430 WeakPolarHBondContact O-CA 3.47Å; V362-Y431 PolarHBondContact N-O 3.41Å; V362-Y431 PolarHBondContact O-N 3.28Å; V362-I433 HydrophobicContact CG2-CD1 3.4Å; V362-I433 HydrophobicContact CG2-CG1 4.39Å; V362-V457 HydrophobicContact CG1-CG2 4.46Å; V362-V457 HydrophobicContact CG2-CB 4.3Å; V362-V457 HydrophobicContact CG2-CG1 4.18Å; V362-V457 HydrophobicContact CG2-CG2 3.84Å; V362-V459 HydrophobicContact CG1-CG2 4.25Å
363	S	92.8	Very high	89.6	Confident	18 Å²	18	48.9 Å²	48.9	13%	0.126	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	143.4	176.4	74.4	0	0	0	0	111.5	V350 Q351 A429	V350-S363 CarbonylContact C-O 3.52Å; V350-S363 WeakPolarHBondContact CA-O 3.45Å; Q351-S363 WeakPolarHBondContact CB-OG 3.5Å; Q351-S363 PolarHBondContact N-O 3.02Å; Q351-S363 PolarHBondContact O-N 2.87Å; Q351-S363 PolarHBondContact OE1-OG 2.82Å; S363-A429 VanDerWaalsContact CA-O 3.23Å; S363-A429 WeakPolarHBondContact CA-O 3.39Å
364	F	92.2	Very high	89.5	Confident	4 Å²	4	46 Å²	46	2%	0.018	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	149.8	174.9	52.2	-91.2	0	0	0	111.3	V350 V362 F368 Y379 I381 F421 S428 A429 Y431 V459	V350-F364 HydrophobicContact CG2-CB 3.85Å; V362-F364 HydrophobicContact CG1-CD1 4.24Å; F364-F368 HydrophobicContact CB-CD2 4.39Å; F364-Y379 AromaticContact CE2-CD1 3.91Å; F364-Y379 HydrophobicContact CE2-CD1 3.91Å; F364-Y379 AromaticContact CE2-CE1 3.97Å; F364-Y379 HydrophobicContact CE2-CE1 3.97Å; F364-Y379 HydrophobicContact CE2-CG 4.37Å; F364-Y379 HydrophobicContact CZ-CD1 4.1Å; F364-Y379 HydrophobicContact CZ-CG 4.34Å; F364-I381 HydrophobicContact CE1-CD1 4.27Å; F364-F421 AromaticContact CD2-CE2 4Å; F364-F421 HydrophobicContact CD2-CE2 4Å; F364-F421 AromaticContact CD2-CZ 3.82Å; F364-F421 HydrophobicContact CD2-CZ 3.82Å; F364-F421 AromaticContact CE2-CE2 3.79Å; F364-F421 HydrophobicContact CE2-CE2 3.79Å; F364-F421 AromaticContact CE2-CZ 3.89Å; F364-F421 HydrophobicContact CE2-CZ 3.89Å; F364-S428 WeakPolarHBondContact O-CA 3.46Å; F364-A429 HydrophobicContact CE2-CB 4.24Å; F364-A429 HydrophobicContact CZ-CB 4.38Å; F364-A429 PolarHBondContact N-O 2.89Å; F364-A429 PolarHBondContact O-N 3.3Å; F364-Y431 AromaticContact CE1-CD2 3.83Å; F364-Y431 HydrophobicContact CE1-CD2 3.83Å; F364-Y431 AromaticContact CE1-CE2 3.68Å; F364-Y431 HydrophobicContact CE1-CE2 3.68Å; F364-Y431 HydrophobicContact CZ-CD2 4.19Å; F364-Y431 AromaticContact CZ-CE2 3.54Å; F364-Y431 HydrophobicContact CZ-CE2 3.54Å; F364-V459 HydrophobicContact CD1-CG1 4.47Å; F364-V459 HydrophobicContact CD1-CG2 4.15Å; F364-V459 HydrophobicContact CE1-CG1 4.2Å; F364-V459 HydrophobicContact CE1-CG2 4.32Å; F364-V459 HydrophobicContact CZ-CG1 4.37Å
365	G	89.1	Confident	89.5	Confident	28 Å²	28	46.5 Å²	46.5	29%	0.289	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	167.7	-178.4	0	0	0	0	0	114.4	F368 F421 Q427	G365-F368 VanDerWaalsContact O-CB 3.25Å; G365-F368 WeakPolarHBondContact O-CB 3.44Å; G365-F421 WeakPolarHBondContact O-CZ 3.45Å; G365-Q427 CarbonylContact C-O 3.54Å; G365-Q427 WeakPolarHBondContact CA-O 3.37Å
366	R	84.9	Confident	89.5	Confident	110 Å²	110	43.7 Å²	43.7	42%	0.415	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	151.1	167.4	-175.7	174	-179	-168.5	0.7	110.4	F368 F421 P424 Q427	R366-F368 PolarHBondContact O-N 2.91Å; R366-F368 VanDerWaalsContact O-N 3.14Å; R366-F421 HydrophobicContact CB-CD1 3.7Å; R366-F421 HydrophobicContact CB-CE1 3.97Å; R366-F421 HydrophobicContact CB-CG 4.13Å; R366-F421 HydrophobicContact CG-CB 4.11Å; R366-F421 HydrophobicContact CG-CD1 4.07Å; R366-F421 HydrophobicContact CG-CG 4.06Å; R366-P424 PolarHBondContact NH1-O 3.35Å; R366-Q427 PolarHBondContact N-O 3.41Å
367	N	77.3	Confident	89.6	Confident	114 Å²	114	42.5 Å²	42.5	61%	0.61	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.6	17.2	-178.9	-54.1	-21.8	0	0	0	114.2	F369	N367-F369 VanDerWaalsContact C-N 3.28Å; N367-F369 CarbonylContact C-O 3.57Å; N367-F369 PolarHBondContact O-N 3.03Å
368	F	83.2	Confident	89.8	Confident	13 Å²	13	38.9 Å²	38.9	6%	0.057	22%	0.224	C	C	.	.	S	Bend	trans	-54.9	-42.5	174.4	173.6	-94.6	0	0	0	113.1	V346 S349 V350 F364 G365 R366 T471	V346-F368 HydrophobicContact CB-CZ 4.46Å; V346-F368 HydrophobicContact CG1-CD1 4.15Å; V346-F368 HydrophobicContact CG1-CD2 4.36Å; V346-F368 HydrophobicContact CG1-CE1 3.47Å; V346-F368 VanDerWaalsContact CG1-CE1 3.47Å; V346-F368 HydrophobicContact CG1-CE2 3.75Å; V346-F368 HydrophobicContact CG1-CZ 3.22Å; V346-F368 WeakPolarHBondContact O-CE2 3.34Å; V346-F368 VanDerWaalsContact O-CZ 3.28Å; V346-F368 WeakPolarHBondContact O-CZ 3.49Å; S349-F368 VanDerWaalsContact CB-CD2 3.45Å; V350-F368 HydrophobicContact CB-CE2 4.4Å; V350-F368 HydrophobicContact CG2-CD2 4.14Å; V350-F368 HydrophobicContact CG2-CE1 4.17Å; V350-F368 HydrophobicContact CG2-CE2 3.31Å; V350-F368 HydrophobicContact CG2-CZ 3.34Å; F364-F368 HydrophobicContact CB-CD2 4.39Å; G365-F368 VanDerWaalsContact O-CB 3.25Å; G365-F368 WeakPolarHBondContact O-CB 3.44Å; R366-F368 PolarHBondContact O-N 2.91Å; R366-F368 VanDerWaalsContact O-N 3.14Å; F368-T471 HydrophobicContact CE1-CG2 3.27Å; F368-T471 HydrophobicContact CE2-CG2 4.48Å; F368-T471 HydrophobicContact CZ-CG2 3.17Å
369	F	89.6	Confident	89.8	Confident	2 Å²	2	37 Å²	37	1%	0.009	21%	0.211	C	C	.	.	S	Bend	trans	-98.9	134.2	164.3	-70	-57.9	0	0	0	108.8	I342 V346 N367 V376 Y379 V459 M469 T471	I342-F369 HydrophobicContact CG2-CD1 4.35Å; V346-F369 HydrophobicContact CG1-CD1 4.37Å; V346-F369 HydrophobicContact CG1-CE1 4.22Å; N367-F369 VanDerWaalsContact C-N 3.28Å; N367-F369 CarbonylContact C-O 3.57Å; N367-F369 PolarHBondContact O-N 3.03Å; F369-V376 HydrophobicContact CB-CG2 3.95Å; F369-V376 HydrophobicContact CD2-CG2 4.47Å; F369-Y379 HydrophobicContact CD2-CD1 4.42Å; F369-Y379 AromaticContact CD2-CE1 3.76Å; F369-Y379 HydrophobicContact CD2-CE1 3.76Å; F369-Y379 HydrophobicContact CE2-CD1 4.31Å; F369-Y379 HydrophobicContact CE2-CE1 4.06Å; F369-V459 HydrophobicContact CE2-CG1 4.23Å; F369-M469 HydrophobicContact CB-CE 3.76Å; F369-M469 HydrophobicContact CB-SD 4.1Å; F369-M469 HydrophobicContact CD1-CB 3.44Å; F369-M469 VanDerWaalsContact CD1-CB 3.44Å; F369-M469 HydrophobicContact CD1-CG 4.38Å; F369-M469 HydrophobicContact CD1-SD 4.19Å; F369-M469 HydrophobicContact CE1-CB 3.5Å; F369-M469 HydrophobicContact CG-CB 4.04Å; F369-M469 HydrophobicContact CG-CE 4.2Å; F369-M469 HydrophobicContact CG-SD 4.38Å; F369-M469 HydrophobicContact CZ-CB 4.15Å; F369-M469 WeakPolarHBondContact CZ-O 3.42Å; F369-T471 HydrophobicContact CE1-CG2 4.26Å; F369-T471 HydrophobicContact CZ-CG2 3.98Å
370	P	83.1	Confident	89.8	Confident	37 Å²	37	37.4 Å²	37.4	24%	0.24	21%	0.211	C	C	.	.			trans	-69	143.1	175.5	29.4	-33.8	0	0	0	110.5	M340 S372 M469	M340-P370 HydrophobicContact CE-CB 4.18Å; M340-P370 HydrophobicContact CE-CG 3.78Å; P370-S372 PolarHBondContact O-N 2.66Å; P370-S372 VanDerWaalsContact O-N 3.12Å; P370-M469 HydrophobicContact CG-SD 4.49Å
371	D	87.7	Confident	89.8	Confident	90 Å²	90	37.4 Å²	37.4	48%	0.481	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-72.4	2.8	174	-70.5	-27.9	0	0	0	112.9	N373 G374	D371-N373 PolarHBondContact O-N 3.47Å; D371-G374 CarbonylContact O-C 3.46Å; D371-G374 VanDerWaalsContact O-CA 3.3Å; D371-G374 WeakPolarHBondContact O-CA 3.36Å; D371-G374 PolarHBondContact O-N 2.93Å
372	S	89.4	Confident	89.8	Confident	59 Å²	59	37.4 Å²	37.4	41%	0.413	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-56	-35.9	-179.8	-55	0	0	0	0	112.6	W318 M340 P370 G374	W318-S372 WeakPolarHBondContact CH2-O 3.43Å; M340-S372 VanDerWaalsContact CE-CB 3.41Å; M340-S372 VanDerWaalsContact CE-OG 3.28Å; M340-S372 WeakPolarHBondContact CE-OG 3.45Å; P370-S372 PolarHBondContact O-N 2.66Å; P370-S372 VanDerWaalsContact O-N 3.12Å; S372-G374 PolarHBondContact O-N 2.86Å
373	N	92.5	Very high	89.8	Confident	11 Å²	11	37.4 Å²	37.4	6%	0.059	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-85.9	8.8	175.7	-72	-30.1	0	0	0	113.5	V339 M340 D371 T463 I467 M469	V339-N373 WeakPolarHBondContact CG2-OD1 3.42Å; M340-N373 PolarHBondContact N-OD1 3.32Å; M340-N373 PolarHBondContact O-ND2 2.89Å; D371-N373 PolarHBondContact O-N 3.47Å; N373-T463 WeakPolarHBondContact O-CG2 3.33Å; N373-I467 HydrophobicContact CB-CG2 3.91Å; N373-M469 HydrophobicContact CB-CE 4.23Å; N373-M469 HydrophobicContact CB-SD 4.08Å; N373-M469 PolarHBondContact ND2-SD 3.3Å; N373-M469 VanDerWaalsContact ND2-SD 3.43Å
374	G	91.9	Very high	89.9	Confident	31 Å²	31	36.5 Å²	36.5	32%	0.32	21%	0.205	S	C	.	.			trans	102.3	162.8	-168.3	0	0	0	0	0	112.3	D371 S372 V376 T463	D371-G374 CarbonylContact O-C 3.46Å; D371-G374 VanDerWaalsContact O-CA 3.3Å; D371-G374 WeakPolarHBondContact O-CA 3.36Å; D371-G374 PolarHBondContact O-N 2.93Å; S372-G374 PolarHBondContact O-N 2.86Å; G374-V376 PolarHBondContact O-N 2.67Å; G374-T463 VanDerWaalsContact O-CG2 3.32Å; G374-T463 WeakPolarHBondContact O-CG2 3.28Å
375	V	90.7	Very high	90	Very high	95 Å²	95	37.4 Å²	37.4	58%	0.576	21%	0.209	S	C	*	.			trans	-66.7	128.2	178	-178.4	0	0	0	0	109.8	D377	V375-D377 PolarHBondContact O-N 2.62Å
376	V	91.3	Very high	90.2	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.006	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	125.3	174.7	-179.5	0	0	0	0	109.6	F369 G374 Q378 Y379 N419 M469	F369-V376 HydrophobicContact CB-CG2 3.95Å; F369-V376 HydrophobicContact CD2-CG2 4.47Å; G374-V376 PolarHBondContact O-N 2.67Å; V376-Q378 WeakPolarHBondContact CG1-O 3.13Å; V376-Y379 HydrophobicContact CB-CE2 4.33Å; V376-Y379 HydrophobicContact CG1-CD1 4.45Å; V376-Y379 HydrophobicContact CG1-CD2 4.06Å; V376-Y379 HydrophobicContact CG1-CE1 4.02Å; V376-Y379 HydrophobicContact CG1-CE2 3.57Å; V376-Y379 HydrophobicContact CG1-CG 4.47Å; V376-N419 PolarHBondContact O-ND2 3.13Å; V376-M469 HydrophobicContact CG2-CE 3.63Å
377	D	90.9	Very high	90.4	Very high	66 Å²	66	36.3 Å²	36.3	35%	0.353	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	-35	178.5	-177.9	55.9	0	0	0	111.4	V375 N419 C462 V464	V375-D377 PolarHBondContact O-N 2.62Å; D377-N419 PolarHBondContact O-N 2.93Å; D377-C462 PolarHBondContact N-O 2.85Å; D377-V464 HydrophobicContact CB-CG2 3.87Å
378	Q	90.9	Very high	91	Very high	49 Å²	49	39 Å²	39	23%	0.229	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	145.8	-172	-58.9	-178.5	-19.8	0	0	112	V376 Y380 V416 G461 C462	V376-Q378 WeakPolarHBondContact CG1-O 3.13Å; Q378-Y380 HydrophobicContact CB-CE2 4.33Å; Q378-Y380 PolarHBondContact OE1-OH 2.68Å; Q378-V416 WeakPolarHBondContact CA-O 3.19Å; Q378-G461 CarbonylContact O-C 3.59Å; Q378-G461 WeakPolarHBondContact O-CA 3.15Å; Q378-C462 PolarHBondContact N-O 2.72Å; Q378-C462 PolarHBondContact O-N 3.32Å
379	Y	92.3	Very high	91.3	Very high	7 Å²	7	41.7 Å²	41.7	3%	0.027	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	139.7	174.3	-68.8	-95.5	0	0	0	110.6	F364 F369 V376 V416 P420 F421 V459 Q460	F364-Y379 AromaticContact CE2-CD1 3.91Å; F364-Y379 HydrophobicContact CE2-CD1 3.91Å; F364-Y379 AromaticContact CE2-CE1 3.97Å; F364-Y379 HydrophobicContact CE2-CE1 3.97Å; F364-Y379 HydrophobicContact CE2-CG 4.37Å; F364-Y379 HydrophobicContact CZ-CD1 4.1Å; F364-Y379 HydrophobicContact CZ-CG 4.34Å; F369-Y379 HydrophobicContact CD2-CD1 4.42Å; F369-Y379 AromaticContact CD2-CE1 3.76Å; F369-Y379 HydrophobicContact CD2-CE1 3.76Å; F369-Y379 HydrophobicContact CE2-CD1 4.31Å; F369-Y379 HydrophobicContact CE2-CE1 4.06Å; V376-Y379 HydrophobicContact CB-CE2 4.33Å; V376-Y379 HydrophobicContact CG1-CD1 4.45Å; V376-Y379 HydrophobicContact CG1-CD2 4.06Å; V376-Y379 HydrophobicContact CG1-CE1 4.02Å; V376-Y379 HydrophobicContact CG1-CE2 3.57Å; V376-Y379 HydrophobicContact CG1-CG 4.47Å; Y379-V416 PolarHBondContact N-O 3.47Å; Y379-V416 WeakPolarHBondContact O-CA 3.06Å; Y379-V416 WeakPolarHBondContact O-CB 3.01Å; Y379-V416 PolarHBondContact O-N 3.17Å; Y379-P420 HydrophobicContact CD2-CG 4.33Å; Y379-P420 HydrophobicContact CE2-CG 4.38Å; Y379-F421 HydrophobicContact CE2-CD2 4.25Å; Y379-F421 HydrophobicContact CE2-CE2 4.34Å; Y379-V459 HydrophobicContact CD1-CG1 4.05Å; Y379-Q460 CarbonylContact C-O 3.57Å; Y379-Q460 VanDerWaalsContact CA-O 3.31Å; Y379-Q460 WeakPolarHBondContact CA-O 3.38Å
380	Y	92.7	Very high	91.1	Very high	50 Å²	50	43.1 Å²	43.1	20%	0.196	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	131.2	174.8	-59.6	-71.6	0	0	0	108.6	Q378 L412 Y414 S415 Q460 C462	Q378-Y380 HydrophobicContact CB-CE2 4.33Å; Q378-Y380 PolarHBondContact OE1-OH 2.68Å; Y380-L412 HydrophobicContact CD1-CD1 3.82Å; Y380-L412 HydrophobicContact CD1-CD2 4.25Å; Y380-L412 HydrophobicContact CG-CD1 4.16Å; Y380-Y414 WeakPolarHBondContact CA-O 3.43Å; Y380-S415 WeakPolarHBondContact CE1-OG 3.33Å; Y380-Q460 PolarHBondContact N-O 2.85Å; Y380-Q460 PolarHBondContact O-N 2.79Å; Y380-C462 HydrophobicContact CE2-CB 4.37Å
381	I	94.1	Very high	90.9	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	116.8	176.1	-56.2	-179.9	0	0	0	106.9	V362 F364 V383 A413 Y414 Y431 I433 V457	V362-I381 HydrophobicContact CG1-CD1 4.41Å; V362-I381 HydrophobicContact CG1-CG2 4.45Å; V362-I381 HydrophobicContact CG2-CG2 4.3Å; F364-I381 HydrophobicContact CE1-CD1 4.27Å; I381-V383 HydrophobicContact CG2-CG2 4.48Å; I381-A413 PolarHBondContact O-N 2.89Å; I381-Y414 HydrophobicContact CD1-CD2 4.26Å; I381-Y414 HydrophobicContact CD1-CG 4.35Å; I381-Y414 PolarHBondContact N-O 2.84Å; I381-Y414 PolarHBondContact O-N 2.8Å; I381-Y431 HydrophobicContact CD1-CD1 4.25Å; I381-Y431 HydrophobicContact CD1-CD2 3.41Å; I381-Y431 VanDerWaalsContact CD1-CD2 3.41Å; I381-Y431 HydrophobicContact CD1-CE2 4.15Å; I381-Y431 HydrophobicContact CD1-CG 3.46Å; I381-Y431 VanDerWaalsContact CD1-CG 3.46Å; I381-I433 HydrophobicContact CG2-CD1 4.14Å; I381-V457 HydrophobicContact CG2-CG2 3.55Å
382	I	93.8	Very high	90.3	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	130.1	-175.4	-57.8	103.4	0	0	0	109	P410 Y411 L412 V457 K458 Q460	I382-P410 HydrophobicContact CG2-CB 3.8Å; I382-Y411 CarbonylContact C-O 3.56Å; I382-Y411 VanDerWaalsContact CA-O 3.31Å; I382-Y411 WeakPolarHBondContact CA-O 3.42Å; I382-Y411 WeakPolarHBondContact CG2-O 3.4Å; I382-L412 HydrophobicContact CG1-CD1 4.22Å; I382-V457 CarbonylContact O-C 3.54Å; I382-V457 WeakPolarHBondContact O-CA 3.3Å; I382-V457 WeakPolarHBondContact O-CG2 3.17Å; I382-K458 HydrophobicContact CB-CG 3.81Å; I382-K458 HydrophobicContact CD1-CG 4.24Å; I382-K458 HydrophobicContact CG2-CG 4.31Å; I382-K458 PolarHBondContact N-O 3.2Å; I382-K458 PolarHBondContact O-N 2.99Å; I382-Q460 HydrophobicContact CD1-CB 3.74Å
383	V	94.9	Very high	89.6	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	145.3	-174.6	-179.2	0	0	0	0	109.4	I381 P410 Y411 A413 I433 L449 Y455 F456 V457	I381-V383 HydrophobicContact CG2-CG2 4.48Å; V383-P410 CarbonylContact O-C 3.6Å; V383-P410 WeakPolarHBondContact O-CA 3.26Å; V383-Y411 HydrophobicContact CB-CD1 4.39Å; V383-Y411 HydrophobicContact CB-CE1 3.74Å; V383-Y411 HydrophobicContact CB-CE2 4.46Å; V383-Y411 HydrophobicContact CG1-CE1 3.86Å; V383-Y411 PolarHBondContact N-O 3.24Å; V383-Y411 WeakPolarHBondContact O-CD1 3.5Å; V383-Y411 PolarHBondContact O-N 2.93Å; V383-A413 HydrophobicContact CB-CB 4.32Å; V383-A413 HydrophobicContact CG2-CB 3.56Å; V383-I433 HydrophobicContact CG2-CD1 3.46Å; V383-I433 VanDerWaalsContact CG2-CD1 3.46Å; V383-I433 HydrophobicContact CG2-CG1 4.23Å; V383-I433 HydrophobicContact CG2-CG2 4.22Å; V383-L449 HydrophobicContact CG1-CD2 4.36Å; V383-Y455 HydrophobicContact CG1-CD1 3.62Å; V383-Y455 HydrophobicContact CG1-CE1 4.34Å; V383-Y455 HydrophobicContact CG1-CG 4.29Å; V383-F456 CarbonylContact C-O 3.56Å; V383-F456 WeakPolarHBondContact CA-O 3.43Å; V383-V457 HydrophobicContact CG2-CG2 4.19Å
384	T	94.9	Very high	88.3	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	153.2	177.1	-168.3	0	0	0	0	110.7	D386 W408 P410 Y455 F456 Y473	T384-D386 PolarHBondContact OG1-N 2.9Å; T384-D386 PolarHBondContact OG1-O 2.86Å; T384-W408 PolarHBondContact OG1-O 3.23Å; T384-W408 VanDerWaalsContact OG1-O 3.06Å; T384-P410 HydrophobicContact CG2-CG 4.44Å; T384-P410 WeakPolarHBondContact OG1-CD 3.48Å; T384-Y455 CarbonylContact O-C 3.52Å; T384-Y455 WeakPolarHBondContact O-CA 3.38Å; T384-Y455 WeakPolarHBondContact O-CD1 3.39Å; T384-F456 HydrophobicContact CG2-CB 3.95Å; T384-F456 HydrophobicContact CG2-CD2 4.5Å; T384-F456 PolarHBondContact N-O 2.72Å; T384-F456 PolarHBondContact O-N 3.38Å; T384-Y473 HydrophobicContact CG2-CD1 3.94Å; T384-Y473 HydrophobicContact CG2-CE1 3.48Å; T384-Y473 VanDerWaalsContact CG2-CE1 3.48Å
385	E	95	Very high	87.6	Confident	22 Å²	22	56.4 Å²	56.4	10%	0.103	27%	0.269	C	S	.	.	S	Bend	trans	-85	-21.2	166.9	-71.8	172.6	-155.3	0	0	111.7	K407 W408 K450 Q454 Y455	E385-K407 WeakPolarHBondContact OE2-CA 3.43Å; E385-W408 HydrophobicContact CB-CB 4.47Å; E385-W408 HydrophobicContact CG-CB 4.06Å; E385-W408 PolarHBondContact N-O 3.02Å; E385-W408 VanDerWaalsContact OE1-CD2 3.24Å; E385-W408 VanDerWaalsContact OE1-CG 3.29Å; E385-W408 PolarHBondContact OE2-N 2.92Å; E385-W408 VanDerWaalsContact OE2-N 3.16Å; E385-K450 VanDerWaalsContact CD-NZ 3.31Å; E385-K450 VanDerWaalsContact OE1-CD 3.32Å; E385-K450 WeakPolarHBondContact OE1-CD 3.49Å; E385-K450 WeakPolarHBondContact OE1-CE 3.07Å; E385-K450 IonicContact OE1-NZ 2.79Å; E385-K450 PolarHBondContact OE1-NZ 3.05Å; E385-K450 IonicContact OE2-NZ 3Å; E385-K450 PolarHBondContact OE2-NZ 2.84Å; E385-Q454 WeakPolarHBondContact CA-O 3.38Å; E385-Y455 HydrophobicContact CB-CE1 4.43Å; E385-Y455 HydrophobicContact CG-CD1 3.75Å; E385-Y455 HydrophobicContact CG-CE1 3.21Å; E385-Y455 HydrophobicContact CG-CE2 4.43Å; E385-Y455 PolarHBondContact OE1-OH 2.84Å
386	D	92.7	Very high	87.2	Confident	25 Å²	25	52.7 Å²	52.7	13%	0.134	25%	0.245	C	C	.	.			trans	-141.9	113	-175.9	-161.5	-34.8	0	0	0	109.8	T384 Q388 L389 K407	T384-D386 PolarHBondContact OG1-N 2.9Å; T384-D386 PolarHBondContact OG1-O 2.86Å; D386-Q388 PolarHBondContact O-N 2.88Å; D386-Q388 WeakPolarHBondContact OD1-CB 3.3Å; D386-Q388 PolarHBondContact OD1-N 2.89Å; D386-L389 HydrophobicContact CB-CD1 3.87Å; D386-L389 HydrophobicContact CB-CG 3.92Å; D386-L389 PolarHBondContact O-N 3.06Å; D386-K407 HydrophobicContact CB-CD 4.02Å; D386-K407 VanDerWaalsContact OD2-CD 3.32Å; D386-K407 WeakPolarHBondContact OD2-CD 3.38Å; D386-K407 IonicContact OD2-NZ 3.35Å; D386-K407 PolarHBondContact OD2-NZ 2.88Å
387	E	90.7	Very high	87.1	Confident	91 Å²	91	55.6 Å²	55.6	43%	0.425	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-66	-25.5	179.1	59.2	176	-170.8	0	0	112.7	L389 D390 Y473	E387-L389 PolarHBondContact O-N 2.78Å; E387-D390 WeakPolarHBondContact O-CB 3.34Å; E387-D390 PolarHBondContact O-N 2.87Å; E387-Y473 HydrophobicContact CB-CD2 3.73Å; E387-Y473 HydrophobicContact CB-CE2 4.17Å; E387-Y473 HydrophobicContact CB-CG 4.04Å
388	Q	88.9	Confident	87.1	Confident	169 Å²	169	53.2 Å²	53.2	79%	0.79	25%	0.25	S	S	*	.	G	3₁₀ helix	trans	-71.4	-16.3	-179.8	-55.7	-173.9	-5.7	0	0	112.2	D386 D390	D386-Q388 PolarHBondContact O-N 2.88Å; D386-Q388 WeakPolarHBondContact OD1-CB 3.3Å; D386-Q388 PolarHBondContact OD1-N 2.89Å; Q388-D390 VanDerWaalsContact C-N 3.26Å
389	L	88.8	Confident	87.2	Confident	71 Å²	71	51.5 Å²	51.5	37%	0.372	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-80.5	-4.1	173.4	-61.3	179.7	0	0	0	112.9	D386 E387 K391 K407 P409	D386-L389 HydrophobicContact CB-CD1 3.87Å; D386-L389 HydrophobicContact CB-CG 3.92Å; D386-L389 PolarHBondContact O-N 3.06Å; E387-L389 PolarHBondContact O-N 2.78Å; L389-K391 PolarHBondContact O-N 2.8Å; L389-K407 HydrophobicContact CD1-CB 4.26Å; L389-P409 HydrophobicContact CB-CB 4Å; L389-P409 HydrophobicContact CD1-CB 4.15Å
390	D	85.1	Confident	87.2	Confident	31 Å²	31	56 Å²	56	17%	0.166	26%	0.261	C	S	.	.			trans	-72.1	95.5	174.5	-169	11.4	0	0	0	111.6	R265 E387 Q388 F392 P410 K458 Y473	R265-D390 IonicContact NH2-OD2 3.75Å; R265-D390 PolarHBondContact NH2-OD2 3.47Å; R265-D390 VanDerWaalsContact NH2-OD2 3.09Å; E387-D390 WeakPolarHBondContact O-CB 3.34Å; E387-D390 PolarHBondContact O-N 2.87Å; Q388-D390 VanDerWaalsContact C-N 3.26Å; D390-F392 PolarHBondContact O-N 2.83Å; D390-F392 VanDerWaalsContact OD1-CA 3.3Å; D390-F392 WeakPolarHBondContact OD1-CA 3.06Å; D390-F392 PolarHBondContact OD1-N 3.16Å; D390-P410 HydrophobicContact CB-CG 3.76Å; D390-K458 IonicContact OD1-NZ 3Å; D390-K458 IonicContact OD2-NZ 3.17Å; D390-K458 PolarHBondContact OD2-NZ 3Å; D390-Y473 HydrophobicContact CB-CE2 3.85Å; D390-Y473 WeakPolarHBondContact CB-OH 3.04Å; D390-Y473 VanDerWaalsContact CG-OH 3.31Å; D390-Y473 PolarHBondContact OD2-OH 2.83Å
391	K	80.9	Confident	87.1	Confident	137 Å²	137	56.4 Å²	56.4	60%	0.596	27%	0.272	S	S	*	.			trans	-76.6	4.9	172	-62.9	-175.3	-178.7	-179.7	0	113.2	K270 L389 Y393	K270-K391 PolarHBondContact NZ-O 3.21Å; L389-K391 PolarHBondContact O-N 2.8Å; K391-Y393 HydrophobicContact CB-CD1 4.45Å; K391-Y393 HydrophobicContact CB-CD2 3.82Å; K391-Y393 HydrophobicContact CB-CE1 4.07Å; K391-Y393 HydrophobicContact CB-CE2 3.4Å; K391-Y393 VanDerWaalsContact CB-CE2 3.4Å; K391-Y393 HydrophobicContact CB-CG 4.34Å; K391-Y393 HydrophobicContact CD-CE2 3.58Å; K391-Y393 WeakPolarHBondContact CD-OH 3.38Å; K391-Y393 HydrophobicContact CG-CE2 4.02Å; K391-Y393 PolarHBondContact O-N 2.76Å
392	F	74.6	Confident	87	Confident	9 Å²	9	56.4 Å²	56.4	4%	0.039	27%	0.272	C	S	.	.			trans	54.4	53.1	179.5	-161.9	-169.9	0	0	0	111.2	V263 R265 K270 F272 L309 D390 E470	V263-F392 HydrophobicContact CB-CE2 3.83Å; V263-F392 HydrophobicContact CB-CZ 3.83Å; V263-F392 HydrophobicContact CG1-CE2 3.55Å; V263-F392 HydrophobicContact CG1-CZ 3.74Å; V263-F392 HydrophobicContact CG2-CE2 4.44Å; R265-F392 HydrophobicContact CG-CZ 4.34Å; R265-F392 VanDerWaalsContact NH2-CD2 3.25Å; K270-F392 HydrophobicContact CB-CD1 3.75Å; K270-F392 HydrophobicContact CB-CE1 3.21Å; K270-F392 HydrophobicContact CB-CE2 4.4Å; K270-F392 HydrophobicContact CB-CZ 3.59Å; K270-F392 HydrophobicContact CD-CB 3.98Å; K270-F392 HydrophobicContact CD-CD1 3.19Å; K270-F392 HydrophobicContact CD-CD2 4.24Å; K270-F392 HydrophobicContact CD-CE1 3.67Å; K270-F392 HydrophobicContact CD-CG 3.51Å; K270-F392 HydrophobicContact CD-CZ 4.35Å; K270-F392 WeakPolarHBondContact CD-O 3.31Å; K270-F392 VanDerWaalsContact CE-O 3.27Å; K270-F392 WeakPolarHBondContact CE-O 3.23Å; K270-F392 HydrophobicContact CG-CD1 4.1Å; K270-F392 HydrophobicContact CG-CE1 4.07Å; K270-F392 PolarHBondContact NZ-O 3.42Å; F272-F392 WeakPolarHBondContact CZ-O 3.17Å; L309-F392 HydrophobicContact CD1-CD1 3.87Å; L309-F392 HydrophobicContact CD1-CE1 3.67Å; D390-F392 PolarHBondContact O-N 2.83Å; D390-F392 VanDerWaalsContact OD1-CA 3.3Å; D390-F392 WeakPolarHBondContact OD1-CA 3.06Å; D390-F392 PolarHBondContact OD1-N 3.16Å; F392-E470 WeakPolarHBondContact CE2-OE2 3.45Å
393	Y	74	Confident	86.8	Confident	121 Å²	121	60.2 Å²	60.2	48%	0.475	29%	0.29	S	S	.	.			trans	-81.6	152.6	176.6	-66.3	-53.9	0	0	0	111.1	K391 Y395	K391-Y393 HydrophobicContact CB-CD1 4.45Å; K391-Y393 HydrophobicContact CB-CD2 3.82Å; K391-Y393 HydrophobicContact CB-CE1 4.07Å; K391-Y393 HydrophobicContact CB-CE2 3.4Å; K391-Y393 VanDerWaalsContact CB-CE2 3.4Å; K391-Y393 HydrophobicContact CB-CG 4.34Å; K391-Y393 HydrophobicContact CD-CE2 3.58Å; K391-Y393 WeakPolarHBondContact CD-OH 3.38Å; K391-Y393 HydrophobicContact CG-CE2 4.02Å; K391-Y393 PolarHBondContact O-N 2.76Å; Y393-Y395 PolarHBondContact O-N 2.92Å
394	A	66.2	Low	86.7	Confident	48 Å²	48	67.8 Å²	67.8	40%	0.397	32%	0.322	S	S	.	.	S	Bend	trans	-72	-17.9	174.4	0	0	0	0	0	113.6	F272	F272-A394 HydrophobicContact CB-CB 4.47Å; F272-A394 HydrophobicContact CD1-CB 3.7Å; F272-A394 HydrophobicContact CD2-CB 4.21Å; F272-A394 HydrophobicContact CE1-CB 3.83Å; F272-A394 HydrophobicContact CE2-CB 4.33Å; F272-A394 HydrophobicContact CG-CB 3.88Å; F272-A394 HydrophobicContact CZ-CB 4.13Å
395	Y	76.5	Confident	86.7	Confident	193 Å²	193	71.9 Å²	71.9	76%	0.757	34%	0.338	S	S	*	.	S	Bend	trans	-121.7	135.5	178.6	-179	-100.6	0	0	0	109.9	Y393	Y393-Y395 PolarHBondContact O-N 2.92Å
396	H	83	Confident	86.6	Confident	16 Å²	16	75.6 Å²	75.6	7%	0.074	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-101.4	144.2	179.8	-63.3	-62.8	0	0	0	110.6	L412	H396-L412 HydrophobicContact CB-CB 3.83Å
397	M	89.4	Confident	86.6	Confident	63 Å²	63	80 Å²	80	31%	0.31	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	155	173.3	-62.7	-170.9	-170.2	0	0	110.3	V402 Y405 P409 Y411 L412	M397-V402 HydrophobicContact CB-CG1 3.85Å; M397-V402 HydrophobicContact SD-CG1 4.15Å; M397-Y405 HydrophobicContact CE-CE2 4.43Å; M397-Y405 HydrophobicContact SD-CE2 3.86Å; M397-P409 HydrophobicContact SD-CG 4.26Å; M397-Y411 CarbonylContact O-C 3.58Å; M397-Y411 WeakPolarHBondContact O-CA 3.48Å; M397-Y411 VanDerWaalsContact O-CB 3.26Å; M397-Y411 WeakPolarHBondContact O-CB 3.49Å; M397-L412 PolarHBondContact O-N 2.89Å
398	G	90.7	Very high	86.8	Confident	16 Å²	16	76 Å²	76	17%	0.165	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	162.2	167.5	0	0	0	0	0	111.3	K400 S401 V402	G398-K400 VanDerWaalsContact C-N 3.27Å; G398-K400 PolarHBondContact O-N 3.07Å; G398-S401 WeakPolarHBondContact O-CB 3.34Å; G398-S401 PolarHBondContact O-N 2.97Å; G398-V402 PolarHBondContact O-N 2.83Å
399	W	92.7	Very high	87	Confident	12 Å²	12	68.6 Å²	68.6	5%	0.045	34%	0.338	C	S	.	.	H	α-helix	trans	-49.9	-42.8	-179.8	179.3	90.5	0	0	0	113.8	S401 V402 Q403 W408 Y411 C438 Y439 C445 G447 P448	W399-S401 VanDerWaalsContact C-N 3.31Å; W399-S401 PolarHBondContact O-N 3Å; W399-V402 WeakPolarHBondContact O-CG2 3.39Å; W399-V402 PolarHBondContact O-N 3.33Å; W399-Q403 HydrophobicContact CE3-CG 4.43Å; W399-Q403 HydrophobicContact CH2-CG 4.33Å; W399-Q403 HydrophobicContact CZ3-CG 4.25Å; W399-Q403 PolarHBondContact O-NE2 2.75Å; W399-W408 AromaticContact NE1-CH2 3.73Å; W399-W408 AromaticContact NE1-CZ3 3.83Å; W399-Y411 HydrophobicContact CB-CD2 4.23Å; W399-Y411 HydrophobicContact CB-CE2 4.21Å; W399-Y411 AromaticContact CD1-CE2 3.99Å; W399-C438 HydrophobicContact CD2-CB 4.28Å; W399-C438 HydrophobicContact CE3-CB 3.52Å; W399-C438 HydrophobicContact CH2-CB 4.17Å; W399-C438 HydrophobicContact CZ3-CB 3.46Å; W399-C438 VanDerWaalsContact CZ3-CB 3.46Å; W399-Y439 HydrophobicContact CH2-CE1 4.42Å; W399-C445 VanDerWaalsContact CB-O 3.24Å; W399-C445 WeakPolarHBondContact CB-O 3.24Å; W399-G447 PolarHBondContact NE1-O 2.83Å; W399-G447 VanDerWaalsContact NE1-O 3.12Å; W399-P448 HydrophobicContact CZ2-CG 3.96Å; W399-P448 PolarHBondContact NE1-O 2.89Å
400	K	91	Very high	87.3	Confident	101 Å²	101	65.8 Å²	65.8	44%	0.439	32%	0.324	S	S	.	.	H	α-helix	trans	-63.7	-34.5	179	-170.1	170.6	-165.8	162.7	0	113.1	G398 V402 E441	G398-K400 VanDerWaalsContact C-N 3.27Å; G398-K400 PolarHBondContact O-N 3.07Å; K400-V402 VanDerWaalsContact C-N 3.34Å; K400-E441 WeakPolarHBondContact CD-O 3.22Å; K400-E441 PolarHBondContact NZ-O 2.92Å
401	S	90.8	Very high	87.7	Confident	60 Å²	60	64.3 Å²	64.3	42%	0.42	32%	0.316	S	S	.	.	H	α-helix	trans	-74.7	-24.9	-178.6	-59	0	0	0	0	112.8	G398 W399 K404	G398-S401 WeakPolarHBondContact O-CB 3.34Å; G398-S401 PolarHBondContact O-N 2.97Å; W399-S401 VanDerWaalsContact C-N 3.31Å; W399-S401 PolarHBondContact O-N 3Å; S401-K404 WeakPolarHBondContact O-CE 3.28Å; S401-K404 WeakPolarHBondContact O-CG 3.05Å
402	V	92	Very high	88.2	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-83.5	-16.2	179.6	-64.5	0	0	0	0	114	M397 G398 W399 K400 K404 Y405 W408 P409 Y411	M397-V402 HydrophobicContact CB-CG1 3.85Å; M397-V402 HydrophobicContact SD-CG1 4.15Å; G398-V402 PolarHBondContact O-N 2.83Å; W399-V402 WeakPolarHBondContact O-CG2 3.39Å; W399-V402 PolarHBondContact O-N 3.33Å; K400-V402 VanDerWaalsContact C-N 3.34Å; V402-K404 PolarHBondContact O-N 2.94Å; V402-Y405 HydrophobicContact CB-CD2 4.49Å; V402-Y405 WeakPolarHBondContact O-CD2 3.23Å; V402-Y405 PolarHBondContact O-N 3.29Å; V402-W408 HydrophobicContact CB-CB 4.22Å; V402-W408 HydrophobicContact CB-CG 4.11Å; V402-W408 HydrophobicContact CG2-CB 4.32Å; V402-W408 HydrophobicContact CG2-CD2 4.01Å; V402-W408 HydrophobicContact CG2-CE3 4.28Å; V402-W408 HydrophobicContact CG2-CG 4.02Å; V402-W408 PolarHBondContact O-NE1 3.09Å; V402-P409 HydrophobicContact CG1-CG 3.91Å; V402-Y411 HydrophobicContact CG1-CD1 4.5Å; V402-Y411 HydrophobicContact CG1-CG 4.38Å; V402-Y411 HydrophobicContact CG2-CD1 3.94Å; V402-Y411 HydrophobicContact CG2-CG 4Å
403	Q	91.2	Very high	89.1	Confident	80 Å²	80	58.4 Å²	58.4	37%	0.374	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-26.3	178.8	-62	-53.2	-51.3	0	0	114.1	W399 Y405 W408	W399-Q403 HydrophobicContact CE3-CG 4.43Å; W399-Q403 HydrophobicContact CH2-CG 4.33Å; W399-Q403 HydrophobicContact CZ3-CG 4.25Å; W399-Q403 PolarHBondContact O-NE2 2.75Å; Q403-Y405 VanDerWaalsContact C-N 3.28Å; Q403-Y405 PolarHBondContact O-N 3.18Å; Q403-W408 VanDerWaalsContact NE2-CH2 3.29Å; Q403-W408 VanDerWaalsContact OE1-CZ2 3.25Å
404	K	92.7	Very high	89.8	Confident	158 Å²	158	55.2 Å²	55.2	69%	0.687	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-10.1	178.9	71.3	-172.9	177.5	175.8	0	114.5	S401 V402	S401-K404 WeakPolarHBondContact O-CE 3.28Å; S401-K404 WeakPolarHBondContact O-CG 3.05Å; V402-K404 PolarHBondContact O-N 2.94Å
405	Y	93	Very high	90.7	Very high	87 Å²	87	55 Å²	55	34%	0.341	28%	0.275	S	S	.	.	S	Bend	trans	-100.1	139.9	-179.3	-58.8	-86.1	0	0	0	110.5	M397 V402 Q403 K407 P409	M397-Y405 HydrophobicContact CE-CE2 4.43Å; M397-Y405 HydrophobicContact SD-CE2 3.86Å; V402-Y405 HydrophobicContact CB-CD2 4.49Å; V402-Y405 WeakPolarHBondContact O-CD2 3.23Å; V402-Y405 PolarHBondContact O-N 3.29Å; Q403-Y405 VanDerWaalsContact C-N 3.28Å; Q403-Y405 PolarHBondContact O-N 3.18Å; Y405-K407 VanDerWaalsContact CB-O 3.23Å; Y405-K407 WeakPolarHBondContact CB-O 3.26Å; Y405-P409 HydrophobicContact CD2-CG 3.93Å; Y405-P409 HydrophobicContact CE2-CG 4.11Å; Y405-P409 HydrophobicContact CG-CG 4.28Å
406	A	93.3	Very high	90.9	Very high	99 Å²	99	46.8 Å²	46.8	82%	0.818	25%	0.245	S	C	*	.	S	Bend	trans	-61.1	-51.2	177.5	0	0	0	0	0	111.8	K450	A406-K450 PolarHBondContact O-NZ 3.19Å
407	K	93.3	Very high	90.9	Very high	119 Å²	119	54 Å²	54	52%	0.517	28%	0.276	S	S	.	.	S	Bend	trans	-100.3	131.6	163.7	-70.2	-165.3	-177.5	-171.6	0	109.6	E385 D386 L389 Y405 P409	E385-K407 WeakPolarHBondContact OE2-CA 3.43Å; D386-K407 HydrophobicContact CB-CD 4.02Å; D386-K407 VanDerWaalsContact OD2-CD 3.32Å; D386-K407 WeakPolarHBondContact OD2-CD 3.38Å; D386-K407 IonicContact OD2-NZ 3.35Å; D386-K407 PolarHBondContact OD2-NZ 2.88Å; L389-K407 HydrophobicContact CD1-CB 4.26Å; Y405-K407 VanDerWaalsContact CB-O 3.23Å; Y405-K407 WeakPolarHBondContact CB-O 3.26Å; K407-P409 WeakPolarHBondContact O-CD 3.47Å
408	W	94	Very high	90.6	Very high	5 Å²	5	58 Å²	58	2%	0.019	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-75.8	120.1	-178.3	-67.9	-7.7	0	0	0	111.5	T384 E385 W399 V402 Q403 Y411 P448 K450 Y455	T384-W408 PolarHBondContact OG1-O 3.23Å; T384-W408 VanDerWaalsContact OG1-O 3.06Å; E385-W408 HydrophobicContact CB-CB 4.47Å; E385-W408 HydrophobicContact CG-CB 4.06Å; E385-W408 PolarHBondContact N-O 3.02Å; E385-W408 VanDerWaalsContact OE1-CD2 3.24Å; E385-W408 VanDerWaalsContact OE1-CG 3.29Å; E385-W408 PolarHBondContact OE2-N 2.92Å; E385-W408 VanDerWaalsContact OE2-N 3.16Å; W399-W408 AromaticContact NE1-CH2 3.73Å; W399-W408 AromaticContact NE1-CZ3 3.83Å; V402-W408 HydrophobicContact CB-CB 4.22Å; V402-W408 HydrophobicContact CB-CG 4.11Å; V402-W408 HydrophobicContact CG2-CB 4.32Å; V402-W408 HydrophobicContact CG2-CD2 4.01Å; V402-W408 HydrophobicContact CG2-CE3 4.28Å; V402-W408 HydrophobicContact CG2-CG 4.02Å; V402-W408 PolarHBondContact O-NE1 3.09Å; Q403-W408 VanDerWaalsContact NE2-CH2 3.29Å; Q403-W408 VanDerWaalsContact OE1-CZ2 3.25Å; W408-Y411 AromaticContact CE3-CE1 3.95Å; W408-Y411 HydrophobicContact CE3-CE1 3.95Å; W408-P448 WeakPolarHBondContact CH2-O 3.34Å; W408-K450 HydrophobicContact CH2-CG 3.78Å; W408-K450 HydrophobicContact CZ2-CD 4.18Å; W408-K450 HydrophobicContact CZ2-CG 3.58Å; W408-K450 HydrophobicContact CZ3-CG 4.41Å; W408-Y455 AromaticContact CE3-CE1 3.95Å; W408-Y455 HydrophobicContact CE3-CE1 3.95Å; W408-Y455 HydrophobicContact CZ3-CE1 4.38Å; W408-Y455 WeakPolarHBondContact CZ3-OH 3.48Å
409	P	93.9	Very high	90.4	Very high	15 Å²	15	58.3 Å²	58.3	10%	0.097	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-70.2	172.9	170.7	33.1	-36.6	0	0	0	110.5	L389 M397 V402 Y405 K407 Y411	L389-P409 HydrophobicContact CB-CB 4Å; L389-P409 HydrophobicContact CD1-CB 4.15Å; M397-P409 HydrophobicContact SD-CG 4.26Å; V402-P409 HydrophobicContact CG1-CG 3.91Å; Y405-P409 HydrophobicContact CD2-CG 3.93Å; Y405-P409 HydrophobicContact CE2-CG 4.11Å; Y405-P409 HydrophobicContact CG-CG 4.28Å; K407-P409 WeakPolarHBondContact O-CD 3.47Å; P409-Y411 PolarHBondContact O-N 3.44Å
410	P	94.1	Very high	90.2	Very high	11 Å²	11	59.2 Å²	59.2	7%	0.071	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-56.2	123.6	-179.6	-26.9	35.3	0	0	0	113.6	I382 V383 T384 D390 Y473	I382-P410 HydrophobicContact CG2-CB 3.8Å; V383-P410 CarbonylContact O-C 3.6Å; V383-P410 WeakPolarHBondContact O-CA 3.26Å; T384-P410 HydrophobicContact CG2-CG 4.44Å; T384-P410 WeakPolarHBondContact OG1-CD 3.48Å; D390-P410 HydrophobicContact CB-CG 3.76Å; P410-Y473 VanDerWaalsContact CG-OH 3.23Å; P410-Y473 WeakPolarHBondContact CG-OH 3.41Å
411	Y	93.5	Very high	90.1	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	154.8	177.1	75	-85.5	0	0	0	111.2	I382 V383 M397 W399 V402 W408 P409 A413 L449	I382-Y411 CarbonylContact C-O 3.56Å; I382-Y411 VanDerWaalsContact CA-O 3.31Å; I382-Y411 WeakPolarHBondContact CA-O 3.42Å; I382-Y411 WeakPolarHBondContact CG2-O 3.4Å; V383-Y411 HydrophobicContact CB-CD1 4.39Å; V383-Y411 HydrophobicContact CB-CE1 3.74Å; V383-Y411 HydrophobicContact CB-CE2 4.46Å; V383-Y411 HydrophobicContact CG1-CE1 3.86Å; V383-Y411 PolarHBondContact N-O 3.24Å; V383-Y411 WeakPolarHBondContact O-CD1 3.5Å; V383-Y411 PolarHBondContact O-N 2.93Å; M397-Y411 CarbonylContact O-C 3.58Å; M397-Y411 WeakPolarHBondContact O-CA 3.48Å; M397-Y411 VanDerWaalsContact O-CB 3.26Å; M397-Y411 WeakPolarHBondContact O-CB 3.49Å; W399-Y411 HydrophobicContact CB-CD2 4.23Å; W399-Y411 HydrophobicContact CB-CE2 4.21Å; W399-Y411 AromaticContact CD1-CE2 3.99Å; V402-Y411 HydrophobicContact CG1-CD1 4.5Å; V402-Y411 HydrophobicContact CG1-CG 4.38Å; V402-Y411 HydrophobicContact CG2-CD1 3.94Å; V402-Y411 HydrophobicContact CG2-CG 4Å; W408-Y411 AromaticContact CE3-CE1 3.95Å; W408-Y411 HydrophobicContact CE3-CE1 3.95Å; P409-Y411 PolarHBondContact O-N 3.44Å; Y411-A413 HydrophobicContact CE2-CB 3.97Å; Y411-A413 PolarHBondContact O-N 2.8Å; Y411-L449 WeakPolarHBondContact OH-CD2 3.08Å
412	L	92.9	Very high	89.9	Confident	23 Å²	23	55.7 Å²	55.7	12%	0.12	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	117.4	178.4	-173.2	65.7	0	0	0	109.5	Y380 I382 H396 M397 Y414 Y444	Y380-L412 HydrophobicContact CD1-CD1 3.82Å; Y380-L412 HydrophobicContact CD1-CD2 4.25Å; Y380-L412 HydrophobicContact CG-CD1 4.16Å; I382-L412 HydrophobicContact CG1-CD1 4.22Å; H396-L412 HydrophobicContact CB-CB 3.83Å; M397-L412 PolarHBondContact O-N 2.89Å; L412-Y414 VanDerWaalsContact CD1-O 3.22Å; L412-Y414 WeakPolarHBondContact CD1-O 3.3Å; L412-Y444 VanDerWaalsContact C-OH 3.23Å; L412-Y444 HydrophobicContact CB-CE2 3.78Å; L412-Y444 HydrophobicContact CD2-CD2 4.29Å; L412-Y444 HydrophobicContact CD2-CE2 3.64Å; L412-Y444 HydrophobicContact CG-CE2 3.56Å; L412-Y444 WeakPolarHBondContact O-CE2 3.23Å; L412-Y444 PolarHBondContact O-OH 3.43Å; L412-Y444 VanDerWaalsContact O-OH 3.07Å
413	A	91.8	Very high	89.6	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	-33.8	179.7	0	0	0	0	0	113.1	I381 V383 Y411 I433 Y444 N446	I381-A413 PolarHBondContact O-N 2.89Å; V383-A413 HydrophobicContact CB-CB 4.32Å; V383-A413 HydrophobicContact CG2-CB 3.56Å; Y411-A413 HydrophobicContact CE2-CB 3.97Å; Y411-A413 PolarHBondContact O-N 2.8Å; A413-I433 HydrophobicContact CB-CG1 4.09Å; A413-I433 HydrophobicContact CB-CG2 4.03Å; A413-Y444 VanDerWaalsContact CA-OH 3.28Å; A413-Y444 WeakPolarHBondContact CA-OH 3.41Å; A413-Y444 PolarHBondContact N-OH 3.45Å; A413-Y444 PolarHBondContact O-OH 3.43Å; A413-N446 WeakPolarHBondContact O-CB 3.46Å
414	Y	89.7	Confident	89.3	Confident	53 Å²	53	59.6 Å²	59.6	21%	0.208	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	144.8	160.9	-82.2	-94.5	0	0	0	114.6	Y380 I381 L412 Y431 L432 I433 Y444 N446	Y380-Y414 WeakPolarHBondContact CA-O 3.43Å; I381-Y414 HydrophobicContact CD1-CD2 4.26Å; I381-Y414 HydrophobicContact CD1-CG 4.35Å; I381-Y414 PolarHBondContact N-O 2.84Å; I381-Y414 PolarHBondContact O-N 2.8Å; L412-Y414 VanDerWaalsContact CD1-O 3.22Å; L412-Y414 WeakPolarHBondContact CD1-O 3.3Å; Y414-Y431 AromaticContact CD1-CD1 3.87Å; Y414-Y431 HydrophobicContact CD1-CD1 3.87Å; Y414-Y431 HydrophobicContact CD2-CD1 4.46Å; Y414-Y431 HydrophobicContact CE1-CD1 4.05Å; Y414-Y431 HydrophobicContact CG-CD1 4.08Å; Y414-L432 WeakPolarHBondContact CE2-O 3.26Å; Y414-L432 PolarHBondContact OH-O 3.46Å; Y414-I433 HydrophobicContact CE2-CG1 4.49Å; Y414-Y444 WeakPolarHBondContact CA-OH 3.28Å; Y414-Y444 PolarHBondContact N-OH 2.92Å; Y414-N446 VanDerWaalsContact CE2-ND2 3.25Å; Y414-N446 WeakPolarHBondContact CE2-ND2 3.39Å; Y414-N446 VanDerWaalsContact CZ-ND2 3.35Å; Y414-N446 PolarHBondContact OH-ND2 3.4Å; Y414-N446 VanDerWaalsContact OH-ND2 3.14Å
415	S	84.8	Confident	89	Confident	43 Å²	43	60.8 Å²	60.8	30%	0.301	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	94.1	167.9	-175.2	0	0	0	0	110.1	Y380 K417	Y380-S415 WeakPolarHBondContact CE1-OG 3.33Å; S415-K417 PolarHBondContact O-N 2.86Å
416	V	82	Confident	88.8	Confident	21 Å²	21	58.8 Å²	58.8	13%	0.127	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	96.2	-175.5	-172.1	0	0	0	0	109	Q378 Y379 K418 Y431	Q378-V416 WeakPolarHBondContact CA-O 3.19Å; Y379-V416 PolarHBondContact N-O 3.47Å; Y379-V416 WeakPolarHBondContact O-CA 3.06Å; Y379-V416 WeakPolarHBondContact O-CB 3.01Å; Y379-V416 PolarHBondContact O-N 3.17Å; V416-K418 WeakPolarHBondContact CG1-O 3.3Å; V416-K418 PolarHBondContact O-N 2.94Å; V416-Y431 HydrophobicContact CG2-CD1 4.36Å; V416-Y431 HydrophobicContact CG2-CE1 3.55Å
417	K	81.3	Confident	88.6	Confident	169 Å²	169	61.7 Å²	61.7	74%	0.735	31%	0.31	S	S	*	.	S	Bend	trans	-69.8	-9.7	-177.8	-65.4	-174.4	179.5	179.4	0	115	S415	S415-K417 PolarHBondContact O-N 2.86Å
418	K	83	Confident	88.5	Confident	145 Å²	145	59.9 Å²	59.9	63%	0.63	31%	0.313	S	S	*	.	S	Bend	trans	-134.9	123.6	-178.6	-178.3	-179.8	-179.6	-178.1	0	109.3	V416 P420	V416-K418 WeakPolarHBondContact CG1-O 3.3Å; V416-K418 PolarHBondContact O-N 2.94Å; K418-P420 WeakPolarHBondContact O-CD 3.09Å; K418-P420 VanDerWaalsContact O-N 3.09Å
419	N	87.8	Confident	88.3	Confident	23 Å²	23	60.1 Å²	60.1	12%	0.123	32%	0.315	C	S	.	.			trans	-49.7	116.7	176.3	-177.5	-16	0	0	0	111	V376 D377 F421 S422	V376-N419 PolarHBondContact O-ND2 3.13Å; D377-N419 PolarHBondContact O-N 2.93Å; N419-F421 PolarHBondContact O-N 2.62Å; N419-F421 WeakPolarHBondContact OD1-CA 3.32Å; N419-F421 WeakPolarHBondContact OD1-CB 3.15Å; N419-F421 WeakPolarHBondContact OD1-CD2 3.2Å; N419-F421 PolarHBondContact OD1-N 3.46Å; N419-S422 WeakPolarHBondContact O-CB 3.42Å; N419-S422 PolarHBondContact O-N 2.89Å; N419-S422 PolarHBondContact O-OG 3.24Å
420	P	87.6	Confident	88.2	Confident	31 Å²	31	64.1 Å²	64.1	20%	0.201	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-63.2	-23.4	-178.9	27	-35.1	0	0	0	112.6	Y379 K418 S422 A429 Y431	Y379-P420 HydrophobicContact CD2-CG 4.33Å; Y379-P420 HydrophobicContact CE2-CG 4.38Å; K418-P420 WeakPolarHBondContact O-CD 3.09Å; K418-P420 VanDerWaalsContact O-N 3.09Å; P420-S422 VanDerWaalsContact C-N 3.29Å; P420-S422 PolarHBondContact O-N 2.91Å; P420-A429 HydrophobicContact CB-CB 3.95Å; P420-A429 HydrophobicContact CG-CB 3.92Å; P420-Y431 WeakPolarHBondContact CG-OH 3.35Å
421	F	89.3	Confident	88.2	Confident	13 Å²	13	65.1 Å²	65.1	6%	0.057	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-89	11.3	177.9	-47.8	-66	0	0	0	113.3	F364 G365 R366 Y379 N419 N423 V426 A429	F364-F421 AromaticContact CD2-CE2 4Å; F364-F421 HydrophobicContact CD2-CE2 4Å; F364-F421 AromaticContact CD2-CZ 3.82Å; F364-F421 HydrophobicContact CD2-CZ 3.82Å; F364-F421 AromaticContact CE2-CE2 3.79Å; F364-F421 HydrophobicContact CE2-CE2 3.79Å; F364-F421 AromaticContact CE2-CZ 3.89Å; F364-F421 HydrophobicContact CE2-CZ 3.89Å; G365-F421 WeakPolarHBondContact O-CZ 3.45Å; R366-F421 HydrophobicContact CB-CD1 3.7Å; R366-F421 HydrophobicContact CB-CE1 3.97Å; R366-F421 HydrophobicContact CB-CG 4.13Å; R366-F421 HydrophobicContact CG-CB 4.11Å; R366-F421 HydrophobicContact CG-CD1 4.07Å; R366-F421 HydrophobicContact CG-CG 4.06Å; Y379-F421 HydrophobicContact CE2-CD2 4.25Å; Y379-F421 HydrophobicContact CE2-CE2 4.34Å; N419-F421 PolarHBondContact O-N 2.62Å; N419-F421 WeakPolarHBondContact OD1-CA 3.32Å; N419-F421 WeakPolarHBondContact OD1-CB 3.15Å; N419-F421 WeakPolarHBondContact OD1-CD2 3.2Å; N419-F421 PolarHBondContact OD1-N 3.46Å; F421-N423 PolarHBondContact O-N 2.9Å; F421-V426 HydrophobicContact CD1-CG1 4.08Å; F421-V426 HydrophobicContact CE1-CG1 4.34Å; F421-A429 HydrophobicContact CE1-CB 4.18Å; F421-A429 HydrophobicContact CZ-CB 3.94Å
422	S	86.6	Confident	88.2	Confident	74 Å²	74	69 Å²	69	52%	0.517	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-55.5	-33.9	171	-61.5	0	0	0	0	111.7	N419 P420	N419-S422 WeakPolarHBondContact O-CB 3.42Å; N419-S422 PolarHBondContact O-N 2.89Å; N419-S422 PolarHBondContact O-OG 3.24Å; P420-S422 VanDerWaalsContact C-N 3.29Å; P420-S422 PolarHBondContact O-N 2.91Å
423	N	86.3	Confident	88.3	Confident	76 Å²	76	67.9 Å²	67.9	41%	0.406	35%	0.35	S	S	.	.	S	Bend	trans	-87.4	118.9	170.4	178.9	-2.1	0	0	0	108.8	F421 K425 V426	F421-N423 PolarHBondContact O-N 2.9Å; N423-K425 PolarHBondContact O-N 3.09Å; N423-K425 WeakPolarHBondContact OD1-CB 3.35Å; N423-K425 PolarHBondContact OD1-N 2.91Å; N423-V426 HydrophobicContact CB-CG2 3.99Å; N423-V426 PolarHBondContact O-N 3.36Å
424	P	83.3	Confident	88.3	Confident	87 Å²	87	68.1 Å²	68.1	57%	0.565	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-16.4	-178.4	25.3	-34.8	0	0	0	114.1	R366 V426	R366-P424 PolarHBondContact NH1-O 3.35Å; P424-V426 VanDerWaalsContact C-N 3.32Å
425	K	87	Confident	88.2	Confident	183 Å²	183	68.3 Å²	68.3	80%	0.796	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-18.5	175.2	-62.3	-176.9	177.8	-178.3	0	113.6	N423 Q427	N423-K425 PolarHBondContact O-N 3.09Å; N423-K425 WeakPolarHBondContact OD1-CB 3.35Å; N423-K425 PolarHBondContact OD1-N 2.91Å; K425-Q427 PolarHBondContact O-N 2.97Å
426	V	89.9	Confident	88.4	Confident	44 Å²	44	70.4 Å²	70.4	27%	0.267	37%	0.37	S	S	.	.			trans	-83.7	113.2	179.2	-179.7	0	0	0	0	108.3	F421 N423 P424 S428	F421-V426 HydrophobicContact CD1-CG1 4.08Å; F421-V426 HydrophobicContact CE1-CG1 4.34Å; N423-V426 HydrophobicContact CB-CG2 3.99Å; N423-V426 PolarHBondContact O-N 3.36Å; P424-V426 VanDerWaalsContact C-N 3.32Å; V426-S428 VanDerWaalsContact CG1-O 3.26Å; V426-S428 WeakPolarHBondContact CG1-O 3.37Å
427	Q	88.8	Confident	88.7	Confident	160 Å²	160	75 Å²	75	75%	0.748	39%	0.393	S	S	*	.			trans	-97.2	-25.3	179.8	-66.4	-173.2	1.1	0	0	113.2	G365 R366 K425	G365-Q427 CarbonylContact C-O 3.54Å; G365-Q427 WeakPolarHBondContact CA-O 3.37Å; R366-Q427 PolarHBondContact N-O 3.41Å; K425-Q427 PolarHBondContact O-N 2.97Å
428	S	90.2	Very high	88.9	Confident	82 Å²	82	67 Å²	67	57%	0.573	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.7	151.9	177.4	57.9	0	0	0	0	110.3	F364 V426	F364-S428 WeakPolarHBondContact O-CA 3.46Å; V426-S428 VanDerWaalsContact CG1-O 3.26Å; V426-S428 WeakPolarHBondContact CG1-O 3.37Å
429	A	91.3	Very high	88.8	Confident	9 Å²	9	67.7 Å²	67.7	7%	0.074	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	139.8	171.7	0	0	0	0	0	108.6	S363 F364 P420 F421 Y431	S363-A429 VanDerWaalsContact CA-O 3.23Å; S363-A429 WeakPolarHBondContact CA-O 3.39Å; F364-A429 HydrophobicContact CE2-CB 4.24Å; F364-A429 HydrophobicContact CZ-CB 4.38Å; F364-A429 PolarHBondContact N-O 2.89Å; F364-A429 PolarHBondContact O-N 3.3Å; P420-A429 HydrophobicContact CB-CB 3.95Å; P420-A429 HydrophobicContact CG-CB 3.92Å; F421-A429 HydrophobicContact CE1-CB 4.18Å; F421-A429 HydrophobicContact CZ-CB 3.94Å; A429-Y431 HydrophobicContact CB-CE2 3.74Å
430	E	92	Very high	88.5	Confident	100 Å²	100	73.9 Å²	73.9	47%	0.467	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	138.5	177.9	-176.8	170.6	-143	0	0	110.1	R353 A361 V362	R353-E430 IonicContact CZ-OE1 3.18Å; R353-E430 IonicContact NE-OE1 3.67Å; R353-E430 PolarHBondContact NE-OE1 3.04Å; R353-E430 IonicContact NH2-OE1 3.85Å; R353-E430 PolarHBondContact NH2-OE1 3.45Å; R353-E430 IonicContact NH2-OE2 3.45Å; A361-E430 HydrophobicContact CB-CG 4.4Å; A361-E430 WeakPolarHBondContact CB-OE1 3.5Å; V362-E430 CarbonylContact O-C 3.46Å; V362-E430 VanDerWaalsContact O-CA 3.32Å; V362-E430 WeakPolarHBondContact O-CA 3.47Å
431	Y	93.4	Very high	87.9	Confident	31 Å²	31	76.5 Å²	76.5	12%	0.122	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	130.4	-177.1	-61.6	-87.6	0	0	0	110.6	A361 V362 F364 I381 Y414 V416 P420 A429	A361-Y431 WeakPolarHBondContact CA-O 3.29Å; V362-Y431 PolarHBondContact N-O 3.41Å; V362-Y431 PolarHBondContact O-N 3.28Å; F364-Y431 AromaticContact CE1-CD2 3.83Å; F364-Y431 HydrophobicContact CE1-CD2 3.83Å; F364-Y431 AromaticContact CE1-CE2 3.68Å; F364-Y431 HydrophobicContact CE1-CE2 3.68Å; F364-Y431 HydrophobicContact CZ-CD2 4.19Å; F364-Y431 AromaticContact CZ-CE2 3.54Å; F364-Y431 HydrophobicContact CZ-CE2 3.54Å; I381-Y431 HydrophobicContact CD1-CD1 4.25Å; I381-Y431 HydrophobicContact CD1-CD2 3.41Å; I381-Y431 VanDerWaalsContact CD1-CD2 3.41Å; I381-Y431 HydrophobicContact CD1-CE2 4.15Å; I381-Y431 HydrophobicContact CD1-CG 3.46Å; I381-Y431 VanDerWaalsContact CD1-CG 3.46Å; Y414-Y431 AromaticContact CD1-CD1 3.87Å; Y414-Y431 HydrophobicContact CD1-CD1 3.87Å; Y414-Y431 HydrophobicContact CD2-CD1 4.46Å; Y414-Y431 HydrophobicContact CE1-CD1 4.05Å; Y414-Y431 HydrophobicContact CG-CD1 4.08Å; V416-Y431 HydrophobicContact CG2-CD1 4.36Å; V416-Y431 HydrophobicContact CG2-CE1 3.55Å; P420-Y431 WeakPolarHBondContact CG-OH 3.35Å; A429-Y431 HydrophobicContact CB-CE2 3.74Å
432	L	94	Very high	87	Confident	82 Å²	82	83.5 Å²	83.5	43%	0.429	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	108.9	177.9	-64.1	175.7	0	0	0	110.3	I359 A360 A361 Y414 A435 N446	I359-L432 HydrophobicContact CG2-CB 4.35Å; I359-L432 HydrophobicContact CG2-CD2 4.42Å; A360-L432 CarbonylContact O-C 3.56Å; A361-L432 HydrophobicContact CB-CD2 3.76Å; Y414-L432 WeakPolarHBondContact CE2-O 3.26Å; Y414-L432 PolarHBondContact OH-O 3.46Å; L432-A435 HydrophobicContact CB-CB 4.23Å; L432-N446 PolarHBondContact O-ND2 3.3Å
433	I	93.7	Very high	86.6	Confident	0 Å²	0	89.8 Å²	89.8	0%	0	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	134.4	173.5	-61.2	158.7	0	0	0	108.8	F352 I359 A360 V362 I381 V383 A413 Y414 N446 L449	F352-I433 HydrophobicContact CE2-CD1 3.77Å; F352-I433 HydrophobicContact CZ-CD1 4.42Å; I359-I433 VanDerWaalsContact CA-O 3.26Å; I359-I433 WeakPolarHBondContact CA-O 3.47Å; I359-I433 WeakPolarHBondContact CG2-O 3.01Å; A360-I433 PolarHBondContact N-O 3.37Å; A360-I433 PolarHBondContact O-N 3.01Å; V362-I433 HydrophobicContact CG2-CD1 3.4Å; V362-I433 HydrophobicContact CG2-CG1 4.39Å; I381-I433 HydrophobicContact CG2-CD1 4.14Å; V383-I433 HydrophobicContact CG2-CD1 3.46Å; V383-I433 VanDerWaalsContact CG2-CD1 3.46Å; V383-I433 HydrophobicContact CG2-CG1 4.23Å; V383-I433 HydrophobicContact CG2-CG2 4.22Å; A413-I433 HydrophobicContact CB-CG1 4.09Å; A413-I433 HydrophobicContact CB-CG2 4.03Å; Y414-I433 HydrophobicContact CE2-CG1 4.49Å; I433-N446 WeakPolarHBondContact CA-OD1 3.35Å; I433-L449 HydrophobicContact CG2-CD1 4.21Å; I433-L449 HydrophobicContact CG2-CD2 3.77Å; I433-L449 HydrophobicContact CG2-CG 4.13Å
434	G	92.1	Very high	86.3	Confident	5 Å²	5	90.7 Å²	90.7	5%	0.052	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	90.9	9.3	176.4	0	0	0	0	0	116.1	N446 G447	G434-N446 PolarHBondContact N-OD1 3.29Å; G434-G447 VanDerWaalsContact CA-O 3.28Å; G434-G447 WeakPolarHBondContact CA-O 3.05Å
435	A	88.2	Confident	86.5	Confident	57 Å²	57	87 Å²	87	47%	0.471	43%	0.426	S	S	.	.			trans	-85.5	-13.3	-174.7	0	0	0	0	0	114.5	L432	L432-A435 HydrophobicContact CB-CB 4.23Å
436	E	89.6	Confident	86.7	Confident	87 Å²	87	78.3 Å²	78.3	41%	0.407	39%	0.388	S	S	.	.	S	Bend	trans	-99.4	145.7	-176.4	-60.3	177.9	173.2	0	0	112	N446 G447 P448	E436-N446 WeakPolarHBondContact CB-O 3.41Å; E436-N446 HydrophobicContact CG-CB 4.17Å; E436-N446 PolarHBondContact N-O 3.44Å; E436-N446 VanDerWaalsContact N-O 3.11Å; E436-N446 PolarHBondContact OE2-N 3.29Å; E436-G447 WeakPolarHBondContact O-CA 3.45Å; E436-P448 WeakPolarHBondContact O-CD 3.31Å
437	D	87	Confident	86.7	Confident	116 Å²	116	76.2 Å²	76.2	62%	0.62	38%	0.375	S	S	*	.			trans	-85.6	112.5	167.8	-178.4	-5.2	0	0	0	110	Y439	D437-Y439 WeakPolarHBondContact OD1-CD2 3.41Å; D437-Y439 PolarHBondContact OD1-N 3.06Å; D437-Y439 VanDerWaalsContact OD1-N 3.12Å
438	C	86.9	Confident	86.9	Confident	2 Å²	2	69.9 Å²	69.9	1%	0.014	35%	0.348	C	S	.	.			trans	-108.9	9.8	-173.3	-60.7	0	0	0	0	114.7	W399 N440 E441 C445 G447	W399-C438 HydrophobicContact CD2-CB 4.28Å; W399-C438 HydrophobicContact CE3-CB 3.52Å; W399-C438 HydrophobicContact CH2-CB 4.17Å; W399-C438 HydrophobicContact CZ3-CB 3.46Å; W399-C438 VanDerWaalsContact CZ3-CB 3.46Å; C438-N440 VanDerWaalsContact C-N 3.26Å; C438-N440 PolarHBondContact O-N 3.45Å; C438-E441 PolarHBondContact O-N 2.94Å; C438-C445 WeakPolarHBondContact CA-SG 3.47Å; C438-C445 HydrophobicContact CB-CB 3.71Å; C438-C445 WeakPolarHBondContact CB-SG 3.31Å; C438-C445 WeakPolarHBondContact SG-CB 3.36Å; C438-C445 CovalentContact SG-SG 2Å; C438-C445 PolarHBondContact SG-SG 2.95Å; C438-G447 WeakPolarHBondContact SG-CA 3.47Å; C438-G447 PolarHBondContact SG-N 2.86Å
439	Y	79.9	Confident	87.1	Confident	160 Å²	160	66.4 Å²	66.4	63%	0.627	32%	0.323	S	S	*	.	S	Bend	trans	-62.7	-33.4	-175.4	-64.6	-62.4	0	0	0	112.7	W399 D437	W399-Y439 HydrophobicContact CH2-CE1 4.42Å; D437-Y439 WeakPolarHBondContact OD1-CD2 3.41Å; D437-Y439 PolarHBondContact OD1-N 3.06Å; D437-Y439 VanDerWaalsContact OD1-N 3.12Å
440	N	81.3	Confident	87.2	Confident	153 Å²	153	68.7 Å²	68.7	82%	0.818	33%	0.331	S	S	*	.	S	Bend	trans	-103.8	-2.2	-176.5	-65.8	-34.6	0	0	0	114.7	C438	C438-N440 VanDerWaalsContact C-N 3.26Å; C438-N440 PolarHBondContact O-N 3.45Å
441	E	74.5	Confident	87.1	Confident	85 Å²	85	66.3 Å²	66.3	40%	0.397	33%	0.329	S	S	.	.			trans	-87.8	136.5	-173.1	-163	54.3	-136.9	0	0	111.5	K400 C438 R443 C445	K400-E441 WeakPolarHBondContact CD-O 3.22Å; K400-E441 PolarHBondContact NZ-O 2.92Å; C438-E441 PolarHBondContact O-N 2.94Å; E441-R443 HydrophobicContact CG-CB 4.24Å; E441-R443 WeakPolarHBondContact OE1-CB 3.42Å; E441-C445 HydrophobicContact CB-CB 4.19Å; E441-C445 HydrophobicContact CG-CB 4.13Å
442	L	71.4	Confident	86.7	Confident	160 Å²	160	73.6 Å²	73.6	84%	0.838	36%	0.364	S	S	*	.	S	Bend	trans	-96.6	-15	173.5	-73.9	170.1	0	0	0	112.4
443	R	78.3	Confident	86.6	Confident	206 Å²	206	71.5 Å²	71.5	78%	0.777	36%	0.356	S	S	*	.	S	Bend	trans	-92.5	179.2	179.9	-62.1	-178.1	174.6	-174.3	1.1	110.8	E441 C445	E441-R443 HydrophobicContact CG-CB 4.24Å; E441-R443 WeakPolarHBondContact OE1-CB 3.42Å; R443-C445 PolarHBondContact O-N 3.3Å
444	Y	80.8	Confident	86.5	Confident	95 Å²	95	77.3 Å²	77.3	37%	0.373	38%	0.383	S	S	.	.			trans	-52	131	168.2	179.8	-89.2	0	0	0	110.9	L412 A413 Y414	L412-Y444 VanDerWaalsContact C-OH 3.23Å; L412-Y444 HydrophobicContact CB-CE2 3.78Å; L412-Y444 HydrophobicContact CD2-CD2 4.29Å; L412-Y444 HydrophobicContact CD2-CE2 3.64Å; L412-Y444 HydrophobicContact CG-CE2 3.56Å; L412-Y444 WeakPolarHBondContact O-CE2 3.23Å; L412-Y444 PolarHBondContact O-OH 3.43Å; L412-Y444 VanDerWaalsContact O-OH 3.07Å; A413-Y444 VanDerWaalsContact CA-OH 3.28Å; A413-Y444 WeakPolarHBondContact CA-OH 3.41Å; A413-Y444 PolarHBondContact N-OH 3.45Å; A413-Y444 PolarHBondContact O-OH 3.43Å; Y414-Y444 WeakPolarHBondContact CA-OH 3.28Å; Y414-Y444 PolarHBondContact N-OH 2.92Å
445	C	86.3	Confident	86.6	Confident	11 Å²	11	77.2 Å²	77.2	7%	0.074	38%	0.381	C	S	.	.			trans	-152.6	138.1	-174.2	-167.1	0	0	0	0	110.5	W399 C438 E441 R443 G447	W399-C445 VanDerWaalsContact CB-O 3.24Å; W399-C445 WeakPolarHBondContact CB-O 3.24Å; C438-C445 WeakPolarHBondContact CA-SG 3.47Å; C438-C445 HydrophobicContact CB-CB 3.71Å; C438-C445 WeakPolarHBondContact CB-SG 3.31Å; C438-C445 WeakPolarHBondContact SG-CB 3.36Å; C438-C445 CovalentContact SG-SG 2Å; C438-C445 PolarHBondContact SG-SG 2.95Å; E441-C445 HydrophobicContact CB-CB 4.19Å; E441-C445 HydrophobicContact CG-CB 4.13Å; R443-C445 PolarHBondContact O-N 3.3Å; C445-G447 PolarHBondContact O-N 2.83Å
446	N	90.5	Very high	87	Confident	0 Å²	0	76 Å²	76	0%	0	37%	0.365	C	S	.	.			trans	-93.5	67.9	-177.5	173.8	37.6	0	0	0	111.1	A413 Y414 L432 I433 G434 E436	A413-N446 WeakPolarHBondContact O-CB 3.46Å; Y414-N446 VanDerWaalsContact CE2-ND2 3.25Å; Y414-N446 WeakPolarHBondContact CE2-ND2 3.39Å; Y414-N446 VanDerWaalsContact CZ-ND2 3.35Å; Y414-N446 PolarHBondContact OH-ND2 3.4Å; Y414-N446 VanDerWaalsContact OH-ND2 3.14Å; L432-N446 PolarHBondContact O-ND2 3.3Å; I433-N446 WeakPolarHBondContact CA-OD1 3.35Å; G434-N446 PolarHBondContact N-OD1 3.29Å; E436-N446 WeakPolarHBondContact CB-O 3.41Å; E436-N446 HydrophobicContact CG-CB 4.17Å; E436-N446 PolarHBondContact N-O 3.44Å; E436-N446 VanDerWaalsContact N-O 3.11Å; E436-N446 PolarHBondContact OE2-N 3.29Å
447	G	91.5	Very high	87.2	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-76.5	165.9	-171.2	0	0	0	0	0	114.6	W399 G434 E436 C438 C445	W399-G447 PolarHBondContact NE1-O 2.83Å; W399-G447 VanDerWaalsContact NE1-O 3.12Å; G434-G447 VanDerWaalsContact CA-O 3.28Å; G434-G447 WeakPolarHBondContact CA-O 3.05Å; E436-G447 WeakPolarHBondContact O-CA 3.45Å; C438-G447 WeakPolarHBondContact SG-CA 3.47Å; C438-G447 PolarHBondContact SG-N 2.86Å; C445-G447 PolarHBondContact O-N 2.83Å
448	P	93.2	Very high	87.5	Confident	26 Å²	26	66.4 Å²	66.4	17%	0.169	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-58.8	145.6	-172.4	24.8	-35.2	0	0	0	112.6	W399 W408 E436	W399-P448 HydrophobicContact CZ2-CG 3.96Å; W399-P448 PolarHBondContact NE1-O 2.89Å; W408-P448 WeakPolarHBondContact CH2-O 3.34Å; E436-P448 WeakPolarHBondContact O-CD 3.31Å
449	L	93.8	Very high	87.8	Confident	10 Å²	10	66.3 Å²	66.3	5%	0.052	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-75.1	155.7	170.9	-59.4	178.2	0	0	0	110.6	T358 A360 V383 Y411 I433 A451 Y455	T358-L449 WeakPolarHBondContact CB-O 3.42Å; T358-L449 WeakPolarHBondContact CG2-O 3.46Å; T358-L449 VanDerWaalsContact O-CB 3.3Å; T358-L449 WeakPolarHBondContact O-CB 3.29Å; T358-L449 WeakPolarHBondContact O-CG 3.34Å; T358-L449 PolarHBondContact O-N 2.95Å; A360-L449 HydrophobicContact CB-CD1 3.76Å; V383-L449 HydrophobicContact CG1-CD2 4.36Å; Y411-L449 WeakPolarHBondContact OH-CD2 3.08Å; I433-L449 HydrophobicContact CG2-CD1 4.21Å; I433-L449 HydrophobicContact CG2-CD2 3.77Å; I433-L449 HydrophobicContact CG2-CG 4.13Å; L449-A451 PolarHBondContact O-N 3.28Å; L449-Y455 HydrophobicContact CB-CD2 4.4Å; L449-Y455 HydrophobicContact CB-CE2 3.73Å; L449-Y455 HydrophobicContact CD1-CD2 4.17Å; L449-Y455 HydrophobicContact CD1-CE2 4.33Å; L449-Y455 HydrophobicContact CD2-CD1 4.25Å; L449-Y455 HydrophobicContact CD2-CD2 4.47Å; L449-Y455 HydrophobicContact CD2-CE1 3.93Å; L449-Y455 HydrophobicContact CD2-CE2 4.17Å; L449-Y455 HydrophobicContact CG-CE2 4.3Å
450	K	92.5	Very high	88.4	Confident	57 Å²	57	59.3 Å²	59.3	25%	0.248	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-67.7	131.1	168.6	-63.2	-172.8	-170.3	128.5	0	109.3	E385 A406 W408 S453 Y455	E385-K450 VanDerWaalsContact CD-NZ 3.31Å; E385-K450 VanDerWaalsContact OE1-CD 3.32Å; E385-K450 WeakPolarHBondContact OE1-CD 3.49Å; E385-K450 WeakPolarHBondContact OE1-CE 3.07Å; E385-K450 IonicContact OE1-NZ 2.79Å; E385-K450 PolarHBondContact OE1-NZ 3.05Å; E385-K450 IonicContact OE2-NZ 3Å; E385-K450 PolarHBondContact OE2-NZ 2.84Å; A406-K450 PolarHBondContact O-NZ 3.19Å; W408-K450 HydrophobicContact CH2-CG 3.78Å; W408-K450 HydrophobicContact CZ2-CD 4.18Å; W408-K450 HydrophobicContact CZ2-CG 3.58Å; W408-K450 HydrophobicContact CZ3-CG 4.41Å; K450-S453 WeakPolarHBondContact CB-OG 3.22Å; K450-Y455 WeakPolarHBondContact CB-OH 3.38Å; K450-Y455 PolarHBondContact N-OH 3.31Å
451	A	89.6	Confident	88.9	Confident	50 Å²	50	52 Å²	52	41%	0.413	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	144.1	172.6	0	0	0	0	0	110.8	L449 S453	L449-A451 PolarHBondContact O-N 3.28Å; A451-S453 PolarHBondContact O-N 2.62Å
452	E	85.8	Confident	89.8	Confident	183 Å²	183	48.3 Å²	48.3	86%	0.855	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.9	9.9	174	-53.6	-175.3	161.2	0	0	115.9
453	S	91	Very high	90.9	Very high	38 Å²	38	41 Å²	41	27%	0.266	20%	0.195	S	C	.	.			trans	-87.8	142.7	174.4	-62.8	0	0	0	0	110.9	K450 A451 Y455	K450-S453 WeakPolarHBondContact CB-OG 3.22Å; A451-S453 PolarHBondContact O-N 2.62Å; S453-Y455 WeakPolarHBondContact O-CD2 2.99Å
454	Q	92.3	Very high	91.4	Very high	123 Å²	123	36.6 Å²	36.6	58%	0.575	19%	0.191	S	C	*	.			trans	-79.2	128.2	171.4	-174.8	173.9	-15.8	0	0	109.3	E385 F456	E385-Q454 WeakPolarHBondContact CA-O 3.38Å; Q454-F456 HydrophobicContact CG-CE2 4.22Å; Q454-F456 HydrophobicContact CG-CZ 4.28Å; Q454-F456 VanDerWaalsContact NE2-CZ 3.32Å
455	Y	95.2	Very high	91.9	Very high	3 Å²	3	35.4 Å²	35.4	1%	0.012	20%	0.201	C	C	.	.			trans	-116.2	155.3	178.2	-75.5	-82.2	0	0	0	111.2	V383 T384 E385 W408 L449 K450 S453 L476	V383-Y455 HydrophobicContact CG1-CD1 3.62Å; V383-Y455 HydrophobicContact CG1-CE1 4.34Å; V383-Y455 HydrophobicContact CG1-CG 4.29Å; T384-Y455 CarbonylContact O-C 3.52Å; T384-Y455 WeakPolarHBondContact O-CA 3.38Å; T384-Y455 WeakPolarHBondContact O-CD1 3.39Å; E385-Y455 HydrophobicContact CB-CE1 4.43Å; E385-Y455 HydrophobicContact CG-CD1 3.75Å; E385-Y455 HydrophobicContact CG-CE1 3.21Å; E385-Y455 HydrophobicContact CG-CE2 4.43Å; E385-Y455 PolarHBondContact OE1-OH 2.84Å; W408-Y455 AromaticContact CE3-CE1 3.95Å; W408-Y455 HydrophobicContact CE3-CE1 3.95Å; W408-Y455 HydrophobicContact CZ3-CE1 4.38Å; W408-Y455 WeakPolarHBondContact CZ3-OH 3.48Å; L449-Y455 HydrophobicContact CB-CD2 4.4Å; L449-Y455 HydrophobicContact CB-CE2 3.73Å; L449-Y455 HydrophobicContact CD1-CD2 4.17Å; L449-Y455 HydrophobicContact CD1-CE2 4.33Å; L449-Y455 HydrophobicContact CD2-CD1 4.25Å; L449-Y455 HydrophobicContact CD2-CD2 4.47Å; L449-Y455 HydrophobicContact CD2-CE1 3.93Å; L449-Y455 HydrophobicContact CD2-CE2 4.17Å; L449-Y455 HydrophobicContact CG-CE2 4.3Å; K450-Y455 WeakPolarHBondContact CB-OH 3.38Å; K450-Y455 PolarHBondContact N-OH 3.31Å; S453-Y455 WeakPolarHBondContact O-CD2 2.99Å; Y455-L476 WeakPolarHBondContact O-CB 2.95Å; Y455-L476 PolarHBondContact O-N 3.21Å
456	F	95.1	Very high	92	Very high	31 Å²	31	39.1 Å²	39.1	14%	0.136	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	141.4	170.6	-55.7	-97.7	0	0	0	109.3	V383 T384 Q454 Y473 I474 P475	V383-F456 CarbonylContact C-O 3.56Å; V383-F456 WeakPolarHBondContact CA-O 3.43Å; T384-F456 HydrophobicContact CG2-CB 3.95Å; T384-F456 HydrophobicContact CG2-CD2 4.5Å; T384-F456 PolarHBondContact N-O 2.72Å; T384-F456 PolarHBondContact O-N 3.38Å; Q454-F456 HydrophobicContact CG-CE2 4.22Å; Q454-F456 HydrophobicContact CG-CZ 4.28Å; Q454-F456 VanDerWaalsContact NE2-CZ 3.32Å; F456-Y473 HydrophobicContact CB-CD1 3.74Å; F456-Y473 HydrophobicContact CB-CG 4.22Å; F456-I474 CarbonylContact C-O 3.56Å; F456-I474 VanDerWaalsContact CA-O 3.27Å; F456-I474 WeakPolarHBondContact CA-O 3.49Å; F456-P475 HydrophobicContact CD1-CB 3.93Å; F456-P475 HydrophobicContact CE1-CB 3.85Å
457	V	94.8	Very high	92.1	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	144.9	175.8	72.5	0	0	0	0	110.8	V350 F352 V362 I381 I382 V383 Y473 I474	V350-V457 HydrophobicContact CG1-CG1 4.46Å; F352-V457 HydrophobicContact CB-CG1 3.54Å; F352-V457 HydrophobicContact CD1-CB 3.84Å; F352-V457 HydrophobicContact CD1-CG1 3.54Å; F352-V457 HydrophobicContact CD2-CB 4.26Å; F352-V457 HydrophobicContact CD2-CG1 3.98Å; F352-V457 HydrophobicContact CE1-CB 3.94Å; F352-V457 HydrophobicContact CE1-CG1 4.18Å; F352-V457 HydrophobicContact CE2-CB 4.32Å; F352-V457 HydrophobicContact CG-CB 4Å; F352-V457 HydrophobicContact CG-CG1 3.42Å; F352-V457 VanDerWaalsContact CG-CG1 3.42Å; F352-V457 HydrophobicContact CZ-CB 4.19Å; V362-V457 HydrophobicContact CG1-CG2 4.46Å; V362-V457 HydrophobicContact CG2-CB 4.3Å; V362-V457 HydrophobicContact CG2-CG1 4.18Å; V362-V457 HydrophobicContact CG2-CG2 3.84Å; I381-V457 HydrophobicContact CG2-CG2 3.55Å; I382-V457 CarbonylContact O-C 3.54Å; I382-V457 WeakPolarHBondContact O-CA 3.3Å; I382-V457 WeakPolarHBondContact O-CG2 3.17Å; V383-V457 HydrophobicContact CG2-CG2 4.19Å; V457-Y473 CarbonylContact O-C 3.56Å; V457-Y473 WeakPolarHBondContact O-CA 3.42Å; V457-I474 HydrophobicContact CG1-CB 4.1Å; V457-I474 HydrophobicContact CG1-CD1 4.4Å; V457-I474 PolarHBondContact N-O 3.4Å; V457-I474 PolarHBondContact O-N 3.22Å
458	K	92.5	Very high	92.2	Very high	1 Å²	1	40.4 Å²	40.4	0%	0.004	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	148.5	160.1	66.3	177.2	-179.5	176.4	0	109.9	I382 D390 E470 T471 Y473	I382-K458 HydrophobicContact CB-CG 3.81Å; I382-K458 HydrophobicContact CD1-CG 4.24Å; I382-K458 HydrophobicContact CG2-CG 4.31Å; I382-K458 PolarHBondContact N-O 3.2Å; I382-K458 PolarHBondContact O-N 2.99Å; D390-K458 IonicContact OD1-NZ 3Å; D390-K458 IonicContact OD2-NZ 3.17Å; D390-K458 PolarHBondContact OD2-NZ 3Å; K458-E470 IonicContact NZ-OE1 3.62Å; K458-E470 IonicContact NZ-OE2 2.72Å; K458-E470 PolarHBondContact NZ-OE2 3.36Å; K458-T471 WeakPolarHBondContact CA-OG1 3.21Å; K458-T471 WeakPolarHBondContact CB-OG1 3.34Å; K458-Y473 HydrophobicContact CB-CD1 4.09Å; K458-Y473 HydrophobicContact CB-CE1 4.14Å; K458-Y473 HydrophobicContact CD-CD1 4.47Å; K458-Y473 HydrophobicContact CD-CE1 3.86Å; K458-Y473 HydrophobicContact CD-CE2 4.08Å; K458-Y473 VanDerWaalsContact CE-OH 3.32Å; K458-Y473 WeakPolarHBondContact CE-OH 3.3Å; K458-Y473 HydrophobicContact CG-CD1 4.26Å; K458-Y473 HydrophobicContact CG-CE1 3.79Å
459	V	93.5	Very high	92.2	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	136.5	175.1	-177.4	0	0	0	0	108	V350 V362 F364 F369 Y379 T471	V350-V459 HydrophobicContact CG1-CG2 4.2Å; V350-V459 HydrophobicContact CG2-CG2 3.96Å; V362-V459 HydrophobicContact CG1-CG2 4.25Å; F364-V459 HydrophobicContact CD1-CG1 4.47Å; F364-V459 HydrophobicContact CD1-CG2 4.15Å; F364-V459 HydrophobicContact CE1-CG1 4.2Å; F364-V459 HydrophobicContact CE1-CG2 4.32Å; F364-V459 HydrophobicContact CZ-CG1 4.37Å; F369-V459 HydrophobicContact CE2-CG1 4.23Å; Y379-V459 HydrophobicContact CD1-CG1 4.05Å; V459-T471 HydrophobicContact CB-CG2 4.04Å; V459-T471 PolarHBondContact N-OG1 2.82Å; V459-T471 WeakPolarHBondContact O-CG2 3.21Å; V459-T471 PolarHBondContact O-N 2.82Å
460	Q	92.6	Very high	92.1	Very high	13 Å²	13	38.8 Å²	38.8	6%	0.061	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	127.3	174.5	-178.8	-172.9	62.7	0	0	109	Y379 Y380 I382 C468 M469 E470	Y379-Q460 CarbonylContact C-O 3.57Å; Y379-Q460 VanDerWaalsContact CA-O 3.31Å; Y379-Q460 WeakPolarHBondContact CA-O 3.38Å; Y380-Q460 PolarHBondContact N-O 2.85Å; Y380-Q460 PolarHBondContact O-N 2.79Å; I382-Q460 HydrophobicContact CD1-CB 3.74Å; Q460-C468 HydrophobicContact CG-CB 4.01Å; Q460-M469 CarbonylContact C-O 3.52Å; Q460-M469 VanDerWaalsContact CA-O 3.22Å; Q460-M469 WeakPolarHBondContact CA-O 3.22Å; Q460-E470 HydrophobicContact CB-CG 3.81Å; Q460-E470 HydrophobicContact CG-CG 3.65Å; Q460-E470 PolarHBondContact NE2-OE1 2.91Å
461	G	92.7	Very high	92.1	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	125	175.8	0	0	0	0	0	110	Q378 C468 M469	Q378-G461 CarbonylContact O-C 3.59Å; Q378-G461 WeakPolarHBondContact O-CA 3.15Å; G461-C468 CarbonylContact O-C 3.53Å; G461-C468 VanDerWaalsContact O-CA 3.29Å; G461-C468 WeakPolarHBondContact O-CA 3.37Å; G461-M469 PolarHBondContact N-O 2.85Å; G461-M469 PolarHBondContact O-N 3.47Å
462	C	93.2	Very high	92	Very high	7 Å²	7	35.8 Å²	35.8	5%	0.047	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	137	-178.9	-59.6	0	0	0	0	111.8	D377 Q378 Y380 I467 C468	D377-C462 PolarHBondContact N-O 2.85Å; Q378-C462 PolarHBondContact N-O 2.72Å; Q378-C462 PolarHBondContact O-N 3.32Å; Y380-C462 HydrophobicContact CE2-CB 4.37Å; C462-I467 WeakPolarHBondContact CA-O 3.49Å; C462-C468 HydrophobicContact CB-CB 4.16Å; C462-C468 WeakPolarHBondContact CB-SG 3.47Å; C462-C468 WeakPolarHBondContact SG-CB 3.29Å; C462-C468 CovalentContact SG-SG 2.05Å; C462-C468 PolarHBondContact SG-SG 2.83Å
463	T	93.1	Very high	92.3	Very high	6 Å²	6	29.1 Å²	29.1	4%	0.037	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	166.6	172.7	72.9	0	0	0	0	111.1	N373 G374 A465 M466 I467 M469	N373-T463 WeakPolarHBondContact O-CG2 3.33Å; G374-T463 VanDerWaalsContact O-CG2 3.32Å; G374-T463 WeakPolarHBondContact O-CG2 3.28Å; T463-A465 PolarHBondContact O-N 2.99Å; T463-A465 PolarHBondContact OG1-N 2.83Å; T463-M466 PolarHBondContact O-N 3.36Å; T463-I467 PolarHBondContact N-O 3.45Å; T463-I467 PolarHBondContact OG1-N 2.97Å; T463-I467 PolarHBondContact OG1-O 3.03Å; T463-M469 HydrophobicContact CG2-CE 4.44Å
464	V	90.1	Very high	92.4	Very high	115 Å²	115	28.3 Å²	28.3	70%	0.697	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-28.6	175.2	-178.7	0	0	0	0	111.9	D377 M466	D377-V464 HydrophobicContact CB-CG2 3.87Å; V464-M466 PolarHBondContact O-N 2.71Å
465	A	89.8	Confident	92.5	Very high	70 Å²	70	25.3 Å²	25.3	58%	0.579	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.2	7.4	176.6	0	0	0	0	0	113.7	T463 I467	T463-A465 PolarHBondContact O-N 2.99Å; T463-A465 PolarHBondContact OG1-N 2.83Å; A465-I467 PolarHBondContact O-N 2.92Å
466	M	89.4	Confident	92.3	Very high	88 Å²	88	26.9 Å²	26.9	43%	0.433	17%	0.165	S	C	.	.	S	Bend	trans	61.3	29	-178.2	-57.6	-76.9	166	0	0	113.8	R261 I262 T463 V464	R261-M466 HydrophobicContact CG-CB 4.06Å; I262-M466 PolarHBondContact N-O 2.78Å; T463-M466 PolarHBondContact O-N 3.36Å; V464-M466 PolarHBondContact O-N 2.71Å
467	I	93.5	Very high	92	Very high	13 Å²	13	29 Å²	29	7%	0.067	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	110.1	163.8	-56.4	171.3	0	0	0	106.6	I337 V339 N373 C462 T463 A465	I337-I467 HydrophobicContact CD1-CD1 3.97Å; I337-I467 HydrophobicContact CD1-CG1 3.81Å; I337-I467 HydrophobicContact CG1-CD1 4.35Å; V339-I467 HydrophobicContact CG2-CG2 3.69Å; N373-I467 HydrophobicContact CB-CG2 3.91Å; C462-I467 WeakPolarHBondContact CA-O 3.49Å; T463-I467 PolarHBondContact N-O 3.45Å; T463-I467 PolarHBondContact OG1-N 2.97Å; T463-I467 PolarHBondContact OG1-O 3.03Å; A465-I467 PolarHBondContact O-N 2.92Å
468	C	93.1	Very high	91.1	Very high	15 Å²	15	32.4 Å²	32.4	10%	0.101	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	143.8	176.6	-61.7	0	0	0	0	109.8	I262 V263 S264 Q460 G461 C462	I262-C468 PolarHBondContact O-N 2.69Å; V263-C468 CarbonylContact C-O 3.55Å; V263-C468 WeakPolarHBondContact CA-O 3.27Å; V263-C468 HydrophobicContact CG1-CB 4.44Å; V263-C468 HydrophobicContact CG2-CB 4.15Å; S264-C468 PolarHBondContact N-O 2.81Å; Q460-C468 HydrophobicContact CG-CB 4.01Å; G461-C468 CarbonylContact O-C 3.53Å; G461-C468 VanDerWaalsContact O-CA 3.29Å; G461-C468 WeakPolarHBondContact O-CA 3.37Å; C462-C468 HydrophobicContact CB-CB 4.16Å; C462-C468 WeakPolarHBondContact CB-SG 3.47Å; C462-C468 WeakPolarHBondContact SG-CB 3.29Å; C462-C468 CovalentContact SG-SG 2.05Å; C462-C468 PolarHBondContact SG-SG 2.83Å
469	M	93.3	Very high	89.5	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	133.1	173.8	-70.1	171	-77.3	0	0	107.7	S264 I342 F369 P370 N373 V376 Q460 G461 T463	S264-M469 CarbonylContact O-C 3.56Å; S264-M469 WeakPolarHBondContact O-CA 3.47Å; I342-M469 HydrophobicContact CG2-CB 3.8Å; I342-M469 HydrophobicContact CG2-CG 3.75Å; I342-M469 HydrophobicContact CG2-SD 3.99Å; F369-M469 HydrophobicContact CB-CE 3.76Å; F369-M469 HydrophobicContact CB-SD 4.1Å; F369-M469 HydrophobicContact CD1-CB 3.44Å; F369-M469 VanDerWaalsContact CD1-CB 3.44Å; F369-M469 HydrophobicContact CD1-CG 4.38Å; F369-M469 HydrophobicContact CD1-SD 4.19Å; F369-M469 HydrophobicContact CE1-CB 3.5Å; F369-M469 HydrophobicContact CG-CB 4.04Å; F369-M469 HydrophobicContact CG-CE 4.2Å; F369-M469 HydrophobicContact CG-SD 4.38Å; F369-M469 HydrophobicContact CZ-CB 4.15Å; F369-M469 WeakPolarHBondContact CZ-O 3.42Å; P370-M469 HydrophobicContact CG-SD 4.49Å; N373-M469 HydrophobicContact CB-CE 4.23Å; N373-M469 HydrophobicContact CB-SD 4.08Å; N373-M469 PolarHBondContact ND2-SD 3.3Å; N373-M469 VanDerWaalsContact ND2-SD 3.43Å; V376-M469 HydrophobicContact CG2-CE 3.63Å; Q460-M469 CarbonylContact C-O 3.52Å; Q460-M469 VanDerWaalsContact CA-O 3.22Å; Q460-M469 WeakPolarHBondContact CA-O 3.22Å; G461-M469 PolarHBondContact N-O 2.85Å; G461-M469 PolarHBondContact O-N 3.47Å; T463-M469 HydrophobicContact CG2-CE 4.44Å
470	E	91.1	Very high	87.2	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	136.1	-177.8	-85.1	-172.2	-168.3	0	0	111.7	V263 S264 R265 I342 F392 K458 Q460	V263-E470 HydrophobicContact CG1-CB 4.02Å; V263-E470 VanDerWaalsContact CG1-CD 3.42Å; V263-E470 HydrophobicContact CG1-CG 3.49Å; V263-E470 VanDerWaalsContact CG1-CG 3.49Å; V263-E470 WeakPolarHBondContact CG1-OE1 3.44Å; S264-E470 PolarHBondContact O-N 2.68Å; R265-E470 HydrophobicContact CG-CB 4Å; R265-E470 IonicContact CZ-OE2 2.72Å; R265-E470 IonicContact NE-OE2 3.48Å; R265-E470 PolarHBondContact NE-OE2 3.31Å; R265-E470 IonicContact NH2-OE2 3.39Å; R265-E470 PolarHBondContact NH2-OE2 3.21Å; I342-E470 WeakPolarHBondContact CD1-O 3.42Å; F392-E470 WeakPolarHBondContact CE2-OE2 3.45Å; K458-E470 IonicContact NZ-OE1 3.62Å; K458-E470 IonicContact NZ-OE2 2.72Å; K458-E470 PolarHBondContact NZ-OE2 3.36Å; Q460-E470 HydrophobicContact CB-CG 3.81Å; Q460-E470 HydrophobicContact CG-CG 3.65Å; Q460-E470 PolarHBondContact NE2-OE1 2.91Å
471	T	91.6	Very high	84.4	Confident	2 Å²	2	50.3 Å²	50.3	1%	0.012	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-73.2	164.2	168.3	71.2	0	0	0	0	111.3	V346 F368 F369 K458 V459	V346-T471 HydrophobicContact CG1-CG2 4.25Å; F368-T471 HydrophobicContact CE1-CG2 3.27Å; F368-T471 HydrophobicContact CE2-CG2 4.48Å; F368-T471 HydrophobicContact CZ-CG2 3.17Å; F369-T471 HydrophobicContact CE1-CG2 4.26Å; F369-T471 HydrophobicContact CZ-CG2 3.98Å; K458-T471 WeakPolarHBondContact CA-OG1 3.21Å; K458-T471 WeakPolarHBondContact CB-OG1 3.34Å; V459-T471 HydrophobicContact CB-CG2 4.04Å; V459-T471 PolarHBondContact N-OG1 2.82Å; V459-T471 WeakPolarHBondContact O-CG2 3.21Å; V459-T471 PolarHBondContact O-N 2.82Å
472	G	89.4	Confident	81.5	Confident	43 Å²	43	57.1 Å²	57.1	44%	0.443	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-64.2	167.5	156.9	0	0	0	0	0	111.5
473	Y	91.8	Very high	78.4	Confident	42 Å²	42	61.9 Å²	61.9	17%	0.165	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-71.5	131.2	170.9	-80	-71.5	0	0	0	110.5	T384 E387 D390 P410 F456 V457 K458	T384-Y473 HydrophobicContact CG2-CD1 3.94Å; T384-Y473 HydrophobicContact CG2-CE1 3.48Å; T384-Y473 VanDerWaalsContact CG2-CE1 3.48Å; E387-Y473 HydrophobicContact CB-CD2 3.73Å; E387-Y473 HydrophobicContact CB-CE2 4.17Å; E387-Y473 HydrophobicContact CB-CG 4.04Å; D390-Y473 HydrophobicContact CB-CE2 3.85Å; D390-Y473 WeakPolarHBondContact CB-OH 3.04Å; D390-Y473 VanDerWaalsContact CG-OH 3.31Å; D390-Y473 PolarHBondContact OD2-OH 2.83Å; P410-Y473 VanDerWaalsContact CG-OH 3.23Å; P410-Y473 WeakPolarHBondContact CG-OH 3.41Å; F456-Y473 HydrophobicContact CB-CD1 3.74Å; F456-Y473 HydrophobicContact CB-CG 4.22Å; V457-Y473 CarbonylContact O-C 3.56Å; V457-Y473 WeakPolarHBondContact O-CA 3.42Å; K458-Y473 HydrophobicContact CB-CD1 4.09Å; K458-Y473 HydrophobicContact CB-CE1 4.14Å; K458-Y473 HydrophobicContact CD-CD1 4.47Å; K458-Y473 HydrophobicContact CD-CE1 3.86Å; K458-Y473 HydrophobicContact CD-CE2 4.08Å; K458-Y473 VanDerWaalsContact CE-OH 3.32Å; K458-Y473 WeakPolarHBondContact CE-OH 3.3Å; K458-Y473 HydrophobicContact CG-CD1 4.26Å; K458-Y473 HydrophobicContact CG-CE1 3.79Å
474	I	93	Very high	75.5	Confident	22 Å²	22	68.7 Å²	68.7	11%	0.113	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	124.6	175.5	-59.8	115.1	0	0	0	107.8	A347 V350 F352 F456 V457	A347-I474 HydrophobicContact CB-CG1 4.43Å; V350-I474 HydrophobicContact CB-CD1 3.71Å; V350-I474 HydrophobicContact CG1-CD1 3.8Å; V350-I474 HydrophobicContact CG2-CD1 4.32Å; F352-I474 HydrophobicContact CB-CG2 4.14Å; F352-I474 WeakPolarHBondContact CD1-O 3.44Å; F456-I474 CarbonylContact C-O 3.56Å; F456-I474 VanDerWaalsContact CA-O 3.27Å; F456-I474 WeakPolarHBondContact CA-O 3.49Å; V457-I474 HydrophobicContact CG1-CB 4.1Å; V457-I474 HydrophobicContact CG1-CD1 4.4Å; V457-I474 PolarHBondContact N-O 3.4Å; V457-I474 PolarHBondContact O-N 3.22Å
475	P	93.5	Very high	72.7	Confident	60 Å²	60	68.2 Å²	68.2	39%	0.39	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	149.1	178.4	29.5	-34.6	0	0	0	111.6	F456 T477	F456-P475 HydrophobicContact CD1-CB 3.93Å; F456-P475 HydrophobicContact CE1-CB 3.85Å; P475-T477 PolarHBondContact O-N 3.47Å
476	L	91.7	Very high	70.3	Confident	35 Å²	35	70 Å²	70	18%	0.183	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-65.8	119.1	172.3	-176.8	65.1	0	0	0	109.6	F352 K354 A360 Y455	F352-L476 HydrophobicContact CD1-CB 3.78Å; F352-L476 HydrophobicContact CD1-CD1 3.94Å; F352-L476 HydrophobicContact CD2-CD1 3.86Å; F352-L476 HydrophobicContact CE1-CB 3.54Å; F352-L476 HydrophobicContact CE1-CD1 3.8Å; F352-L476 HydrophobicContact CE1-CG 4.23Å; F352-L476 HydrophobicContact CE2-CD1 3.73Å; F352-L476 HydrophobicContact CG-CD1 3.98Å; F352-L476 HydrophobicContact CZ-CB 4.18Å; F352-L476 HydrophobicContact CZ-CD1 3.69Å; F352-L476 HydrophobicContact CZ-CG 4.43Å; K354-L476 HydrophobicContact CB-CD1 4.27Å; K354-L476 HydrophobicContact CB-CD2 4.43Å; K354-L476 HydrophobicContact CB-CG 4.39Å; A360-L476 HydrophobicContact CB-CD1 3.67Å; Y455-L476 WeakPolarHBondContact O-CB 2.95Å; Y455-L476 PolarHBondContact O-N 3.21Å
477	T	88	Confident	67.7	Low	77 Å²	77	73.7 Å²	73.7	47%	0.472	42%	0.421	S	S	.	.	B	Isolated β-bridge	trans	-90.6	128.3	172.9	59.2	0	0	0	0	109.7	F352 K354 P475	F352-T477 PolarHBondContact O-N 3.37Å; F352-T477 PolarHBondContact O-OG1 3.33Å; F352-T477 VanDerWaalsContact O-OG1 3.06Å; K354-T477 PolarHBondContact N-O 3.22Å; P475-T477 PolarHBondContact O-N 3.47Å
478	S	76.1	Confident	64.8	Low	71 Å²	71	80.7 Å²	80.7	50%	0.497	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-63.6	141.9	155.4	39.3	0	0	0	0	107.6	D480	S478-D480 PolarHBondContact O-N 2.88Å; S478-D480 PolarHBondContact OG-OD1 2.84Å
479	E	59.9	Low	61.9	Low	143 Å²	143	89.3 Å²	89.3	67%	0.668	49%	0.494	S	S	*	.			trans	-60.6	93.4	155.4	-78.3	-174.5	177.9	0	0	105.5	R353 V481	R353-E479 IonicContact NH1-OE1 2.77Å; E479-V481 PolarHBondContact O-N 3.33Å
480	D	43.5	Very low	58.9	Low	131 Å²	131	96.9 Å²	96.9	70%	0.701	54%	0.535	S	S	*	.			trans	-57.9	107.1	153.2	-72.7	-18.6	0	0	0	103	S478 I482	S478-D480 PolarHBondContact O-N 2.88Å; S478-D480 PolarHBondContact OG-OD1 2.84Å; D480-I482 PolarHBondContact O-N 2.59Å
481	V	34.5	Very low	56.1	Low	116 Å²	116	106.1 Å²	106.1	70%	0.703	58%	0.575	S	S	*	*			trans	-31.6	115	157.2	173.6	0	0	0	0	104.6	E479 V483	E479-V481 PolarHBondContact O-N 3.33Å; V481-V483 HydrophobicContact CG1-CG2 4.39Å; V481-V483 PolarHBondContact O-N 3.23Å
482	I	31	Very low	53.2	Low	142 Å²	142	108.8 Å²	108.8	73%	0.728	60%	0.603	S	S	*	*			trans	-59.4	91.1	165.9	-61.7	171.7	0	0	0	102.7	D480 L484	D480-I482 PolarHBondContact O-N 2.59Å; I482-L484 HydrophobicContact CG2-CD2 3.91Å; I482-L484 HydrophobicContact CG2-CG 4.08Å; I482-L484 PolarHBondContact O-N 2.84Å
483	V	30.1	Very low	50.9	Low	107 Å²	107	112.7 Å²	112.7	65%	0.648	62%	0.621	S	S	*	*			trans	-62.5	94.7	157.3	178.3	0	0	0	0	99.9	V481 T485	V481-V483 HydrophobicContact CG1-CG2 4.39Å; V481-V483 PolarHBondContact O-N 3.23Å; V483-T485 HydrophobicContact CG1-CG2 4.3Å; V483-T485 PolarHBondContact O-N 2.9Å
484	L	30.7	Very low	48.1	Very low	150 Å²	150	121.6 Å²	121.6	79%	0.785	66%	0.656	S	S	*	*			trans	-55.2	89	160.9	-70.4	166.9	0	0	0	103.3	I482 S486	I482-L484 HydrophobicContact CG2-CD2 3.91Å; I482-L484 HydrophobicContact CG2-CG 4.08Å; I482-L484 PolarHBondContact O-N 2.84Å; L484-S486 PolarHBondContact O-N 3.45Å
485	T	31.8	Very low	45	Very low	104 Å²	104	125.9 Å²	125.9	64%	0.638	69%	0.687	S	S	*	*			trans	-55.7	118.3	167.3	46.5	0	0	0	0	103.6	V483 E487	V483-T485 HydrophobicContact CG1-CG2 4.3Å; V483-T485 PolarHBondContact O-N 2.9Å; T485-E487 PolarHBondContact O-N 3.38Å
486	S	39.1	Very low	42.1	Very low	107 Å²	107	131.7 Å²	131.7	75%	0.748	71%	0.708	S	S	*	*	S	Bend	trans	-64.8	63.9	-168.7	55.9	0	0	0	0	112	L484	L484-S486 PolarHBondContact O-N 3.45Å
487	E	36	Very low	39.3	Very low	166 Å²	166	137.9 Å²	137.9	78%	0.776	74%	0.742	S	S	*	*			trans	-112.3	6.2	179.6	-70.5	-170.3	166.8	0	0	113.1	T485	T485-E487 PolarHBondContact O-N 3.38Å
488	L	32	Very low	36.7	Very low	160 Å²	160	142 Å²	142	84%	0.838	76%	0.76	S	S	*	*	S	Bend	trans	-115.7	5.4	172.6	-80.2	165	0	0	0	115.4	N490	L488-N490 VanDerWaalsContact C-N 3.28Å; L488-N490 PolarHBondContact O-N 2.89Å
489	F	32.6	Very low	34.5	Very low	196 Å²	196	145.8 Å²	145.8	86%	0.86	77%	0.774	S	S	*	*			trans	-93.3	61.9	163.2	-80.1	-79.4	0	0	0	110.8
490	N	29.8	Very low	33.3	Very low	160 Å²	160	147.5 Å²	147.5	86%	0.856	78%	0.782	S	S	*	*			trans	-113.5	55.7	159.3	-109.6	-9.7	0	0	0	108.3	L488	L488-N490 VanDerWaalsContact C-N 3.28Å; L488-N490 PolarHBondContact O-N 2.89Å
491	F	32.3	Very low	32.8	Very low	194 Å²	194	150 Å²	150	85%	0.851	79%	0.789	S	S	*	*			trans	-96	108.3	157.2	-86	-80.2	0	0	0	107.3
492	G	30.8	Very low	32.8	Very low	59 Å²	59	151 Å²	151	61%	0.608	80%	0.796	S	S	*	*			trans	-61.2	179.9	176.9	0	0	0	0	0	114	Y494	G492-Y494 PolarHBondContact O-N 2.7Å
493	P	39.8	Very low	33.1	Very low	125 Å²	125	148.6 Å²	148.6	81%	0.812	79%	0.789	S	S	*	*	S	Bend	trans	-82.9	96.1	-152.9	33.3	-33.3	0	0	0	110.9
494	Y	33	Very low	33.5	Very low	228 Å²	228	150 Å²	150	89%	0.894	79%	0.793	S	S	*	*			trans	-132.3	63.9	159.6	-98.6	-80.7	0	0	0	107.9	G492	G492-Y494 PolarHBondContact O-N 2.7Å
495	C	27.8	Very low	33.9	Very low	113 Å²	113	150.7 Å²	150.7	76%	0.764	79%	0.794	S	S	*	*			trans	-162.8	29.1	170.4	-106.3	0	0	0	0	114.2
496	E	33.1	Very low	34.9	Very low	181 Å²	181	149.4 Å²	149.4	85%	0.846	79%	0.789	S	S	*	*	S	Bend	trans	-93.9	-8.8	170.6	-100.2	-176.8	165.9	0	0	114.4
497	D	33.9	Very low	35.4	Very low	166 Å²	166	148.8 Å²	148.8	89%	0.888	78%	0.777	S	S	*	*	S	Bend	trans	-96.1	6	-175.7	-82.9	-23.3	0	0	0	115.9
498	L	32.2	Very low	36.1	Very low	163 Å²	163	145.1 Å²	145.1	85%	0.853	77%	0.766	S	S	*	*	S	Bend	trans	-115.3	8.7	-177	-105.1	101.5	0	0	0	116.8	H500	L498-H500 PolarHBondContact O-N 2.8Å
499	L	31.4	Very low	37.2	Very low	150 Å²	150	144.1 Å²	144.1	79%	0.785	76%	0.757	S	S	*	*	S	Bend	trans	-87.3	4.4	179.3	-89.2	160.3	0	0	0	115.4
500	H	33	Very low	38.5	Very low	180 Å²	180	137.4 Å²	137.4	83%	0.833	74%	0.738	S	S	*	*	S	Bend	trans	-116.3	68.1	176	-77.9	-59.5	0	0	0	112.6	L498	L498-H500 PolarHBondContact O-N 2.8Å
501	Q	33.2	Very low	39.8	Very low	182 Å²	182	138.4 Å²	138.4	85%	0.85	73%	0.729	S	S	*	*			trans	-165.5	84.1	155	-105.2	158.6	50.7	0	0	109.1	P503	Q501-P503 VanDerWaalsContact O-CD 3.22Å; Q501-P503 WeakPolarHBondContact O-CD 3.18Å
502	T	36	Very low	41.2	Very low	138 Å²	138	134.7 Å²	134.7	85%	0.847	72%	0.715	S	S	*	*			trans	-69.3	110.4	165.2	43.7	0	0	0	0	108.4
503	P	35.7	Very low	42.8	Very low	92 Å²	92	137.9 Å²	137.9	60%	0.597	72%	0.717	S	S	*	*			trans	-75.4	145.8	179.3	-2.9	21	0	0	0	109.9	Q501	Q501-P503 VanDerWaalsContact O-CD 3.22Å; Q501-P503 WeakPolarHBondContact O-CD 3.18Å
504	L	39.7	Very low	44	Very low	137 Å²	137	138.5 Å²	138.5	72%	0.717	71%	0.709	S	S	*	*			trans	-54.1	141.9	176.6	-104.9	82.7	0	0	0	111.3	S506 D507	L504-S506 PolarHBondContact O-N 3.46Å; L504-D507 PolarHBondContact O-N 2.86Å; L504-D507 VanDerWaalsContact O-N 3.1Å
505	M	38.9	Very low	45	Very low	164 Å²	164	136 Å²	136	81%	0.808	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.8	-12.5	-174	-157.8	151.7	71.1	0	0	115.4
506	S	51.9	Low	46.4	Very low	77 Å²	77	135 Å²	135	54%	0.538	69%	0.685	S	S	.	*	H	α-helix	trans	-72.2	-25.2	175.3	54.1	0	0	0	0	114.3	L504	L504-S506 PolarHBondContact O-N 3.46Å
507	D	50.1	Low	47.8	Very low	93 Å²	93	129 Å²	129	50%	0.497	67%	0.667	S	S	.	*	H	α-helix	trans	-81.7	-21.4	-177.5	-75.6	-17.1	0	0	0	113.3	L504 R511	L504-D507 PolarHBondContact O-N 2.86Å; L504-D507 VanDerWaalsContact O-N 3.1Å; D507-R511 PolarHBondContact O-N 3.47Å
508	V	51.2	Low	49.2	Very low	89 Å²	89	126.3 Å²	126.3	54%	0.539	65%	0.652	S	S	.	*	H	α-helix	trans	-73.8	-42.1	-179.4	-180	0	0	0	0	110.7	A510 R511 Q512	V508-A510 PolarHBondContact O-N 3.23Å; V508-R511 PolarHBondContact O-N 2.94Å; V508-Q512 WeakPolarHBondContact O-CB 3.12Å; V508-Q512 PolarHBondContact O-N 3.48Å
509	E	56	Low	50.8	Low	140 Å²	140	123.2 Å²	123.2	65%	0.654	64%	0.635	S	S	*	*	H	α-helix	trans	-67.1	-36.5	178.6	-68.1	-177.8	164.1	0	0	112.2	Q512 L513	E509-Q512 PolarHBondContact O-N 2.87Å; E509-L513 PolarHBondContact O-N 3.43Å; E509-L513 VanDerWaalsContact O-N 3.09Å
510	A	59.6	Low	52.3	Low	55 Å²	55	118.7 Å²	118.7	46%	0.455	62%	0.619	S	S	.	*	H	α-helix	trans	-64.9	-41.9	175.8	0	0	0	0	0	112.2	V508 L513 E514	V508-A510 PolarHBondContact O-N 3.23Å; A510-L513 PolarHBondContact O-N 3.47Å; A510-E514 PolarHBondContact O-N 3.18Å; A510-E514 VanDerWaalsContact O-N 3.12Å
511	R	56.1	Low	53.9	Low	180 Å²	180	114 Å²	114	68%	0.679	60%	0.603	S	S	*	*	H	α-helix	trans	-70.7	-32.9	176.8	-84.6	176.7	171.3	166.3	-0.5	113.4	D507 V508 W515	D507-R511 PolarHBondContact O-N 3.47Å; V508-R511 PolarHBondContact O-N 2.94Å; R511-W515 PolarHBondContact O-N 3.37Å; R511-W515 VanDerWaalsContact O-N 3.07Å
512	Q	63	Low	55.6	Low	117 Å²	117	110.1 Å²	110.1	55%	0.547	59%	0.585	S	S	.	*	H	α-helix	trans	-65.5	-43.7	174.7	-160.9	94.4	9.6	0	0	110.7	V508 E509 W515 D516	V508-Q512 WeakPolarHBondContact O-CB 3.12Å; V508-Q512 PolarHBondContact O-N 3.48Å; E509-Q512 PolarHBondContact O-N 2.87Å; Q512-W515 PolarHBondContact O-N 3.36Å; Q512-D516 PolarHBondContact O-N 3.24Å
513	L	63.9	Low	56.9	Low	126 Å²	126	106.3 Å²	106.3	66%	0.66	57%	0.568	S	S	*	*	H	α-helix	trans	-63.6	-39.3	176.2	-92.1	154.5	0	0	0	113	E509 A510 A517	E509-L513 PolarHBondContact O-N 3.43Å; E509-L513 VanDerWaalsContact O-N 3.09Å; A510-L513 PolarHBondContact O-N 3.47Å; L513-A517 VanDerWaalsContact O-CB 3.3Å; L513-A517 WeakPolarHBondContact O-CB 3.45Å; L513-A517 PolarHBondContact O-N 3.39Å
514	E	63.8	Low	58.3	Low	137 Å²	137	105.4 Å²	105.4	64%	0.64	56%	0.56	S	S	*	*	H	α-helix	trans	-63.5	-42.8	172.7	-94.4	-175.2	157.5	0	0	112.1	A510 A517 L518	A510-E514 PolarHBondContact O-N 3.18Å; A510-E514 VanDerWaalsContact O-N 3.12Å; E514-A517 PolarHBondContact O-N 3.3Å; E514-L518 WeakPolarHBondContact O-CB 3.28Å; E514-L518 PolarHBondContact O-N 2.91Å
515	W	54.2	Low	59.7	Low	176 Å²	176	105 Å²	105	67%	0.667	56%	0.555	S	S	*	*	H	α-helix	trans	-66	-43.4	178.1	-101.9	101.7	0	0	0	112.8	R511 Q512 A517 L518 I519	R511-W515 PolarHBondContact O-N 3.37Å; R511-W515 VanDerWaalsContact O-N 3.07Å; Q512-W515 PolarHBondContact O-N 3.36Å; W515-A517 VanDerWaalsContact C-N 3.31Å; W515-A517 PolarHBondContact O-N 3.41Å; W515-L518 PolarHBondContact O-N 2.92Å; W515-I519 HydrophobicContact CE3-CD1 4.06Å; W515-I519 HydrophobicContact CE3-CG1 4.2Å; W515-I519 WeakPolarHBondContact O-CG1 3.3Å; W515-I519 PolarHBondContact O-N 2.94Å
516	D	57.3	Low	61	Low	92 Å²	92	105.7 Å²	105.7	49%	0.492	55%	0.548	S	S	.	.	H	α-helix	trans	-65.6	-35.7	177.2	-72.3	-23.7	0	0	0	111.3	Q512 A520	Q512-D516 PolarHBondContact O-N 3.24Å; D516-A520 VanDerWaalsContact O-CB 3.25Å; D516-A520 WeakPolarHBondContact O-CB 3.47Å; D516-A520 PolarHBondContact O-N 2.82Å
517	A	62.8	Low	61.7	Low	55 Å²	55	110.1 Å²	110.1	46%	0.455	55%	0.554	S	S	.	*	H	α-helix	trans	-67.7	-37.6	173.9	0	0	0	0	0	112.9	L513 E514 W515 A520 T521	L513-A517 VanDerWaalsContact O-CB 3.3Å; L513-A517 WeakPolarHBondContact O-CB 3.45Å; L513-A517 PolarHBondContact O-N 3.39Å; E514-A517 PolarHBondContact O-N 3.3Å; W515-A517 VanDerWaalsContact C-N 3.31Å; W515-A517 PolarHBondContact O-N 3.41Å; A517-A520 PolarHBondContact O-N 3.08Å; A517-T521 WeakPolarHBondContact O-CB 3.45Å; A517-T521 WeakPolarHBondContact O-CG2 3.44Å; A517-T521 PolarHBondContact O-N 2.95Å; A517-T521 PolarHBondContact O-OG1 2.86Å
518	L	63.8	Low	62.3	Low	109 Å²	109	110.2 Å²	110.2	57%	0.571	55%	0.554	S	S	*	*	H	α-helix	trans	-67.5	-41.7	176	-119.1	146.3	0	0	0	111.9	E514 W515 T521 E522	E514-L518 WeakPolarHBondContact O-CB 3.28Å; E514-L518 PolarHBondContact O-N 2.91Å; W515-L518 PolarHBondContact O-N 2.92Å; L518-T521 WeakPolarHBondContact CA-OG1 3.4Å; L518-T521 PolarHBondContact O-N 3.46Å; L518-T521 PolarHBondContact O-OG1 2.95Å; L518-E522 PolarHBondContact O-N 2.77Å; L518-E522 VanDerWaalsContact O-N 3.12Å
519	I	64.7	Low	63.2	Low	99 Å²	99	109.5 Å²	109.5	51%	0.508	55%	0.55	S	S	.	*	H	α-helix	trans	-67	-40.4	175.2	-66.7	170.4	0	0	0	110.6	W515 A523	W515-I519 HydrophobicContact CE3-CD1 4.06Å; W515-I519 HydrophobicContact CE3-CG1 4.2Å; W515-I519 WeakPolarHBondContact O-CG1 3.3Å; W515-I519 PolarHBondContact O-N 2.94Å; I519-A523 VanDerWaalsContact O-CB 3.3Å; I519-A523 WeakPolarHBondContact O-CB 3.48Å; I519-A523 PolarHBondContact O-N 2.76Å
520	A	63	Low	63.2	Low	55 Å²	55	107.9 Å²	107.9	46%	0.455	55%	0.545	S	S	.	.	H	α-helix	trans	-65.2	-38.1	178.3	0	0	0	0	0	112.6	D516 A517 A523 T524	D516-A520 VanDerWaalsContact O-CB 3.25Å; D516-A520 WeakPolarHBondContact O-CB 3.47Å; D516-A520 PolarHBondContact O-N 2.82Å; A517-A520 PolarHBondContact O-N 3.08Å; A520-A523 PolarHBondContact O-N 3.09Å; A520-T524 PolarHBondContact O-N 3.06Å; A520-T524 PolarHBondContact O-OG1 3.37Å
521	T	67	Low	63.1	Low	81 Å²	81	109.6 Å²	109.6	50%	0.497	55%	0.546	S	S	.	.	H	α-helix	trans	-71.3	-41	178.4	39.7	0	0	0	0	112.8	A517 L518 A523 T524 Q525	A517-T521 WeakPolarHBondContact O-CB 3.45Å; A517-T521 WeakPolarHBondContact O-CG2 3.44Å; A517-T521 PolarHBondContact O-N 2.95Å; A517-T521 PolarHBondContact O-OG1 2.86Å; L518-T521 WeakPolarHBondContact CA-OG1 3.4Å; L518-T521 PolarHBondContact O-N 3.46Å; L518-T521 PolarHBondContact O-OG1 2.95Å; T521-A523 VanDerWaalsContact C-N 3.29Å; T521-A523 PolarHBondContact O-N 3.27Å; T521-T524 WeakPolarHBondContact CA-OG1 3.21Å; T521-T524 PolarHBondContact O-N 2.88Å; T521-T524 PolarHBondContact O-OG1 2.81Å; T521-T524 VanDerWaalsContact O-OG1 3.09Å; T521-Q525 WeakPolarHBondContact O-CB 3.42Å; T521-Q525 PolarHBondContact O-N 3.18Å
522	E	68.9	Low	63.2	Low	101 Å²	101	107 Å²	107	47%	0.472	54%	0.542	S	S	.	.	H	α-helix	trans	-63.8	-37.2	173.8	-164	78.9	-154.6	0	0	111.2	L518 R526	L518-E522 PolarHBondContact O-N 2.77Å; L518-E522 VanDerWaalsContact O-N 3.12Å; E522-R526 WeakPolarHBondContact O-CG 3.3Å; E522-R526 PolarHBondContact O-N 3.03Å; E522-R526 VanDerWaalsContact O-N 3.08Å
523	A	64.2	Low	63	Low	57 Å²	57	108.8 Å²	108.8	47%	0.471	55%	0.548	S	S	.	.	H	α-helix	trans	-69.9	-41.3	178.4	0	0	0	0	0	113.1	I519 A520 T521 R527	I519-A523 VanDerWaalsContact O-CB 3.3Å; I519-A523 WeakPolarHBondContact O-CB 3.48Å; I519-A523 PolarHBondContact O-N 2.76Å; A520-A523 PolarHBondContact O-N 3.09Å; T521-A523 VanDerWaalsContact C-N 3.29Å; T521-A523 PolarHBondContact O-N 3.27Å; A523-R527 WeakPolarHBondContact O-CB 3.48Å; A523-R527 PolarHBondContact O-N 3.05Å
524	T	64.8	Low	62.3	Low	73 Å²	73	106.5 Å²	106.5	45%	0.448	54%	0.535	S	S	.	.	H	α-helix	trans	-67.2	-40.5	173.6	34.5	0	0	0	0	111.7	A520 T521 R526 R527 D528	A520-T524 PolarHBondContact O-N 3.06Å; A520-T524 PolarHBondContact O-OG1 3.37Å; T521-T524 WeakPolarHBondContact CA-OG1 3.21Å; T521-T524 PolarHBondContact O-N 2.88Å; T521-T524 PolarHBondContact O-OG1 2.81Å; T521-T524 VanDerWaalsContact O-OG1 3.09Å; T524-R526 VanDerWaalsContact C-N 3.34Å; T524-R526 PolarHBondContact O-N 3.29Å; T524-R527 WeakPolarHBondContact O-CB 3.46Å; T524-R527 PolarHBondContact O-N 3.39Å; T524-R527 VanDerWaalsContact O-N 3.1Å; T524-D528 WeakPolarHBondContact O-CB 3.4Å; T524-D528 PolarHBondContact O-N 2.8Å
525	Q	68.4	Low	61.4	Low	129 Å²	129	102.6 Å²	102.6	60%	0.603	53%	0.526	S	S	*	.	H	α-helix	trans	-62.5	-39.1	177.2	-169.7	171.8	-9.3	0	0	112.5	T521 T529	T521-Q525 WeakPolarHBondContact O-CB 3.42Å; T521-Q525 PolarHBondContact O-N 3.18Å; Q525-T529 PolarHBondContact O-N 3.14Å; Q525-T529 VanDerWaalsContact O-N 3.09Å; Q525-T529 PolarHBondContact O-OG1 2.76Å
526	R	65.7	Low	60.9	Low	178 Å²	178	99.9 Å²	99.9	67%	0.672	53%	0.525	S	S	*	.	H	α-helix	trans	-67.7	-37.3	172.1	-77	-177.2	-177.6	-171.2	1.9	112.8	E522 T524 T529 L530	E522-R526 WeakPolarHBondContact O-CG 3.3Å; E522-R526 PolarHBondContact O-N 3.03Å; E522-R526 VanDerWaalsContact O-N 3.08Å; T524-R526 VanDerWaalsContact C-N 3.34Å; T524-R526 PolarHBondContact O-N 3.29Å; R526-T529 WeakPolarHBondContact CA-OG1 3.32Å; R526-T529 PolarHBondContact O-OG1 2.94Å; R526-L530 VanDerWaalsContact O-CB 3.29Å; R526-L530 WeakPolarHBondContact O-CB 3.45Å; R526-L530 PolarHBondContact O-N 3.5Å; R526-L530 VanDerWaalsContact O-N 3.08Å
527	R	67.7	Low	60.1	Low	171 Å²	171	101.4 Å²	101.4	65%	0.645	53%	0.529	S	S	*	.	H	α-helix	trans	-66.1	-44.5	176.7	-169.5	-176.4	-164.4	141.8	2.6	111.5	A523 T524 L530 L531	A523-R527 WeakPolarHBondContact O-CB 3.48Å; A523-R527 PolarHBondContact O-N 3.05Å; T524-R527 WeakPolarHBondContact O-CB 3.46Å; T524-R527 PolarHBondContact O-N 3.39Å; T524-R527 VanDerWaalsContact O-N 3.1Å; R527-L530 PolarHBondContact O-N 3.23Å; R527-L531 HydrophobicContact CG-CD1 4.05Å; R527-L531 HydrophobicContact CG-CG 4.5Å; R527-L531 WeakPolarHBondContact O-CB 3.47Å; R527-L531 WeakPolarHBondContact O-CG 2.91Å; R527-L531 PolarHBondContact O-N 3.14Å
528	D	63.1	Low	58.7	Low	95 Å²	95	104.1 Å²	104.1	51%	0.508	53%	0.532	S	S	.	.	H	α-helix	trans	-70.9	-40	-177.8	-71.6	-16.1	0	0	0	111.5	T524 L530 L531 Q532	T524-D528 WeakPolarHBondContact O-CB 3.4Å; T524-D528 PolarHBondContact O-N 2.8Å; D528-L530 VanDerWaalsContact C-N 3.3Å; D528-L530 PolarHBondContact O-N 2.91Å; D528-L531 PolarHBondContact O-N 2.92Å; D528-Q532 VanDerWaalsContact O-CB 3.24Å; D528-Q532 WeakPolarHBondContact O-CB 3.34Å; D528-Q532 PolarHBondContact O-N 3.33Å
529	T	68.7	Low	57.1	Low	74 Å²	74	109 Å²	109	45%	0.454	54%	0.544	S	S	.	.	H	α-helix	trans	-64.6	-33	171.5	39.1	0	0	0	0	113	Q525 R526 K533	Q525-T529 PolarHBondContact O-N 3.14Å; Q525-T529 VanDerWaalsContact O-N 3.09Å; Q525-T529 PolarHBondContact O-OG1 2.76Å; R526-T529 WeakPolarHBondContact CA-OG1 3.32Å; R526-T529 PolarHBondContact O-OG1 2.94Å; T529-K533 WeakPolarHBondContact O-CB 3.49Å; T529-K533 WeakPolarHBondContact O-CG 2.97Å; T529-K533 PolarHBondContact O-N 2.98Å; T529-K533 VanDerWaalsContact O-N 3.1Å
530	L	57.2	Low	55.4	Low	106 Å²	106	112.8 Å²	112.8	56%	0.555	56%	0.56	S	S	*	*	H	α-helix	trans	-71.1	-44.4	173.6	-171.9	72.9	0	0	0	111.4	R526 R527 D528 Q532 K533 I534	R526-L530 VanDerWaalsContact O-CB 3.29Å; R526-L530 WeakPolarHBondContact O-CB 3.45Å; R526-L530 PolarHBondContact O-N 3.5Å; R526-L530 VanDerWaalsContact O-N 3.08Å; R527-L530 PolarHBondContact O-N 3.23Å; D528-L530 VanDerWaalsContact C-N 3.3Å; D528-L530 PolarHBondContact O-N 2.91Å; L530-Q532 VanDerWaalsContact C-N 3.32Å; L530-Q532 PolarHBondContact O-N 3.28Å; L530-K533 PolarHBondContact O-N 3.15Å; L530-I534 HydrophobicContact CD2-CD1 4.49Å; L530-I534 HydrophobicContact CG-CD1 4Å; L530-I534 VanDerWaalsContact O-CG1 3.22Å; L530-I534 WeakPolarHBondContact O-CG1 3.45Å; L530-I534 PolarHBondContact O-N 3.07Å
531	L	56.8	Low	53.8	Low	91 Å²	91	116.1 Å²	116.1	48%	0.476	57%	0.57	S	S	.	*	H	α-helix	trans	-63.8	-37.9	176.8	-76.6	171	0	0	0	111.7	R527 D528 I534 A535	R527-L531 HydrophobicContact CG-CD1 4.05Å; R527-L531 HydrophobicContact CG-CG 4.5Å; R527-L531 WeakPolarHBondContact O-CB 3.47Å; R527-L531 WeakPolarHBondContact O-CG 2.91Å; R527-L531 PolarHBondContact O-N 3.14Å; D528-L531 PolarHBondContact O-N 2.92Å; L531-I534 CarbonylContact O-C 3.52Å; L531-I534 PolarHBondContact O-N 3.43Å; L531-A535 VanDerWaalsContact O-CB 3.28Å; L531-A535 WeakPolarHBondContact O-CB 3.41Å; L531-A535 PolarHBondContact O-N 2.87Å
532	Q	58.5	Low	51.9	Low	126 Å²	126	115.5 Å²	115.5	59%	0.589	58%	0.579	S	S	*	*	H	α-helix	trans	-68.3	-39.9	176.5	-158.3	162.9	7.5	0	0	111.3	D528 L530 I534 A535 D536	D528-Q532 VanDerWaalsContact O-CB 3.24Å; D528-Q532 WeakPolarHBondContact O-CB 3.34Å; D528-Q532 PolarHBondContact O-N 3.33Å; L530-Q532 VanDerWaalsContact C-N 3.32Å; L530-Q532 PolarHBondContact O-N 3.28Å; Q532-I534 VanDerWaalsContact C-N 3.33Å; Q532-I534 PolarHBondContact O-N 2.85Å; Q532-A535 PolarHBondContact O-N 3.33Å; Q532-D536 WeakPolarHBondContact O-CB 3.32Å; Q532-D536 PolarHBondContact O-N 2.83Å
533	K	57.5	Low	49.8	Very low	154 Å²	154	120.7 Å²	120.7	67%	0.67	60%	0.6	S	S	*	*	H	α-helix	trans	-63.1	-35.4	169.7	-79.2	177.4	179.2	174.6	0	113.1	T529 L530 H537	T529-K533 WeakPolarHBondContact O-CB 3.49Å; T529-K533 WeakPolarHBondContact O-CG 2.97Å; T529-K533 PolarHBondContact O-N 2.98Å; T529-K533 VanDerWaalsContact O-N 3.1Å; L530-K533 PolarHBondContact O-N 3.15Å; K533-H537 WeakPolarHBondContact O-CB 3.32Å; K533-H537 PolarHBondContact O-N 2.96Å
534	I	49.1	Very low	47.8	Very low	77 Å²	77	126.4 Å²	126.4	40%	0.395	62%	0.615	S	S	.	*	H	α-helix	trans	-73.5	-37.3	176.9	-68	164.6	0	0	0	111	L530 L531 Q532 H537 H538	L530-I534 HydrophobicContact CD2-CD1 4.49Å; L530-I534 HydrophobicContact CG-CD1 4Å; L530-I534 VanDerWaalsContact O-CG1 3.22Å; L530-I534 WeakPolarHBondContact O-CG1 3.45Å; L530-I534 PolarHBondContact O-N 3.07Å; L531-I534 CarbonylContact O-C 3.52Å; L531-I534 PolarHBondContact O-N 3.43Å; Q532-I534 VanDerWaalsContact C-N 3.33Å; Q532-I534 PolarHBondContact O-N 2.85Å; I534-H537 CarbonylContact O-C 3.56Å; I534-H537 WeakPolarHBondContact O-CB 3.39Å; I534-H537 PolarHBondContact O-N 3.04Å; I534-H538 PolarHBondContact O-N 3.48Å; I534-H538 PolarHBondContact O-ND1 3.18Å
535	A	45	Very low	46	Very low	55 Å²	55	127.2 Å²	127.2	46%	0.455	63%	0.629	S	S	.	*	H	α-helix	trans	-69	-43.5	177.7	0	0	0	0	0	111.7	L531 Q532 H537 H538 Y539	L531-A535 VanDerWaalsContact O-CB 3.28Å; L531-A535 WeakPolarHBondContact O-CB 3.41Å; L531-A535 PolarHBondContact O-N 2.87Å; Q532-A535 PolarHBondContact O-N 3.33Å; A535-H537 PolarHBondContact O-N 3.47Å; A535-H538 PolarHBondContact O-N 2.86Å; A535-Y539 PolarHBondContact O-N 2.98Å
536	D	44.9	Very low	43.9	Very low	119 Å²	119	130.6 Å²	130.6	64%	0.636	65%	0.645	S	S	*	*	H	α-helix	trans	-62	-30	171.3	-73.5	-16.5	0	0	0	111.5	Q532	Q532-D536 WeakPolarHBondContact O-CB 3.32Å; Q532-D536 PolarHBondContact O-N 2.83Å
537	H	40.4	Very low	42.1	Very low	124 Å²	124	124.4 Å²	124.4	57%	0.574	64%	0.636	S	S	*	*	H	α-helix	trans	-76	-25	173.9	-150.8	70.4	0	0	0	113.9	K533 I534 A535 K653	K533-H537 WeakPolarHBondContact O-CB 3.32Å; K533-H537 PolarHBondContact O-N 2.96Å; I534-H537 CarbonylContact O-C 3.56Å; I534-H537 WeakPolarHBondContact O-CB 3.39Å; I534-H537 PolarHBondContact O-N 3.04Å; A535-H537 PolarHBondContact O-N 3.47Å; H537-K653 PolarHBondContact CE1-NZ 3.24Å; H537-K653 PolarHBondContact NE2-NZ 3.46Å
538	H	32.8	Very low	40.7	Very low	112 Å²	112	118 Å²	118	52%	0.519	62%	0.616	S	S	.	*	H	α-helix	trans	-95.1	-19.6	-177.2	-86.2	76.1	0	0	0	113.9	I534 A535 Q540 L541	I534-H538 PolarHBondContact O-N 3.48Å; I534-H538 PolarHBondContact O-ND1 3.18Å; A535-H538 PolarHBondContact O-N 2.86Å; H538-Q540 VanDerWaalsContact C-N 3.28Å; H538-Q540 PolarHBondContact O-N 3.12Å; H538-L541 WeakPolarHBondContact O-CD1 3.42Å; H538-L541 WeakPolarHBondContact O-CG 3.16Å; H538-L541 PolarHBondContact O-N 3.41Å
539	Y	30.4	Very low	39.5	Very low	211 Å²	211	119.8 Å²	119.8	83%	0.827	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	-8.2	-176.9	-165	-103	0	0	0	114.7	A535 L541	A535-Y539 PolarHBondContact O-N 2.98Å; Y539-L541 VanDerWaalsContact C-N 3.25Å; Y539-L541 PolarHBondContact O-N 3.19Å
540	Q	30.3	Very low	38	Very low	179 Å²	179	119.1 Å²	119.1	84%	0.836	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	38.3	171	-70.4	-88.9	-24.1	0	0	111.9	H538 G542	H538-Q540 VanDerWaalsContact C-N 3.28Å; H538-Q540 PolarHBondContact O-N 3.12Å; Q540-G542 PolarHBondContact O-N 3.37Å; Q540-G542 VanDerWaalsContact O-N 3.11Å
541	L	29	Very low	37.8	Very low	126 Å²	126	119.3 Å²	119.3	66%	0.66	63%	0.631	S	S	*	*			trans	-75.6	85.1	172	-88.3	161.5	0	0	0	110.6	H538 Y539	H538-L541 WeakPolarHBondContact O-CD1 3.42Å; H538-L541 WeakPolarHBondContact O-CG 3.16Å; H538-L541 PolarHBondContact O-N 3.41Å; Y539-L541 VanDerWaalsContact C-N 3.25Å; Y539-L541 PolarHBondContact O-N 3.19Å
542	G	26.4	Very low	37.2	Very low	67 Å²	67	118.1 Å²	118.1	69%	0.691	63%	0.634	S	S	*	*			trans	-80	113.8	162	0	0	0	0	0	111.3	Q540	Q540-G542 PolarHBondContact O-N 3.37Å; Q540-G542 VanDerWaalsContact O-N 3.11Å
543	F	24.1	Very low	36.3	Very low	211 Å²	211	113 Å²	113	93%	0.925	62%	0.616	S	S	*	*			trans	22.6	96.9	160.3	-90.7	-94.8	0	0	0	118.8	A545	F543-A545 PolarHBondContact O-N 2.83Å; F543-A545 VanDerWaalsContact O-N 3.1Å
544	K	23.6	Very low	35.8	Very low	177 Å²	177	113 Å²	113	77%	0.77	61%	0.611	S	S	*	*			trans	-73.4	90.1	160.7	-86.6	179.3	173.2	174.7	0	110.4	Q546	K544-Q546 PolarHBondContact O-N 3.37Å
545	A	26.1	Very low	36	Very low	90 Å²	90	115.5 Å²	115.5	74%	0.744	63%	0.625	S	S	*	*			trans	-63	127.8	156	0	0	0	0	0	108	F543 G547	F543-A545 PolarHBondContact O-N 2.83Å; F543-A545 VanDerWaalsContact O-N 3.1Å; A545-G547 PolarHBondContact O-N 3.34Å
546	Q	25.3	Very low	36.1	Very low	200 Å²	200	116.9 Å²	116.9	94%	0.935	63%	0.628	S	S	*	*			trans	-51.4	108.4	-177	-74.7	174	-16.3	0	0	110.4	K544	K544-Q546 PolarHBondContact O-N 3.37Å
547	G	28.2	Very low	36.2	Very low	48 Å²	48	115.5 Å²	115.5	50%	0.495	62%	0.62	S	S	.	*			trans	-65.9	160.8	-168.8	0	0	0	0	0	113.8	A545 L549	A545-G547 PolarHBondContact O-N 3.34Å; G547-L549 PolarHBondContact O-N 3.35Å
548	P	38	Very low	36.9	Very low	35 Å²	35	113.7 Å²	113.7	23%	0.227	62%	0.617	C	S	.	*	T	Hydrogen-bonded Turn	trans	-84.1	42.6	-165.5	33.5	-32.2	0	0	0	113.1	R554 L557 K658	P548-R554 WeakPolarHBondContact O-CG 3.45Å; P548-L557 HydrophobicContact CB-CD1 3.38Å; P548-L557 HydrophobicContact CG-CD1 3.55Å; P548-K658 HydrophobicContact CG-CD 3.86Å
549	L	37.1	Very low	37.9	Very low	134 Å²	134	111.1 Å²	111.1	70%	0.702	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	-18.2	172.9	-75.5	162.7	0	0	0	112.1	G547	G547-L549 PolarHBondContact O-N 3.35Å
550	S	37.2	Very low	38.7	Very low	60 Å²	60	106.9 Å²	106.9	42%	0.42	61%	0.606	S	S	.	*	S	Bend	trans	-73.2	144.4	169.6	74.2	0	0	0	0	110.5	A552 G553 R554	S550-A552 PolarHBondContact O-N 3.22Å; S550-G553 PolarHBondContact O-N 3.45Å; S550-G553 PolarHBondContact OG-N 3.49Å; S550-R554 PolarHBondContact O-N 3.38Å; S550-R554 VanDerWaalsContact O-N 3.09Å
551	P	52.5	Low	39.7	Very low	110 Å²	110	101.7 Å²	101.7	71%	0.714	58%	0.581	S	S	*	*	H	α-helix	trans	-52.4	-37.7	173.8	-26.1	33.5	0	0	0	112.5	R554 L555	P551-R554 PolarHBondContact O-N 3.1Å; P551-L555 PolarHBondContact O-N 2.91Å
552	A	45.5	Very low	41	Very low	65 Å²	65	102.2 Å²	102.2	54%	0.537	58%	0.578	S	S	.	*	H	α-helix	trans	-62.4	-43.4	174.5	0	0	0	0	0	112.4	S550 R554 L555 V556	S550-A552 PolarHBondContact O-N 3.22Å; A552-R554 VanDerWaalsContact C-N 3.33Å; A552-R554 PolarHBondContact O-N 3.43Å; A552-L555 PolarHBondContact O-N 3.43Å; A552-V556 WeakPolarHBondContact O-CG2 3.49Å; A552-V556 PolarHBondContact O-N 3.48Å
553	G	40	Very low	42.2	Very low	19 Å²	19	102.3 Å²	102.3	20%	0.196	57%	0.567	C	S	.	*	H	α-helix	trans	-63.6	-35.5	176.3	0	0	0	0	0	113.2	S550 L557	S550-G553 PolarHBondContact O-N 3.45Å; S550-G553 PolarHBondContact OG-N 3.49Å; G553-L557 WeakPolarHBondContact O-CB 3.34Å; G553-L557 PolarHBondContact O-N 3.45Å; G553-L557 VanDerWaalsContact O-N 3.09Å
554	R	46	Very low	43.4	Very low	154 Å²	154	94.1 Å²	94.1	58%	0.581	54%	0.541	S	S	*	.	H	α-helix	trans	-67.7	-38.5	172.9	-63	-173.9	-168.9	-160.8	4.4	112.2	P548 S550 P551 A552 L557 V558	P548-R554 WeakPolarHBondContact O-CG 3.45Å; S550-R554 PolarHBondContact O-N 3.38Å; S550-R554 VanDerWaalsContact O-N 3.09Å; P551-R554 PolarHBondContact O-N 3.1Å; A552-R554 VanDerWaalsContact C-N 3.33Å; A552-R554 PolarHBondContact O-N 3.43Å; R554-L557 PolarHBondContact O-N 2.92Å; R554-V558 WeakPolarHBondContact O-CG2 3.3Å; R554-V558 PolarHBondContact O-N 2.88Å
555	L	53	Low	44.8	Very low	130 Å²	130	87.2 Å²	87.2	68%	0.681	51%	0.512	S	S	*	.	H	α-helix	trans	-70.1	-40.3	-178.9	-145.5	136.1	0	0	0	111.5	P551 A552 V558 A559	P551-L555 PolarHBondContact O-N 2.91Å; A552-L555 PolarHBondContact O-N 3.43Å; L555-V558 PolarHBondContact O-N 3.44Å; L555-A559 WeakPolarHBondContact O-CB 3.32Å; L555-A559 PolarHBondContact O-N 2.97Å
556	V	48	Very low	46.3	Very low	84 Å²	84	90.6 Å²	90.6	51%	0.509	51%	0.507	S	S	.	.	H	α-helix	trans	-63.2	-41.3	171.4	173.5	0	0	0	0	111.3	A552 A559 L560	A552-V556 WeakPolarHBondContact O-CG2 3.49Å; A552-V556 PolarHBondContact O-N 3.48Å; V556-A559 PolarHBondContact O-N 2.92Å; V556-L560 HydrophobicContact CG1-CD1 3.7Å; V556-L560 HydrophobicContact CG1-CG 4.31Å; V556-L560 WeakPolarHBondContact O-CB 3.42Å; V556-L560 WeakPolarHBondContact O-CG 3.43Å; V556-L560 PolarHBondContact O-N 2.72Å
557	L	46.5	Very low	47.8	Very low	90 Å²	90	86.6 Å²	86.6	47%	0.471	49%	0.491	S	S	.	.	H	α-helix	trans	-61.1	-47.9	176.4	-120.9	146.8	0	0	0	111.6	P548 G553 R554 L560 F561	P548-L557 HydrophobicContact CB-CD1 3.38Å; P548-L557 HydrophobicContact CG-CD1 3.55Å; G553-L557 WeakPolarHBondContact O-CB 3.34Å; G553-L557 PolarHBondContact O-N 3.45Å; G553-L557 VanDerWaalsContact O-N 3.09Å; R554-L557 PolarHBondContact O-N 2.92Å; L557-L560 PolarHBondContact O-N 3.32Å; L557-F561 WeakPolarHBondContact O-CB 3.41Å; L557-F561 PolarHBondContact O-N 2.87Å
558	V	55.3	Low	49	Very low	85 Å²	85	89.2 Å²	89.2	52%	0.515	49%	0.487	S	S	.	.	H	α-helix	trans	-62.9	-43.4	176.2	170.1	0	0	0	0	111.2	R554 L555 L560 F561 F562	R554-V558 WeakPolarHBondContact O-CG2 3.3Å; R554-V558 PolarHBondContact O-N 2.88Å; L555-V558 PolarHBondContact O-N 3.44Å; V558-L560 PolarHBondContact O-N 3.49Å; V558-F561 PolarHBondContact O-N 3.39Å; V558-F562 HydrophobicContact CG1-CD2 4.11Å; V558-F562 HydrophobicContact CG1-CE2 3.94Å; V558-F562 WeakPolarHBondContact O-CD2 3.42Å
559	A	53.4	Low	49.8	Very low	59 Å²	59	90.9 Å²	90.9	49%	0.488	49%	0.494	S	S	.	.	H	α-helix	trans	-66.5	-33.1	-178.5	0	0	0	0	0	113.3	L555 V556 P563	L555-A559 WeakPolarHBondContact O-CB 3.32Å; L555-A559 PolarHBondContact O-N 2.97Å; V556-A559 PolarHBondContact O-N 2.92Å; A559-P563 WeakPolarHBondContact O-CD 3.29Å; A559-P563 WeakPolarHBondContact O-CG 3.3Å
560	L	47.2	Very low	50.8	Low	122 Å²	122	86.9 Å²	86.9	64%	0.639	48%	0.475	S	S	*	.	H	α-helix	trans	-86.7	-29	176.8	-68.2	173.7	0	0	0	112.8	V556 L557 V558 G564	V556-L560 HydrophobicContact CG1-CD1 3.7Å; V556-L560 HydrophobicContact CG1-CG 4.31Å; V556-L560 WeakPolarHBondContact O-CB 3.42Å; V556-L560 WeakPolarHBondContact O-CG 3.43Å; V556-L560 PolarHBondContact O-N 2.72Å; L557-L560 PolarHBondContact O-N 3.32Å; V558-L560 PolarHBondContact O-N 3.49Å; L560-G564 PolarHBondContact O-N 2.88Å; L560-G564 VanDerWaalsContact O-N 3.08Å
561	F	51	Low	51.8	Low	70 Å²	70	86.3 Å²	86.3	31%	0.307	47%	0.474	S	S	.	.	H	α-helix	trans	-67	-46.6	-174.1	-179.6	-104.4	0	0	0	113.1	L557 V558 M565 V662 L666	L557-F561 WeakPolarHBondContact O-CB 3.41Å; L557-F561 PolarHBondContact O-N 2.87Å; V558-F561 PolarHBondContact O-N 3.39Å; F561-M565 HydrophobicContact CD2-CG 4.4Å; F561-M565 HydrophobicContact CE1-CG 4.22Å; F561-M565 HydrophobicContact CE2-CG 4.02Å; F561-M565 HydrophobicContact CZ-CG 3.97Å; F561-M565 VanDerWaalsContact O-CB 3.26Å; F561-M565 WeakPolarHBondContact O-CB 3.37Å; F561-M565 VanDerWaalsContact O-CG 3.3Å; F561-M565 WeakPolarHBondContact O-CG 3.45Å; F561-M565 PolarHBondContact O-N 3.34Å; F561-V662 HydrophobicContact CD2-CG1 4.2Å; F561-V662 HydrophobicContact CE2-CG1 3.14Å; F561-V662 HydrophobicContact CZ-CG1 3.36Å; F561-L666 HydrophobicContact CE2-CD1 3.56Å; F561-L666 HydrophobicContact CZ-CD1 3.32Å; F561-L666 HydrophobicContact CZ-CD2 4.32Å; F561-L666 HydrophobicContact CZ-CG 4.43Å
562	F	56.3	Low	52	Low	137 Å²	137	82.4 Å²	82.4	60%	0.601	45%	0.451	S	S	*	.	H	α-helix	trans	-69.5	-44.4	-178.2	-72.2	-73.1	0	0	0	113.9	V558 M565 Y566	V558-F562 HydrophobicContact CG1-CD2 4.11Å; V558-F562 HydrophobicContact CG1-CE2 3.94Å; V558-F562 WeakPolarHBondContact O-CD2 3.42Å; F562-M565 PolarHBondContact O-N 2.65Å; F562-Y566 WeakPolarHBondContact O-CB 3.47Å; F562-Y566 PolarHBondContact O-N 3.19Å
563	P	52.7	Low	52.5	Low	69 Å²	69	81.3 Å²	81.3	45%	0.448	44%	0.439	S	S	.	.	H	α-helix	trans	-64.9	-40.7	173.8	-22.6	34.7	0	0	0	112.8	A559 Y566 L567	A559-P563 WeakPolarHBondContact O-CD 3.29Å; A559-P563 WeakPolarHBondContact O-CG 3.3Å; P563-Y566 PolarHBondContact O-N 3.48Å; P563-L567 WeakPolarHBondContact O-CB 3.06Å; P563-L567 WeakPolarHBondContact O-CG 3.4Å; P563-L567 PolarHBondContact O-N 3.03Å
564	G	48	Very low	53.6	Low	38 Å²	38	84.4 Å²	84.4	39%	0.392	46%	0.457	S	S	.	.	H	α-helix	trans	-62.1	-42.9	175.7	0	0	0	0	0	112.3	L560 L567 Y568	L560-G564 PolarHBondContact O-N 2.88Å; L560-G564 VanDerWaalsContact O-N 3.08Å; G564-L567 PolarHBondContact O-N 2.99Å; G564-Y568 WeakPolarHBondContact O-CB 3.25Å; G564-Y568 PolarHBondContact O-N 2.97Å
565	M	53.5	Low	54.3	Low	32 Å²	32	82.7 Å²	82.7	16%	0.158	46%	0.458	C	S	.	.	H	α-helix	trans	-63.4	-41.9	174	-84.2	-58	-49	0	0	112.9	F561 F562 Y568 L569 L666	F561-M565 HydrophobicContact CD2-CG 4.4Å; F561-M565 HydrophobicContact CE1-CG 4.22Å; F561-M565 HydrophobicContact CE2-CG 4.02Å; F561-M565 HydrophobicContact CZ-CG 3.97Å; F561-M565 VanDerWaalsContact O-CB 3.26Å; F561-M565 WeakPolarHBondContact O-CB 3.37Å; F561-M565 VanDerWaalsContact O-CG 3.3Å; F561-M565 WeakPolarHBondContact O-CG 3.45Å; F561-M565 PolarHBondContact O-N 3.34Å; F562-M565 PolarHBondContact O-N 2.65Å; M565-Y568 PolarHBondContact O-N 2.85Å; M565-L569 HydrophobicContact CE-CD1 3.85Å; M565-L569 HydrophobicContact CE-CG 4.05Å; M565-L569 WeakPolarHBondContact O-CB 3.25Å; M565-L569 WeakPolarHBondContact O-CG 3.31Å; M565-L569 PolarHBondContact O-N 2.93Å; M565-L666 HydrophobicContact CE-CB 4.07Å; M565-L666 HydrophobicContact CE-CD1 4.47Å; M565-L666 HydrophobicContact CE-CD2 3.45Å; M565-L666 VanDerWaalsContact CE-CD2 3.45Å; M565-L666 HydrophobicContact CE-CG 4.17Å; M565-L666 HydrophobicContact CG-CD1 4.41Å; M565-L666 HydrophobicContact CG-CD2 4.37Å; M565-L666 HydrophobicContact SD-CB 4.04Å; M565-L666 HydrophobicContact SD-CD1 3.67Å; M565-L666 HydrophobicContact SD-CD2 3.72Å; M565-L666 HydrophobicContact SD-CG 3.99Å
566	Y	57.9	Low	54.8	Low	162 Å²	162	77 Å²	77	64%	0.635	43%	0.431	S	S	*	.	H	α-helix	trans	-63.1	-46.1	176.5	177.7	-96.6	0	0	0	111.6	F562 P563 L569 T570	F562-Y566 WeakPolarHBondContact O-CB 3.47Å; F562-Y566 PolarHBondContact O-N 3.19Å; P563-Y566 PolarHBondContact O-N 3.48Å; Y566-L569 PolarHBondContact O-N 3.02Å; Y566-T570 HydrophobicContact CD1-CG2 4.49Å; Y566-T570 HydrophobicContact CE1-CG2 4.03Å; Y566-T570 HydrophobicContact CE2-CG2 4.13Å; Y566-T570 WeakPolarHBondContact O-CB 3.33Å; Y566-T570 PolarHBondContact O-N 3.27Å; Y566-T570 PolarHBondContact O-OG1 3.02Å
567	L	55.6	Low	55.3	Low	115 Å²	115	81.3 Å²	81.3	60%	0.602	44%	0.438	S	S	*	.	H	α-helix	trans	-61.8	-41.4	176.1	-77	164.7	0	0	0	112	P563 G564 T570 A571	P563-L567 WeakPolarHBondContact O-CB 3.06Å; P563-L567 WeakPolarHBondContact O-CG 3.4Å; P563-L567 PolarHBondContact O-N 3.03Å; G564-L567 PolarHBondContact O-N 2.99Å; L567-T570 VanDerWaalsContact CA-OG1 3.3Å; L567-T570 WeakPolarHBondContact CA-OG1 3.39Å; L567-T570 PolarHBondContact O-OG1 3.17Å; L567-A571 VanDerWaalsContact O-CB 3.26Å; L567-A571 WeakPolarHBondContact O-CB 3.3Å; L567-A571 PolarHBondContact O-N 3.03Å
568	Y	53.3	Low	56.2	Low	103 Å²	103	82.5 Å²	82.5	40%	0.404	44%	0.444	S	S	.	.	H	α-helix	trans	-65	-48	177.1	-177.5	-97.1	0	0	0	112.2	G564 M565 T570 A571 A572 Y667 T670	G564-Y568 WeakPolarHBondContact O-CB 3.25Å; G564-Y568 PolarHBondContact O-N 2.97Å; M565-Y568 PolarHBondContact O-N 2.85Å; Y568-T570 PolarHBondContact O-N 2.79Å; Y568-A571 PolarHBondContact O-N 3.31Å; Y568-A572 WeakPolarHBondContact O-CB 3.42Å; Y568-A572 PolarHBondContact O-N 3.08Å; Y568-Y667 VanDerWaalsContact OH-CD2 3.26Å; Y568-Y667 WeakPolarHBondContact OH-CD2 3.17Å; Y568-Y667 VanDerWaalsContact OH-CE2 3.28Å; Y568-Y667 WeakPolarHBondContact OH-CE2 3.39Å; Y568-T670 HydrophobicContact CD1-CG2 3.94Å; Y568-T670 HydrophobicContact CE1-CG2 3.62Å
569	L	56.3	Low	56.6	Low	70 Å²	70	81.1 Å²	81.1	37%	0.366	43%	0.434	S	S	.	.	H	α-helix	trans	-63.8	-39.4	178.4	-77.8	165.9	0	0	0	112.2	M565 Y566 C573 T670	M565-L569 HydrophobicContact CE-CD1 3.85Å; M565-L569 HydrophobicContact CE-CG 4.05Å; M565-L569 WeakPolarHBondContact O-CB 3.25Å; M565-L569 WeakPolarHBondContact O-CG 3.31Å; M565-L569 PolarHBondContact O-N 2.93Å; Y566-L569 PolarHBondContact O-N 3.02Å; L569-C573 WeakPolarHBondContact O-CB 3.45Å; L569-C573 PolarHBondContact O-N 3.49Å; L569-T670 HydrophobicContact CD2-CG2 3.4Å; L569-T670 VanDerWaalsContact CD2-CG2 3.4Å; L569-T670 HydrophobicContact CG-CG2 4.25Å
570	T	57.9	Low	56.9	Low	50 Å²	50	79.7 Å²	79.7	31%	0.307	42%	0.42	S	S	.	.	H	α-helix	trans	-68.3	-43	175.7	41.1	0	0	0	0	111.7	Y566 L567 Y568 C573 C574	Y566-T570 HydrophobicContact CD1-CG2 4.49Å; Y566-T570 HydrophobicContact CE1-CG2 4.03Å; Y566-T570 HydrophobicContact CE2-CG2 4.13Å; Y566-T570 WeakPolarHBondContact O-CB 3.33Å; Y566-T570 PolarHBondContact O-N 3.27Å; Y566-T570 PolarHBondContact O-OG1 3.02Å; L567-T570 VanDerWaalsContact CA-OG1 3.3Å; L567-T570 WeakPolarHBondContact CA-OG1 3.39Å; L567-T570 PolarHBondContact O-OG1 3.17Å; Y568-T570 PolarHBondContact O-N 2.79Å; T570-C573 PolarHBondContact O-N 3.2Å; T570-C574 PolarHBondContact O-N 3.23Å; T570-C574 PolarHBondContact O-SG 2.99Å
571	A	57.1	Low	57.5	Low	48 Å²	48	80.6 Å²	80.6	40%	0.397	42%	0.419	S	S	.	.	H	α-helix	trans	-61	-45.5	174.6	0	0	0	0	0	112.2	L567 Y568 C573 C574 L575	L567-A571 VanDerWaalsContact O-CB 3.26Å; L567-A571 WeakPolarHBondContact O-CB 3.3Å; L567-A571 PolarHBondContact O-N 3.03Å; Y568-A571 PolarHBondContact O-N 3.31Å; A571-C573 VanDerWaalsContact C-N 3.31Å; A571-C573 PolarHBondContact O-N 3.27Å; A571-C574 PolarHBondContact O-N 2.94Å; A571-L575 WeakPolarHBondContact O-CB 3.46Å; A571-L575 WeakPolarHBondContact O-CG 3.48Å; A571-L575 PolarHBondContact O-N 3.23Å
572	A	58.2	Low	58.2	Low	28 Å²	28	80.7 Å²	80.7	23%	0.231	43%	0.426	C	S	.	.	H	α-helix	trans	-60.7	-40	176.2	0	0	0	0	0	111.9	Y568 G576	Y568-A572 WeakPolarHBondContact O-CB 3.42Å; Y568-A572 PolarHBondContact O-N 3.08Å; A572-G576 PolarHBondContact O-N 3.14Å
573	C	55.9	Low	58.5	Low	42 Å²	42	76.3 Å²	76.3	28%	0.284	41%	0.408	S	S	.	.	H	α-helix	trans	-67.4	-41.6	176.4	-154.3	0	0	0	0	112	L569 T570 A571 G576 R577	L569-C573 WeakPolarHBondContact O-CB 3.45Å; L569-C573 PolarHBondContact O-N 3.49Å; T570-C573 PolarHBondContact O-N 3.2Å; A571-C573 VanDerWaalsContact C-N 3.31Å; A571-C573 PolarHBondContact O-N 3.27Å; C573-G576 PolarHBondContact O-N 2.99Å; C573-R577 WeakPolarHBondContact O-CG 3.27Å; C573-R577 PolarHBondContact O-N 3.47Å
574	C	62.2	Low	58.7	Low	85 Å²	85	76.6 Å²	76.6	57%	0.574	40%	0.401	S	S	*	.	H	α-helix	trans	-64.1	-47.2	175.5	-76.6	0	0	0	0	112.2	T570 A571 G576 R577 L578	T570-C574 PolarHBondContact O-N 3.23Å; T570-C574 PolarHBondContact O-SG 2.99Å; A571-C574 PolarHBondContact O-N 2.94Å; C574-G576 VanDerWaalsContact C-N 3.33Å; C574-G576 PolarHBondContact O-N 3.26Å; C574-R577 PolarHBondContact O-N 3.37Å; C574-L578 WeakPolarHBondContact O-CB 3.11Å; C574-L578 PolarHBondContact O-N 3.13Å
575	L	61.5	Low	59.4	Low	118 Å²	118	78 Å²	78	62%	0.618	40%	0.404	S	S	*	.	H	α-helix	trans	-61.4	-41.6	176.1	-77	165.3	0	0	0	111.5	A571 R577 L578 L579	A571-L575 WeakPolarHBondContact O-CB 3.46Å; A571-L575 WeakPolarHBondContact O-CG 3.48Å; A571-L575 PolarHBondContact O-N 3.23Å; L575-R577 PolarHBondContact O-N 3.3Å; L575-L578 PolarHBondContact O-N 3.45Å; L575-L579 WeakPolarHBondContact O-CB 3.32Å; L575-L579 PolarHBondContact O-N 3.03Å
576	G	63.9	Low	59.9	Low	11 Å²	11	79.1 Å²	79.1	11%	0.113	42%	0.419	C	S	.	.	H	α-helix	trans	-62.2	-42	176.6	0	0	0	0	0	114.1	A572 C573 C574 S580 F674	A572-G576 PolarHBondContact O-N 3.14Å; C573-G576 PolarHBondContact O-N 2.99Å; C574-G576 VanDerWaalsContact C-N 3.33Å; C574-G576 PolarHBondContact O-N 3.26Å; G576-S580 WeakPolarHBondContact O-CB 3.34Å; G576-S580 PolarHBondContact O-N 3.13Å; G576-F674 VanDerWaalsContact CA-CE2 3.49Å
577	R	58.4	Low	60	Low	174 Å²	174	72.9 Å²	72.9	66%	0.657	40%	0.398	S	S	*	.	H	α-helix	trans	-64.5	-45.3	174	-74.1	179.5	-176.5	-171.8	2.1	111.6	C573 C574 L575 L579 S580 F581	C573-R577 WeakPolarHBondContact O-CG 3.27Å; C573-R577 PolarHBondContact O-N 3.47Å; C574-R577 PolarHBondContact O-N 3.37Å; L575-R577 PolarHBondContact O-N 3.3Å; R577-L579 VanDerWaalsContact C-N 3.34Å; R577-L579 PolarHBondContact O-N 3.45Å; R577-S580 PolarHBondContact O-N 3.49Å; R577-F581 WeakPolarHBondContact O-CB 3.2Å; R577-F581 PolarHBondContact O-N 3.35Å
578	L	64.2	Low	60.1	Low	114 Å²	114	70.4 Å²	70.4	60%	0.597	39%	0.39	S	S	*	.	H	α-helix	trans	-61.9	-43.7	179.6	-165.4	75.1	0	0	0	111.1	C574 L575 F581 T582	C574-L578 WeakPolarHBondContact O-CB 3.11Å; C574-L578 PolarHBondContact O-N 3.13Å; L575-L578 PolarHBondContact O-N 3.45Å; L578-F581 PolarHBondContact O-N 3.09Å; L578-T582 WeakPolarHBondContact O-CG2 3.17Å; L578-T582 PolarHBondContact O-N 2.96Å; L578-T582 PolarHBondContact O-OG1 3.06Å
579	L	63.5	Low	60.5	Low	57 Å²	57	74.5 Å²	74.5	30%	0.298	41%	0.41	S	S	.	.	H	α-helix	trans	-68.7	-41.9	179.4	-166	101.3	0	0	0	112.6	L575 R577 F581 T582 I583 F610	L575-L579 WeakPolarHBondContact O-CB 3.32Å; L575-L579 PolarHBondContact O-N 3.03Å; R577-L579 VanDerWaalsContact C-N 3.34Å; R577-L579 PolarHBondContact O-N 3.45Å; L579-F581 PolarHBondContact O-N 2.91Å; L579-T582 WeakPolarHBondContact CA-OG1 3.38Å; L579-T582 PolarHBondContact O-N 2.9Å; L579-T582 PolarHBondContact O-OG1 3.07Å; L579-I583 HydrophobicContact CD2-CD1 3.86Å; L579-I583 HydrophobicContact CG-CD1 4.1Å; L579-I583 WeakPolarHBondContact O-CB 3.21Å; L579-I583 VanDerWaalsContact O-CG1 3.28Å; L579-I583 WeakPolarHBondContact O-CG1 3.48Å; L579-I583 PolarHBondContact O-N 3.09Å; L579-F610 HydrophobicContact CD1-CE2 4.37Å; L579-F610 HydrophobicContact CD1-CZ 4.49Å; L579-F610 HydrophobicContact CD2-CD1 3.71Å; L579-F610 HydrophobicContact CD2-CD2 3.67Å; L579-F610 HydrophobicContact CD2-CE1 3.37Å; L579-F610 HydrophobicContact CD2-CE2 3.36Å; L579-F610 HydrophobicContact CD2-CG 3.85Å; L579-F610 HydrophobicContact CD2-CZ 3.22Å; L579-F610 HydrophobicContact CG-CE2 4.5Å; L579-F610 HydrophobicContact CG-CZ 4.43Å
580	S	60	Low	60.6	Low	28 Å²	28	79 Å²	79	20%	0.196	43%	0.431	C	S	.	.	H	α-helix	trans	-61.7	-37.7	174	-174.7	0	0	0	0	111.2	G576 R577 Y584 L681	G576-S580 WeakPolarHBondContact O-CB 3.34Å; G576-S580 PolarHBondContact O-N 3.13Å; R577-S580 PolarHBondContact O-N 3.49Å; S580-Y584 VanDerWaalsContact O-CB 3.27Å; S580-Y584 WeakPolarHBondContact O-CB 3.32Å; S580-Y584 PolarHBondContact O-N 3.43Å; S580-L681 VanDerWaalsContact OG-CD2 3.3Å; S580-L681 WeakPolarHBondContact OG-CD2 3.16Å
581	F	60.5	Low	60.2	Low	141 Å²	141	77.7 Å²	77.7	62%	0.618	43%	0.428	S	S	*	.	H	α-helix	trans	-69.5	-38.8	177.3	-169.4	-94.6	0	0	0	112.1	R577 L578 L579 Y584 S585	R577-F581 WeakPolarHBondContact O-CB 3.2Å; R577-F581 PolarHBondContact O-N 3.35Å; L578-F581 PolarHBondContact O-N 3.09Å; L579-F581 PolarHBondContact O-N 2.91Å; F581-Y584 PolarHBondContact O-N 3.33Å; F581-S585 VanDerWaalsContact O-CB 3.32Å; F581-S585 WeakPolarHBondContact O-CB 3.5Å; F581-S585 PolarHBondContact O-N 2.78Å
582	T	64.9	Low	59.9	Low	73 Å²	73	83.1 Å²	83.1	45%	0.448	45%	0.45	S	S	.	.	H	α-helix	trans	-69.7	-41.4	175.4	50.8	0	0	0	0	112.5	L578 L579 Y584 S585 A586	L578-T582 WeakPolarHBondContact O-CG2 3.17Å; L578-T582 PolarHBondContact O-N 2.96Å; L578-T582 PolarHBondContact O-OG1 3.06Å; L579-T582 WeakPolarHBondContact CA-OG1 3.38Å; L579-T582 PolarHBondContact O-N 2.9Å; L579-T582 PolarHBondContact O-OG1 3.07Å; T582-Y584 VanDerWaalsContact C-N 3.3Å; T582-Y584 PolarHBondContact O-N 3.18Å; T582-S585 PolarHBondContact O-N 3Å; T582-A586 VanDerWaalsContact O-CB 3.31Å; T582-A586 WeakPolarHBondContact O-CB 3.43Å; T582-A586 PolarHBondContact O-N 2.74Å
583	I	63.5	Low	59.7	Low	45 Å²	45	86.4 Å²	86.4	23%	0.231	48%	0.477	C	S	.	.	H	α-helix	trans	-59.7	-44.5	172.5	-67.1	167.3	0	0	0	109.8	L579 A586 V587	L579-I583 HydrophobicContact CD2-CD1 3.86Å; L579-I583 HydrophobicContact CG-CD1 4.1Å; L579-I583 WeakPolarHBondContact O-CB 3.21Å; L579-I583 VanDerWaalsContact O-CG1 3.28Å; L579-I583 WeakPolarHBondContact O-CG1 3.48Å; L579-I583 PolarHBondContact O-N 3.09Å; I583-A586 PolarHBondContact O-N 2.77Å; I583-V587 HydrophobicContact CG2-CG2 4.28Å; I583-V587 WeakPolarHBondContact O-CB 3.28Å; I583-V587 VanDerWaalsContact O-CG2 3.24Å; I583-V587 WeakPolarHBondContact O-CG2 3.41Å; I583-V587 PolarHBondContact O-N 2.99Å
584	Y	57.4	Low	59.9	Low	75 Å²	75	87.9 Å²	87.9	29%	0.294	48%	0.482	S	S	.	.	H	α-helix	trans	-61.8	-47.4	175.2	-177.9	-89.5	0	0	0	112.8	S580 F581 T582 A586 V587 S588 H603 I689	S580-Y584 VanDerWaalsContact O-CB 3.27Å; S580-Y584 WeakPolarHBondContact O-CB 3.32Å; S580-Y584 PolarHBondContact O-N 3.43Å; F581-Y584 PolarHBondContact O-N 3.33Å; T582-Y584 VanDerWaalsContact C-N 3.3Å; T582-Y584 PolarHBondContact O-N 3.18Å; Y584-A586 VanDerWaalsContact C-N 3.3Å; Y584-A586 PolarHBondContact O-N 3.07Å; Y584-V587 PolarHBondContact O-N 2.82Å; Y584-S588 WeakPolarHBondContact O-CB 3.45Å; Y584-S588 PolarHBondContact O-N 3.03Å; Y584-H603 AromaticContact CD2-CE1 3.52Å; Y584-H603 AromaticContact CD2-NE2 3.26Å; Y584-H603 VanDerWaalsContact CD2-NE2 3.26Å; Y584-H603 WeakPolarHBondContact CD2-NE2 3.44Å; Y584-H603 AromaticContact CE2-NE2 3.83Å; Y584-I689 HydrophobicContact CE2-CD1 4.39Å
585	S	62.9	Low	59.9	Low	66 Å²	66	85.8 Å²	85.8	46%	0.462	47%	0.468	S	S	.	.	H	α-helix	trans	-59.7	-42.1	176.8	-171.5	0	0	0	0	111.5	F581 T582 S588 F589	F581-S585 VanDerWaalsContact O-CB 3.32Å; F581-S585 WeakPolarHBondContact O-CB 3.5Å; F581-S585 PolarHBondContact O-N 2.78Å; T582-S585 PolarHBondContact O-N 3Å; S585-S588 PolarHBondContact O-N 3.34Å; S585-F589 VanDerWaalsContact O-CB 3.31Å; S585-F589 WeakPolarHBondContact O-CB 3.42Å; S585-F589 PolarHBondContact O-N 3.15Å
586	A	63.7	Low	60	Low	57 Å²	57	81.3 Å²	81.3	47%	0.471	45%	0.446	S	S	.	.	H	α-helix	trans	-66.7	-43.3	177.2	0	0	0	0	0	112.8	T582 I583 Y584 F589 M590	T582-A586 VanDerWaalsContact O-CB 3.31Å; T582-A586 WeakPolarHBondContact O-CB 3.43Å; T582-A586 PolarHBondContact O-N 2.74Å; I583-A586 PolarHBondContact O-N 2.77Å; Y584-A586 VanDerWaalsContact C-N 3.3Å; Y584-A586 PolarHBondContact O-N 3.07Å; A586-F589 PolarHBondContact O-N 2.89Å; A586-M590 WeakPolarHBondContact O-CG 3.37Å; A586-M590 PolarHBondContact O-N 2.9Å; A586-M590 VanDerWaalsContact O-N 3.1Å
587	V	59.5	Low	59.9	Low	31 Å²	31	82 Å²	82	19%	0.188	45%	0.449	C	S	.	.	H	α-helix	trans	-68.2	-38.4	176.6	169.4	0	0	0	0	111.4	I583 Y584 M590 L602	I583-V587 HydrophobicContact CG2-CG2 4.28Å; I583-V587 WeakPolarHBondContact O-CB 3.28Å; I583-V587 VanDerWaalsContact O-CG2 3.24Å; I583-V587 WeakPolarHBondContact O-CG2 3.41Å; I583-V587 PolarHBondContact O-N 2.99Å; Y584-V587 PolarHBondContact O-N 2.82Å; V587-M590 PolarHBondContact O-N 2.82Å; V587-L602 HydrophobicContact CG1-CD2 3.64Å; V587-L602 HydrophobicContact CG1-CG 4.43Å; V587-L602 HydrophobicContact CG2-CD2 4.09Å; V587-L602 HydrophobicContact CG2-CG 4.44Å
588	S	58.1	Low	60.2	Low	63 Å²	63	79.7 Å²	79.7	44%	0.441	44%	0.444	S	S	.	.	H	α-helix	trans	-63.2	-44.2	174.3	172	0	0	0	0	111.5	Y584 S585 M590 G591	Y584-S588 WeakPolarHBondContact O-CB 3.45Å; Y584-S588 PolarHBondContact O-N 3.03Å; S585-S588 PolarHBondContact O-N 3.34Å; S588-M590 PolarHBondContact O-N 3.05Å; S588-G591 PolarHBondContact O-N 2.95Å
589	F	60.9	Low	60.1	Low	188 Å²	188	76.7 Å²	76.7	83%	0.825	43%	0.426	S	S	*	.	H	α-helix	trans	-62	-33.9	175	-170.5	-98.1	0	0	0	112	S585 A586 G591	S585-F589 VanDerWaalsContact O-CB 3.31Å; S585-F589 WeakPolarHBondContact O-CB 3.42Å; S585-F589 PolarHBondContact O-N 3.15Å; A586-F589 PolarHBondContact O-N 2.89Å; F589-G591 PolarHBondContact O-N 3.25Å
590	M	57.5	Low	60.3	Low	165 Å²	165	74.3 Å²	74.3	81%	0.813	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	11.7	179.5	-74.6	-120	-135.9	0	0	115.8	A586 V587 S588	A586-M590 WeakPolarHBondContact O-CG 3.37Å; A586-M590 PolarHBondContact O-N 2.9Å; A586-M590 VanDerWaalsContact O-N 3.1Å; V587-M590 PolarHBondContact O-N 2.82Å; S588-M590 PolarHBondContact O-N 3.05Å
591	G	50	Low	60.6	Low	22 Å²	22	77.7 Å²	77.7	23%	0.227	43%	0.429	C	S	.	.			trans	142.2	134.1	147	0	0	0	0	0	116.7	S588 F589 A593	S588-G591 PolarHBondContact O-N 2.95Å; F589-G591 PolarHBondContact O-N 3.25Å; G591-A593 PolarHBondContact O-N 2.63Å
592	N	51.1	Low	61	Low	163 Å²	163	74.3 Å²	74.3	87%	0.872	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	15.5	166.1	-74.9	-25.2	0	0	0	114.2
593	A	54.7	Low	61.1	Low	96 Å²	96	71.9 Å²	71.9	79%	0.793	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.1	-9	-174.2	0	0	0	0	0	115.1	G591	G591-A593 PolarHBondContact O-N 2.63Å
594	L	60.2	Low	61.3	Low	74 Å²	74	74 Å²	74	39%	0.387	41%	0.412	S	S	.	.	S	Bend	trans	-86.3	137	179.8	-88.6	80.1	0	0	0	112.5	K598 K599 L602	L594-K598 HydrophobicContact CB-CB 4.42Å; L594-K598 HydrophobicContact CD2-CB 3.94Å; L594-K598 HydrophobicContact CG-CB 4.37Å; L594-K599 HydrophobicContact CB-CG 4.01Å; L594-K599 VanDerWaalsContact O-CE 3.29Å; L594-K599 WeakPolarHBondContact O-CE 3.3Å; L594-L602 HydrophobicContact CD2-CD2 4.44Å
595	S	62.2	Low	61.9	Low	41 Å²	41	74.7 Å²	74.7	29%	0.287	42%	0.42	S	S	.	.			trans	-63	155.7	170.6	72.3	0	0	0	0	111.5	S597 K598 K599 D730	S595-S597 VanDerWaalsContact C-N 3.29Å; S595-S597 PolarHBondContact O-N 3.3Å; S595-S597 PolarHBondContact OG-OG 3.11Å; S595-S597 VanDerWaalsContact OG-OG 3.07Å; S595-K598 PolarHBondContact O-N 2.84Å; S595-K598 VanDerWaalsContact O-N 3.09Å; S595-K598 WeakPolarHBondContact OG-CG 3.27Å; S595-K599 PolarHBondContact O-N 3.39Å; S595-D730 WeakPolarHBondContact CB-OD2 3.34Å
596	V	61.9	Low	62.2	Low	24 Å²	24	72.9 Å²	72.9	15%	0.145	41%	0.408	C	S	.	.	H	α-helix	trans	-59.8	-41.3	-175.6	177.4	0	0	0	0	111.1	K598 K599 V600 I689 E693 W733	V596-K598 VanDerWaalsContact C-N 3.31Å; V596-K598 PolarHBondContact O-N 3.49Å; V596-K599 PolarHBondContact O-N 3.16Å; V596-V600 WeakPolarHBondContact O-CG2 3.09Å; V596-V600 PolarHBondContact O-N 3.1Å; V596-I689 HydrophobicContact CG1-CG2 3.78Å; V596-I689 HydrophobicContact CG2-CG2 4.11Å; V596-E693 HydrophobicContact CG2-CB 4.25Å; V596-E693 HydrophobicContact CG2-CG 3.87Å; V596-W733 HydrophobicContact CG1-CZ3 4.43Å
597	S	62.5	Low	62.4	Low	26 Å²	26	71 Å²	71	18%	0.182	39%	0.391	C	S	.	.	H	α-helix	trans	-57.7	-44	175.8	59.8	0	0	0	0	111.9	S595 V600 L601 D730	S595-S597 VanDerWaalsContact C-N 3.29Å; S595-S597 PolarHBondContact O-N 3.3Å; S595-S597 PolarHBondContact OG-OG 3.11Å; S595-S597 VanDerWaalsContact OG-OG 3.07Å; S597-V600 PolarHBondContact O-N 3.41Å; S597-L601 VanDerWaalsContact O-CB 3.32Å; S597-L601 WeakPolarHBondContact O-CB 3.21Å; S597-L601 PolarHBondContact O-N 3.12Å; S597-D730 VanDerWaalsContact CB-OD1 3.31Å; S597-D730 WeakPolarHBondContact CB-OD1 3.32Å; S597-D730 PolarHBondContact N-OD2 3.4Å; S597-D730 PolarHBondContact OG-OD1 3.04Å; S597-D730 PolarHBondContact OG-OD2 2.9Å; S597-D730 VanDerWaalsContact OG-OD2 3.12Å
598	K	65.2	Low	62.8	Low	125 Å²	125	75 Å²	75	54%	0.543	41%	0.411	S	S	.	.	H	α-helix	trans	-69.2	-37.8	178.7	-68.1	178.7	-178.8	-179.6	0	112.2	L594 S595 V596 L601 L602	L594-K598 HydrophobicContact CB-CB 4.42Å; L594-K598 HydrophobicContact CD2-CB 3.94Å; L594-K598 HydrophobicContact CG-CB 4.37Å; S595-K598 PolarHBondContact O-N 2.84Å; S595-K598 VanDerWaalsContact O-N 3.09Å; S595-K598 WeakPolarHBondContact OG-CG 3.27Å; V596-K598 VanDerWaalsContact C-N 3.31Å; V596-K598 PolarHBondContact O-N 3.49Å; K598-L601 PolarHBondContact O-N 3.44Å; K598-L602 WeakPolarHBondContact O-CB 3.1Å; K598-L602 PolarHBondContact O-N 3.37Å
599	K	62.5	Low	63.6	Low	50 Å²	50	78.3 Å²	78.3	22%	0.217	42%	0.421	C	S	.	.	H	α-helix	trans	-60.6	-46	172.7	-70	-179.9	179.3	176.9	0	111.1	L594 S595 V596 L602 H603	L594-K599 HydrophobicContact CB-CG 4.01Å; L594-K599 VanDerWaalsContact O-CE 3.29Å; L594-K599 WeakPolarHBondContact O-CE 3.3Å; S595-K599 PolarHBondContact O-N 3.39Å; V596-K599 PolarHBondContact O-N 3.16Å; K599-L602 PolarHBondContact O-N 2.68Å; K599-H603 PolarHBondContact O-CD2 3.43Å; K599-H603 PolarHBondContact O-N 2.98Å
600	V	66.2	Low	63.9	Low	8 Å²	8	72.3 Å²	72.3	5%	0.048	39%	0.394	C	S	.	.	H	α-helix	trans	-67.9	-42	178.9	176.3	0	0	0	0	111.8	V596 S597 H603 L604 W733	V596-V600 WeakPolarHBondContact O-CG2 3.09Å; V596-V600 PolarHBondContact O-N 3.1Å; S597-V600 PolarHBondContact O-N 3.41Å; V600-H603 WeakPolarHBondContact O-CB 3.29Å; V600-H603 PolarHBondContact O-N 2.96Å; V600-L604 HydrophobicContact CG1-CD1 4.09Å; V600-L604 HydrophobicContact CG1-CG 4.49Å; V600-L604 WeakPolarHBondContact O-CG 3.12Å; V600-L604 PolarHBondContact O-N 2.92Å; V600-W733 HydrophobicContact CB-CH2 4.13Å; V600-W733 HydrophobicContact CB-CZ2 4.13Å; V600-W733 HydrophobicContact CG1-CH2 4.14Å; V600-W733 HydrophobicContact CG1-CZ2 3.81Å; V600-W733 HydrophobicContact CG2-CH2 3.88Å; V600-W733 HydrophobicContact CG2-CZ2 4.37Å
601	L	66.8	Low	64.4	Low	98 Å²	98	66 Å²	66	51%	0.513	37%	0.365	S	S	.	.	H	α-helix	trans	-62	-44.3	175.6	-177.2	64.3	0	0	0	111.2	S597 K598 H603 L604 L605	S597-L601 VanDerWaalsContact O-CB 3.32Å; S597-L601 WeakPolarHBondContact O-CB 3.21Å; S597-L601 PolarHBondContact O-N 3.12Å; K598-L601 PolarHBondContact O-N 3.44Å; L601-H603 VanDerWaalsContact C-N 3.29Å; L601-H603 PolarHBondContact O-N 3.29Å; L601-L604 PolarHBondContact O-N 2.84Å; L601-L605 HydrophobicContact CD1-CD1 4.36Å; L601-L605 HydrophobicContact CD1-CG 4.39Å; L601-L605 HydrophobicContact CG-CD1 3.96Å; L601-L605 HydrophobicContact CG-CG 4.42Å; L601-L605 WeakPolarHBondContact O-CB 3.36Å; L601-L605 VanDerWaalsContact O-CG 3.28Å; L601-L605 WeakPolarHBondContact O-CG 3.39Å; L601-L605 PolarHBondContact O-N 2.98Å
602	L	68.3	Low	65.3	Low	70 Å²	70	67.3 Å²	67.3	37%	0.366	37%	0.374	S	S	.	.	H	α-helix	trans	-62.6	-38.5	176.6	-173.2	62.6	0	0	0	111.3	V587 L594 K598 K599 S606	V587-L602 HydrophobicContact CG1-CD2 3.64Å; V587-L602 HydrophobicContact CG1-CG 4.43Å; V587-L602 HydrophobicContact CG2-CD2 4.09Å; V587-L602 HydrophobicContact CG2-CG 4.44Å; L594-L602 HydrophobicContact CD2-CD2 4.44Å; K598-L602 WeakPolarHBondContact O-CB 3.1Å; K598-L602 PolarHBondContact O-N 3.37Å; K599-L602 PolarHBondContact O-N 2.68Å; L602-S606 VanDerWaalsContact O-CB 3.28Å; L602-S606 WeakPolarHBondContact O-CB 3.37Å; L602-S606 PolarHBondContact O-N 3.2Å; L602-S606 PolarHBondContact O-OG 3.05Å
603	H	67.6	Low	66.3	Low	23 Å²	23	67.2 Å²	67.2	11%	0.106	37%	0.366	C	S	.	.	H	α-helix	trans	-63.2	-47.5	172	-87.1	-57.9	0	0	0	113.1	Y584 K599 V600 L601 L605 S606 S607	Y584-H603 AromaticContact CD2-CE1 3.52Å; Y584-H603 AromaticContact CD2-NE2 3.26Å; Y584-H603 VanDerWaalsContact CD2-NE2 3.26Å; Y584-H603 WeakPolarHBondContact CD2-NE2 3.44Å; Y584-H603 AromaticContact CE2-NE2 3.83Å; K599-H603 PolarHBondContact O-CD2 3.43Å; K599-H603 PolarHBondContact O-N 2.98Å; V600-H603 WeakPolarHBondContact O-CB 3.29Å; V600-H603 PolarHBondContact O-N 2.96Å; L601-H603 VanDerWaalsContact C-N 3.29Å; L601-H603 PolarHBondContact O-N 3.29Å; H603-L605 VanDerWaalsContact C-N 3.33Å; H603-L605 PolarHBondContact O-N 3.31Å; H603-S606 WeakPolarHBondContact CA-OG 3.4Å; H603-S606 PolarHBondContact O-N 2.87Å; H603-S606 PolarHBondContact O-OG 2.9Å; H603-S607 WeakPolarHBondContact O-CB 3.39Å; H603-S607 PolarHBondContact O-N 2.9Å
604	L	68.1	Low	67	Low	89 Å²	89	64.5 Å²	64.5	47%	0.466	34%	0.338	S	S	.	.	H	α-helix	trans	-60.2	-44.3	176.8	-74.5	167.3	0	0	0	111.4	V600 L601 S607 L608 V682	V600-L604 HydrophobicContact CG1-CD1 4.09Å; V600-L604 HydrophobicContact CG1-CG 4.49Å; V600-L604 WeakPolarHBondContact O-CG 3.12Å; V600-L604 PolarHBondContact O-N 2.92Å; L601-L604 PolarHBondContact O-N 2.84Å; L604-S607 PolarHBondContact O-N 3.13Å; L604-L608 WeakPolarHBondContact O-CB 3.47Å; L604-L608 PolarHBondContact O-N 2.79Å; L604-V682 HydrophobicContact CD2-CG1 3.89Å; L604-V682 HydrophobicContact CG-CG1 4.2Å
605	L	69.7	Low	67.5	Low	89 Å²	89	62.7 Å²	62.7	47%	0.466	33%	0.331	S	S	.	.	H	α-helix	trans	-64.2	-45.5	176.3	-72.1	170.7	0	0	0	111.4	L601 H603 S607 L608 M609	L601-L605 HydrophobicContact CD1-CD1 4.36Å; L601-L605 HydrophobicContact CD1-CG 4.39Å; L601-L605 HydrophobicContact CG-CD1 3.96Å; L601-L605 HydrophobicContact CG-CG 4.42Å; L601-L605 WeakPolarHBondContact O-CB 3.36Å; L601-L605 VanDerWaalsContact O-CG 3.28Å; L601-L605 WeakPolarHBondContact O-CG 3.39Å; L601-L605 PolarHBondContact O-N 2.98Å; H603-L605 VanDerWaalsContact C-N 3.33Å; H603-L605 PolarHBondContact O-N 3.31Å; L605-S607 VanDerWaalsContact C-N 3.32Å; L605-S607 PolarHBondContact O-N 2.93Å; L605-L608 PolarHBondContact O-N 3.28Å; L605-M609 WeakPolarHBondContact O-CB 3.21Å; L605-M609 VanDerWaalsContact O-CG 3.23Å; L605-M609 WeakPolarHBondContact O-CG 3.42Å; L605-M609 PolarHBondContact O-N 2.84Å
606	S	68.9	Low	67.9	Low	29 Å²	29	63.4 Å²	63.4	20%	0.203	34%	0.34	C	S	.	.	H	α-helix	trans	-62.1	-40	177.6	71	0	0	0	0	112	L602 H603 F610	L602-S606 VanDerWaalsContact O-CB 3.28Å; L602-S606 WeakPolarHBondContact O-CB 3.37Å; L602-S606 PolarHBondContact O-N 3.2Å; L602-S606 PolarHBondContact O-OG 3.05Å; H603-S606 WeakPolarHBondContact CA-OG 3.4Å; H603-S606 PolarHBondContact O-N 2.87Å; H603-S606 PolarHBondContact O-OG 2.9Å; S606-F610 VanDerWaalsContact O-CB 3.32Å; S606-F610 WeakPolarHBondContact O-CB 3.35Å; S606-F610 PolarHBondContact O-N 2.8Å
607	S	68	Low	68.3	Low	18 Å²	18	64.1 Å²	64.1	13%	0.126	35%	0.348	C	S	.	.	H	α-helix	trans	-64	-45.3	173.9	177.3	0	0	0	0	111.4	H603 L604 L605 F610 T611 T678	H603-S607 WeakPolarHBondContact O-CB 3.39Å; H603-S607 PolarHBondContact O-N 2.9Å; L604-S607 PolarHBondContact O-N 3.13Å; L605-S607 VanDerWaalsContact C-N 3.32Å; L605-S607 PolarHBondContact O-N 2.93Å; S607-F610 PolarHBondContact O-N 3.14Å; S607-T611 PolarHBondContact O-N 3.43Å; S607-T611 PolarHBondContact O-OG1 3.35Å; S607-T678 WeakPolarHBondContact OG-CG2 3.44Å
608	L	68.5	Low	68.4	Low	115 Å²	115	63 Å²	63	60%	0.602	34%	0.341	S	S	*	.	H	α-helix	trans	-63.9	-46.1	-178.8	-162.9	109.8	0	0	0	110.7	L604 L605 F610 T611 A612	L604-L608 WeakPolarHBondContact O-CB 3.47Å; L604-L608 PolarHBondContact O-N 2.79Å; L605-L608 PolarHBondContact O-N 3.28Å; L608-F610 VanDerWaalsContact C-N 3.33Å; L608-F610 PolarHBondContact O-N 3.33Å; L608-T611 VanDerWaalsContact CA-OG1 3.31Å; L608-T611 WeakPolarHBondContact CA-OG1 3.28Å; L608-T611 PolarHBondContact O-N 3.32Å; L608-T611 PolarHBondContact O-OG1 3.07Å; L608-A612 WeakPolarHBondContact O-CB 3.42Å; L608-A612 PolarHBondContact O-N 2.81Å
609	M	74	Confident	68.4	Low	132 Å²	132	58 Å²	58	65%	0.65	32%	0.32	S	S	*	.	H	α-helix	trans	-60.3	-42.6	175.3	-71.8	-60.3	-65.6	0	0	111.5	L605 A612 F613	L605-M609 WeakPolarHBondContact O-CB 3.21Å; L605-M609 VanDerWaalsContact O-CG 3.23Å; L605-M609 WeakPolarHBondContact O-CG 3.42Å; L605-M609 PolarHBondContact O-N 2.84Å; M609-A612 PolarHBondContact O-N 2.94Å; M609-F613 WeakPolarHBondContact O-CB 3.37Å; M609-F613 PolarHBondContact O-N 3.17Å
610	F	68.5	Low	68.7	Low	61 Å²	61	61.5 Å²	61.5	27%	0.268	33%	0.333	S	S	.	.	H	α-helix	trans	-67.2	-42	177.3	-174.6	-106.7	0	0	0	112.4	L579 S606 S607 L608 A612 F613 L614 F674	L579-F610 HydrophobicContact CD1-CE2 4.37Å; L579-F610 HydrophobicContact CD1-CZ 4.49Å; L579-F610 HydrophobicContact CD2-CD1 3.71Å; L579-F610 HydrophobicContact CD2-CD2 3.67Å; L579-F610 HydrophobicContact CD2-CE1 3.37Å; L579-F610 HydrophobicContact CD2-CE2 3.36Å; L579-F610 HydrophobicContact CD2-CG 3.85Å; L579-F610 HydrophobicContact CD2-CZ 3.22Å; L579-F610 HydrophobicContact CG-CE2 4.5Å; L579-F610 HydrophobicContact CG-CZ 4.43Å; S606-F610 VanDerWaalsContact O-CB 3.32Å; S606-F610 WeakPolarHBondContact O-CB 3.35Å; S606-F610 PolarHBondContact O-N 2.8Å; S607-F610 PolarHBondContact O-N 3.14Å; L608-F610 VanDerWaalsContact C-N 3.33Å; L608-F610 PolarHBondContact O-N 3.33Å; F610-A612 VanDerWaalsContact C-N 3.3Å; F610-A612 PolarHBondContact O-N 3.12Å; F610-F613 PolarHBondContact O-N 2.75Å; F610-L614 HydrophobicContact CD1-CD1 3.74Å; F610-L614 HydrophobicContact CD1-CG 4.42Å; F610-L614 HydrophobicContact CE1-CD1 3.14Å; F610-L614 HydrophobicContact CE1-CG 3.87Å; F610-L614 HydrophobicContact CE2-CG 4.42Å; F610-L614 HydrophobicContact CZ-CD1 3.59Å; F610-L614 HydrophobicContact CZ-CD2 4.38Å; F610-L614 HydrophobicContact CZ-CG 3.83Å; F610-L614 PolarHBondContact O-N 3.18Å; F610-F674 AromaticContact CD1-CE1 3.98Å; F610-F674 HydrophobicContact CD1-CE1 3.98Å; F610-F674 AromaticContact CD1-CZ 3.92Å; F610-F674 HydrophobicContact CD1-CZ 3.92Å; F610-F674 AromaticContact CE1-CE1 3.96Å; F610-F674 HydrophobicContact CE1-CE1 3.96Å; F610-F674 HydrophobicContact CE1-CE2 4.48Å; F610-F674 AromaticContact CE1-CZ 3.58Å; F610-F674 HydrophobicContact CE1-CZ 3.58Å
611	T	68	Low	68.5	Low	33 Å²	33	66 Å²	66	20%	0.202	36%	0.355	C	S	.	.	H	α-helix	trans	-63.3	-36.5	173.8	40.3	0	0	0	0	112.6	S607 L608 S615 F674 L675	S607-T611 PolarHBondContact O-N 3.43Å; S607-T611 PolarHBondContact O-OG1 3.35Å; L608-T611 VanDerWaalsContact CA-OG1 3.31Å; L608-T611 WeakPolarHBondContact CA-OG1 3.28Å; L608-T611 PolarHBondContact O-N 3.32Å; L608-T611 PolarHBondContact O-OG1 3.07Å; T611-S615 WeakPolarHBondContact O-CB 3.38Å; T611-S615 PolarHBondContact O-N 3.3Å; T611-S615 PolarHBondContact O-OG 2.89Å; T611-F674 HydrophobicContact CG2-CD1 4.44Å; T611-F674 HydrophobicContact CG2-CE1 4.35Å; T611-L675 HydrophobicContact CG2-CD1 3.94Å
612	A	68.8	Low	68.2	Low	49 Å²	49	62 Å²	62	41%	0.405	33%	0.334	S	S	.	.	H	α-helix	trans	-67.3	-37.7	173.7	0	0	0	0	0	111.8	L608 M609 F610 S615 A616	L608-A612 WeakPolarHBondContact O-CB 3.42Å; L608-A612 PolarHBondContact O-N 2.81Å; M609-A612 PolarHBondContact O-N 2.94Å; F610-A612 VanDerWaalsContact C-N 3.3Å; F610-A612 PolarHBondContact O-N 3.12Å; A612-S615 WeakPolarHBondContact CA-OG 3.43Å; A612-S615 PolarHBondContact O-OG 3Å; A612-A616 VanDerWaalsContact O-CB 3.26Å; A612-A616 WeakPolarHBondContact O-CB 3.11Å; A612-A616 PolarHBondContact O-N 3.18Å
613	F	72.8	Confident	67.8	Low	162 Å²	162	60.1 Å²	60.1	71%	0.711	33%	0.325	S	S	*	.	H	α-helix	trans	-69.1	-41.7	176.9	-150.1	-86.5	0	0	0	111.7	M609 F610 A616 A617	M609-F613 WeakPolarHBondContact O-CB 3.37Å; M609-F613 PolarHBondContact O-N 3.17Å; F610-F613 PolarHBondContact O-N 2.75Å; F613-A616 PolarHBondContact O-N 3.11Å; F613-A617 VanDerWaalsContact O-CB 3.27Å; F613-A617 WeakPolarHBondContact O-CB 3.38Å; F613-A617 PolarHBondContact O-N 3.34Å
614	L	69.1	Low	67.4	Low	38 Å²	38	67.8 Å²	67.8	20%	0.199	35%	0.353	C	S	.	.	H	α-helix	trans	-63.3	-45.1	172.9	-87.1	170.3	0	0	0	111.7	F610 A616 A617 T618 M671 F674	F610-L614 HydrophobicContact CD1-CD1 3.74Å; F610-L614 HydrophobicContact CD1-CG 4.42Å; F610-L614 HydrophobicContact CE1-CD1 3.14Å; F610-L614 HydrophobicContact CE1-CG 3.87Å; F610-L614 HydrophobicContact CE2-CG 4.42Å; F610-L614 HydrophobicContact CZ-CD1 3.59Å; F610-L614 HydrophobicContact CZ-CD2 4.38Å; F610-L614 HydrophobicContact CZ-CG 3.83Å; F610-L614 PolarHBondContact O-N 3.18Å; L614-A616 VanDerWaalsContact C-N 3.35Å; L614-A617 PolarHBondContact O-N 2.78Å; L614-T618 WeakPolarHBondContact O-CB 3.27Å; L614-T618 PolarHBondContact O-N 2.92Å; L614-T618 PolarHBondContact O-OG1 2.84Å; L614-M671 HydrophobicContact CB-SD 4.19Å; L614-M671 HydrophobicContact CD1-SD 4.24Å; L614-F674 HydrophobicContact CD1-CD1 4.48Å; L614-F674 HydrophobicContact CD1-CE1 4.15Å; L614-F674 HydrophobicContact CD1-CZ 4.45Å
615	S	69.7	Low	66.8	Low	36 Å²	36	66.9 Å²	66.9	25%	0.252	36%	0.359	S	S	.	.	H	α-helix	trans	-63.8	-41.5	177.7	65.5	0	0	0	0	111.3	T611 A612 T618 V619	T611-S615 WeakPolarHBondContact O-CB 3.38Å; T611-S615 PolarHBondContact O-N 3.3Å; T611-S615 PolarHBondContact O-OG 2.89Å; A612-S615 WeakPolarHBondContact CA-OG 3.43Å; A612-S615 PolarHBondContact O-OG 3Å; S615-T618 WeakPolarHBondContact O-CB 3.41Å; S615-T618 PolarHBondContact O-N 3.33Å; S615-V619 WeakPolarHBondContact O-CG2 3.41Å; S615-V619 PolarHBondContact O-N 2.89Å
616	A	71.2	Confident	66.1	Low	57 Å²	57	64.7 Å²	64.7	47%	0.471	35%	0.349	S	S	.	.	H	α-helix	trans	-63.3	-46.3	174.5	0	0	0	0	0	112.4	A612 F613 L614 T618 V619 Y620	A612-A616 VanDerWaalsContact O-CB 3.26Å; A612-A616 WeakPolarHBondContact O-CB 3.11Å; A612-A616 PolarHBondContact O-N 3.18Å; F613-A616 PolarHBondContact O-N 3.11Å; L614-A616 VanDerWaalsContact C-N 3.35Å; A616-T618 PolarHBondContact O-N 2.84Å; A616-V619 PolarHBondContact O-N 2.9Å; A616-Y620 WeakPolarHBondContact O-CB 3.48Å; A616-Y620 PolarHBondContact O-N 3.48Å
617	A	70.2	Confident	65.7	Low	38 Å²	38	63.9 Å²	63.9	31%	0.314	34%	0.343	S	S	.	.	H	α-helix	trans	-60.8	-35	174.8	0	0	0	0	0	111.7	F613 L614 Y620 I621	F613-A617 VanDerWaalsContact O-CB 3.27Å; F613-A617 WeakPolarHBondContact O-CB 3.38Å; F613-A617 PolarHBondContact O-N 3.34Å; L614-A617 PolarHBondContact O-N 2.78Å; A617-Y620 PolarHBondContact O-N 2.8Å; A617-I621 VanDerWaalsContact O-CG1 3.24Å; A617-I621 WeakPolarHBondContact O-CG1 3.34Å; A617-I621 PolarHBondContact O-N 3.36Å
618	T	65.2	Low	65.5	Low	4 Å²	4	69 Å²	69	3%	0.025	37%	0.369	C	S	.	.	H	α-helix	trans	-68.2	-50.2	176.7	-54.2	0	0	0	0	111.3	L614 S615 A616 Y620 I621 I622 F637 Y667	L614-T618 WeakPolarHBondContact O-CB 3.27Å; L614-T618 PolarHBondContact O-N 2.92Å; L614-T618 PolarHBondContact O-OG1 2.84Å; S615-T618 WeakPolarHBondContact O-CB 3.41Å; S615-T618 PolarHBondContact O-N 3.33Å; A616-T618 PolarHBondContact O-N 2.84Å; T618-Y620 PolarHBondContact O-N 2.8Å; T618-I621 PolarHBondContact O-N 2.92Å; T618-I621 VanDerWaalsContact O-N 3.14Å; T618-I622 HydrophobicContact CG2-CD1 3.84Å; T618-I622 HydrophobicContact CG2-CG1 4.38Å; T618-I622 VanDerWaalsContact O-CG1 3.29Å; T618-I622 WeakPolarHBondContact O-CG1 3.36Å; T618-I622 PolarHBondContact O-N 2.82Å; T618-F637 HydrophobicContact CG2-CD2 3.77Å; T618-F637 HydrophobicContact CG2-CE2 3.99Å; T618-Y667 HydrophobicContact CG2-CD1 3.57Å; T618-Y667 HydrophobicContact CG2-CE1 3.15Å; T618-Y667 WeakPolarHBondContact OG1-CE1 3.23Å; T618-Y667 PolarHBondContact OG1-OH 2.84Å
619	V	65.4	Low	65.3	Low	19 Å²	19	65.7 Å²	65.7	12%	0.115	36%	0.355	C	S	.	.	H	α-helix	trans	-57.1	-40.9	175.3	169.2	0	0	0	0	109.9	S615 A616 I622 D623 V630 A633 I634 F637	S615-V619 WeakPolarHBondContact O-CG2 3.41Å; S615-V619 PolarHBondContact O-N 2.89Å; A616-V619 PolarHBondContact O-N 2.9Å; V619-I622 PolarHBondContact O-N 3.22Å; V619-D623 VanDerWaalsContact O-CB 3.31Å; V619-D623 WeakPolarHBondContact O-CB 3.41Å; V619-D623 PolarHBondContact O-N 2.85Å; V619-V630 HydrophobicContact CG1-CG1 4.23Å; V619-A633 HydrophobicContact CG1-CB 4.02Å; V619-I634 HydrophobicContact CG1-CG1 3.63Å; V619-I634 HydrophobicContact CG2-CG1 4.23Å; V619-F637 HydrophobicContact CG2-CB 3.94Å; V619-F637 HydrophobicContact CG2-CD1 4.22Å; V619-F637 HydrophobicContact CG2-CD2 4.48Å; V619-F637 HydrophobicContact CG2-CG 3.96Å
620	Y	68.2	Low	65.2	Low	124 Å²	124	63.2 Å²	63.2	49%	0.486	35%	0.347	S	S	.	.	H	α-helix	trans	-63.5	-43.3	175.5	-179.3	-100.4	0	0	0	113.1	A616 A617 T618 D623 R624	A616-Y620 WeakPolarHBondContact O-CB 3.48Å; A616-Y620 PolarHBondContact O-N 3.48Å; A617-Y620 PolarHBondContact O-N 2.8Å; T618-Y620 PolarHBondContact O-N 2.8Å; Y620-D623 PolarHBondContact O-N 2.76Å; Y620-R624 HydrophobicContact CD1-CG 4.35Å; Y620-R624 HydrophobicContact CD2-CG 4.47Å; Y620-R624 HydrophobicContact CE1-CG 3.9Å; Y620-R624 HydrophobicContact CE2-CG 4.04Å; Y620-R624 WeakPolarHBondContact O-CB 3.44Å; Y620-R624 WeakPolarHBondContact O-CG 3.16Å; Y620-R624 PolarHBondContact O-N 2.9Å; Y620-R624 PolarHBondContact OH-NE 3.42Å; Y620-R624 VanDerWaalsContact OH-NE 3.07Å; Y620-R624 PolarHBondContact OH-NH2 3.39Å
621	I	62.3	Low	65.3	Low	101 Å²	101	66.6 Å²	66.6	52%	0.518	37%	0.368	S	S	.	.	H	α-helix	trans	-64.7	-41.5	175.5	-69.3	164.7	0	0	0	110.5	A617 T618 R624 A625	A617-I621 VanDerWaalsContact O-CG1 3.24Å; A617-I621 WeakPolarHBondContact O-CG1 3.34Å; A617-I621 PolarHBondContact O-N 3.36Å; T618-I621 PolarHBondContact O-N 2.92Å; T618-I621 VanDerWaalsContact O-N 3.14Å; I621-R624 PolarHBondContact O-N 3.4Å; I621-A625 WeakPolarHBondContact O-CB 3.3Å; I621-A625 PolarHBondContact O-N 3.42Å
622	I	59.8	Low	64.8	Low	14 Å²	14	67.9 Å²	67.9	7%	0.072	37%	0.371	C	S	.	.	H	α-helix	trans	-63.8	-42.5	177	-68.8	169.9	0	0	0	111	T618 V619 T626 C627 A633 V636 F637	T618-I622 HydrophobicContact CG2-CD1 3.84Å; T618-I622 HydrophobicContact CG2-CG1 4.38Å; T618-I622 VanDerWaalsContact O-CG1 3.29Å; T618-I622 WeakPolarHBondContact O-CG1 3.36Å; T618-I622 PolarHBondContact O-N 2.82Å; V619-I622 PolarHBondContact O-N 3.22Å; I622-T626 PolarHBondContact O-N 3.12Å; I622-T626 PolarHBondContact O-OG1 2.85Å; I622-C627 WeakPolarHBondContact CG2-SG 3.28Å; I622-C627 PolarHBondContact O-N 2.94Å; I622-C627 VanDerWaalsContact O-N 3.13Å; I622-A633 HydrophobicContact CB-CB 4.1Å; I622-A633 HydrophobicContact CG2-CB 3.67Å; I622-V636 HydrophobicContact CG2-CB 4.34Å; I622-V636 HydrophobicContact CG2-CG1 4.13Å; I622-F637 HydrophobicContact CD1-CB 4.15Å; I622-F637 HydrophobicContact CD1-CD2 4.5Å
623	D	61	Low	64.4	Low	32 Å²	32	65.6 Å²	65.6	17%	0.171	35%	0.352	C	S	.	.	H	α-helix	trans	-60.4	-49.4	174.4	-178.5	61.7	0	0	0	110.8	V619 Y620 A625 V630 A633	V619-D623 VanDerWaalsContact O-CB 3.31Å; V619-D623 WeakPolarHBondContact O-CB 3.41Å; V619-D623 PolarHBondContact O-N 2.85Å; Y620-D623 PolarHBondContact O-N 2.76Å; D623-A625 PolarHBondContact O-N 2.94Å; D623-V630 PolarHBondContact OD1-N 3.33Å; D623-A633 HydrophobicContact CB-CB 3.82Å
624	R	59.2	Low	64	Low	183 Å²	183	61 Å²	61	69%	0.691	34%	0.335	S	S	*	.	H	α-helix	trans	-70	-30.2	179.8	-70	-62.6	-168.7	163.1	0.1	114.5	Y620 I621	Y620-R624 HydrophobicContact CD1-CG 4.35Å; Y620-R624 HydrophobicContact CD2-CG 4.47Å; Y620-R624 HydrophobicContact CE1-CG 3.9Å; Y620-R624 HydrophobicContact CE2-CG 4.04Å; Y620-R624 WeakPolarHBondContact O-CB 3.44Å; Y620-R624 WeakPolarHBondContact O-CG 3.16Å; Y620-R624 PolarHBondContact O-N 2.9Å; Y620-R624 PolarHBondContact OH-NE 3.42Å; Y620-R624 VanDerWaalsContact OH-NE 3.07Å; Y620-R624 PolarHBondContact OH-NH2 3.39Å; I621-R624 PolarHBondContact O-N 3.4Å
625	A	54.9	Low	63.5	Low	71 Å²	71	62.1 Å²	62.1	59%	0.587	34%	0.339	S	S	*	.	H	α-helix	trans	-94.4	-35.2	-173.2	0	0	0	0	0	113.6	I621 D623	I621-A625 WeakPolarHBondContact O-CB 3.3Å; I621-A625 PolarHBondContact O-N 3.42Å; D623-A625 PolarHBondContact O-N 2.94Å
626	T	54.8	Low	63	Low	43 Å²	43	60.5 Å²	60.5	26%	0.264	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.1	-20.3	-166.4	63.8	0	0	0	0	116.6	I622	I622-T626 PolarHBondContact O-N 3.12Å; I622-T626 PolarHBondContact O-OG1 2.85Å
627	C	60	Low	62.5	Low	11 Å²	11	59.6 Å²	59.6	7%	0.074	31%	0.313	C	S	.	.			trans	-112.5	155.4	-172.2	-51	0	0	0	0	111.9	I622 E632 A633 C649	I622-C627 WeakPolarHBondContact CG2-SG 3.28Å; I622-C627 PolarHBondContact O-N 2.94Å; I622-C627 VanDerWaalsContact O-N 3.13Å; C627-E632 HydrophobicContact CB-CB 4.03Å; C627-A633 HydrophobicContact CB-CB 4.17Å; C627-C649 HydrophobicContact CB-CB 4.5Å; C627-C649 VanDerWaalsContact CB-SG 3.59Å; C627-C649 PolarHBondContact SG-SG 3.35Å
628	N	63.1	Low	62.1	Low	127 Å²	127	61.8 Å²	61.8	68%	0.679	32%	0.318	S	S	*	.	S	Bend	trans	-90.6	-11.2	177.3	-67.9	-38	0	0	0	112.1	E632	N628-E632 PolarHBondContact N-OE2 2.9Å; N628-E632 VanDerWaalsContact N-OE2 3.16Å
629	S	65.8	Low	61.6	Low	44 Å²	44	65.5 Å²	65.5	31%	0.308	33%	0.333	S	S	.	.	S	Bend	trans	-146.8	151.4	179.4	71.6	0	0	0	0	112.5	L631 E632 A633	S629-L631 PolarHBondContact O-N 2.73Å; S629-E632 PolarHBondContact N-OE2 2.96Å; S629-E632 PolarHBondContact O-N 2.76Å; S629-E632 VanDerWaalsContact OG-CG 3.32Å; S629-E632 WeakPolarHBondContact OG-CG 3.34Å; S629-E632 PolarHBondContact OG-N 3.39Å; S629-E632 PolarHBondContact OG-OE2 3.29Å; S629-A633 PolarHBondContact O-N 3.18Å; S629-A633 VanDerWaalsContact O-N 3.08Å
630	V	72	Confident	61	Low	80 Å²	80	64.6 Å²	64.6	49%	0.485	33%	0.327	S	S	.	.	H	α-helix	trans	-58.7	-34	175.3	178.4	0	0	0	0	111.3	V619 D623 A633 I634	V619-V630 HydrophobicContact CG1-CG1 4.23Å; D623-V630 PolarHBondContact OD1-N 3.33Å; V630-A633 WeakPolarHBondContact O-CB 3.02Å; V630-A633 PolarHBondContact O-N 2.67Å; V630-I634 HydrophobicContact CG1-CD1 4.07Å; V630-I634 HydrophobicContact CG1-CG1 4.46Å; V630-I634 VanDerWaalsContact O-CG1 3.28Å; V630-I634 WeakPolarHBondContact O-CG1 3.25Å; V630-I634 PolarHBondContact O-N 2.78Å
631	L	69	Low	60.3	Low	132 Å²	132	60.5 Å²	60.5	69%	0.691	32%	0.316	S	S	*	.	H	α-helix	trans	-66.9	-43.5	179.8	-172.5	66.8	0	0	0	111.9	S629 A633 I634 E635	S629-L631 PolarHBondContact O-N 2.73Å; L631-A633 VanDerWaalsContact C-N 3.31Å; L631-A633 PolarHBondContact O-N 2.97Å; L631-I634 PolarHBondContact O-N 2.83Å; L631-E635 PolarHBondContact O-N 3.47Å
632	E	58.1	Low	60	Low	61 Å²	61	60.8 Å²	60.8	29%	0.285	32%	0.319	S	S	.	.	H	α-helix	trans	-62.5	-40.4	173.5	-73.3	170.3	165.8	0	0	111.1	C627 N628 S629 I634 E635 V636 C649	C627-E632 HydrophobicContact CB-CB 4.03Å; N628-E632 PolarHBondContact N-OE2 2.9Å; N628-E632 VanDerWaalsContact N-OE2 3.16Å; S629-E632 PolarHBondContact N-OE2 2.96Å; S629-E632 PolarHBondContact O-N 2.76Å; S629-E632 VanDerWaalsContact OG-CG 3.32Å; S629-E632 WeakPolarHBondContact OG-CG 3.34Å; S629-E632 PolarHBondContact OG-N 3.39Å; S629-E632 PolarHBondContact OG-OE2 3.29Å; E632-I634 VanDerWaalsContact C-N 3.34Å; E632-I634 PolarHBondContact O-N 2.85Å; E632-E635 PolarHBondContact O-N 3.2Å; E632-V636 WeakPolarHBondContact O-CB 3.22Å; E632-V636 VanDerWaalsContact O-CG2 3.28Å; E632-V636 WeakPolarHBondContact O-CG2 3.4Å; E632-V636 PolarHBondContact O-N 3.21Å; E632-C649 HydrophobicContact CB-CB 4.34Å; E632-C649 PolarHBondContact OE2-SG 3.03Å; E632-C649 VanDerWaalsContact OE2-SG 3.37Å
633	A	61	Low	59.5	Low	0 Å²	0	66.3 Å²	66.3	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-62.6	-39.4	176.5	0	0	0	0	0	112.6	V619 I622 D623 C627 S629 V630 L631 F637	V619-A633 HydrophobicContact CG1-CB 4.02Å; I622-A633 HydrophobicContact CB-CB 4.1Å; I622-A633 HydrophobicContact CG2-CB 3.67Å; D623-A633 HydrophobicContact CB-CB 3.82Å; C627-A633 HydrophobicContact CB-CB 4.17Å; S629-A633 PolarHBondContact O-N 3.18Å; S629-A633 VanDerWaalsContact O-N 3.08Å; V630-A633 WeakPolarHBondContact O-CB 3.02Å; V630-A633 PolarHBondContact O-N 2.67Å; L631-A633 VanDerWaalsContact C-N 3.31Å; L631-A633 PolarHBondContact O-N 2.97Å; A633-F637 WeakPolarHBondContact O-CB 3.46Å; A633-F637 PolarHBondContact O-N 2.92Å
634	I	64.5	Low	59	Low	67 Å²	67	70.3 Å²	70.3	34%	0.344	36%	0.362	S	S	.	.	H	α-helix	trans	-63.2	-46.2	173.1	-69.2	166.2	0	0	0	110.5	V619 V630 L631 E632 V636 F637 I638	V619-I634 HydrophobicContact CG1-CG1 3.63Å; V619-I634 HydrophobicContact CG2-CG1 4.23Å; V630-I634 HydrophobicContact CG1-CD1 4.07Å; V630-I634 HydrophobicContact CG1-CG1 4.46Å; V630-I634 VanDerWaalsContact O-CG1 3.28Å; V630-I634 WeakPolarHBondContact O-CG1 3.25Å; V630-I634 PolarHBondContact O-N 2.78Å; L631-I634 PolarHBondContact O-N 2.83Å; E632-I634 VanDerWaalsContact C-N 3.34Å; E632-I634 PolarHBondContact O-N 2.85Å; I634-V636 PolarHBondContact O-N 3.22Å; I634-F637 WeakPolarHBondContact O-CB 3.27Å; I634-F637 PolarHBondContact O-N 3.31Å; I634-I638 HydrophobicContact CG2-CD1 3.72Å; I634-I638 HydrophobicContact CG2-CG1 4.36Å; I634-I638 VanDerWaalsContact O-CG1 3.31Å; I634-I638 WeakPolarHBondContact O-CG1 3.47Å; I634-I638 PolarHBondContact O-N 3.02Å
635	E	57.5	Low	58.3	Low	61 Å²	61	63.3 Å²	63.3	29%	0.285	35%	0.347	S	S	.	.	H	α-helix	trans	-61.8	-46	-179	-175	174.9	-160.5	0	0	111.3	L631 E632 F637 I638 Y639	L631-E635 PolarHBondContact O-N 3.47Å; E632-E635 PolarHBondContact O-N 3.2Å; E635-F637 PolarHBondContact O-N 2.66Å; E635-I638 PolarHBondContact O-N 2.61Å; E635-Y639 HydrophobicContact CG-CD2 3.6Å; E635-Y639 HydrophobicContact CG-CE2 3.13Å; E635-Y639 WeakPolarHBondContact O-CD2 3.14Å; E635-Y639 PolarHBondContact O-N 3.37Å; E635-Y639 WeakPolarHBondContact OE1-CE2 3.04Å; E635-Y639 PolarHBondContact OE1-OH 3.05Å; E635-Y639 VanDerWaalsContact OE1-OH 3.14Å
636	V	59.5	Low	57.8	Low	1 Å²	1	61.9 Å²	61.9	1%	0.006	33%	0.331	C	S	.	.	H	α-helix	trans	-58.7	-45.2	173.3	169.7	0	0	0	0	111.6	I622 E632 I634 I638 G640 G647 C649 I664	I622-V636 HydrophobicContact CG2-CB 4.34Å; I622-V636 HydrophobicContact CG2-CG1 4.13Å; E632-V636 WeakPolarHBondContact O-CB 3.22Å; E632-V636 VanDerWaalsContact O-CG2 3.28Å; E632-V636 WeakPolarHBondContact O-CG2 3.4Å; E632-V636 PolarHBondContact O-N 3.21Å; I634-V636 PolarHBondContact O-N 3.22Å; V636-I638 VanDerWaalsContact C-N 3.35Å; V636-I638 PolarHBondContact O-N 3.13Å; V636-G640 PolarHBondContact O-N 2.87Å; V636-G647 VanDerWaalsContact CG2-O 3.3Å; V636-G647 WeakPolarHBondContact CG2-O 3.34Å; V636-C649 HydrophobicContact CG2-CB 3.34Å; V636-I664 HydrophobicContact CG1-CD1 3.68Å; V636-I664 HydrophobicContact CG1-CG1 4.32Å; V636-I664 HydrophobicContact CG1-CG2 3.73Å
637	F	60.9	Low	57.3	Low	39 Å²	39	60.5 Å²	60.5	17%	0.171	33%	0.326	C	S	.	.	H	α-helix	trans	-60.7	-42.6	177.1	174.7	-98.9	0	0	0	112	T618 V619 I622 A633 I634 E635 S641	T618-F637 HydrophobicContact CG2-CD2 3.77Å; T618-F637 HydrophobicContact CG2-CE2 3.99Å; V619-F637 HydrophobicContact CG2-CB 3.94Å; V619-F637 HydrophobicContact CG2-CD1 4.22Å; V619-F637 HydrophobicContact CG2-CD2 4.48Å; V619-F637 HydrophobicContact CG2-CG 3.96Å; I622-F637 HydrophobicContact CD1-CB 4.15Å; I622-F637 HydrophobicContact CD1-CD2 4.5Å; A633-F637 WeakPolarHBondContact O-CB 3.46Å; A633-F637 PolarHBondContact O-N 2.92Å; I634-F637 WeakPolarHBondContact O-CB 3.27Å; I634-F637 PolarHBondContact O-N 3.31Å; E635-F637 PolarHBondContact O-N 2.66Å; F637-S641 VanDerWaalsContact O-CB 3.22Å; F637-S641 WeakPolarHBondContact O-CB 3.34Å; F637-S641 PolarHBondContact O-N 2.85Å; F637-S641 PolarHBondContact O-OG 2.78Å
638	I	61.2	Low	56.6	Low	84 Å²	84	70 Å²	70	43%	0.431	36%	0.36	S	S	.	.	H	α-helix	trans	-65.2	-53.1	179	-68.9	167.7	0	0	0	110.7	I634 E635 V636 G640 S641 L642	I634-I638 HydrophobicContact CG2-CD1 3.72Å; I634-I638 HydrophobicContact CG2-CG1 4.36Å; I634-I638 VanDerWaalsContact O-CG1 3.31Å; I634-I638 WeakPolarHBondContact O-CG1 3.47Å; I634-I638 PolarHBondContact O-N 3.02Å; E635-I638 PolarHBondContact O-N 2.61Å; V636-I638 VanDerWaalsContact C-N 3.35Å; V636-I638 PolarHBondContact O-N 3.13Å; I638-G640 PolarHBondContact O-N 2.99Å; I638-S641 PolarHBondContact O-N 3.1Å; I638-S641 VanDerWaalsContact O-N 3.15Å; I638-L642 HydrophobicContact CG2-CD1 3.96Å; I638-L642 WeakPolarHBondContact O-CG 3.41Å; I638-L642 PolarHBondContact O-N 2.95Å
639	Y	54.7	Low	55.4	Low	82 Å²	82	64.1 Å²	64.1	32%	0.322	33%	0.328	S	S	.	.	H	α-helix	trans	-69	-35.1	-177.7	-63.1	-58	0	0	0	112.9	E635 S641 L642 F643 I644 G645 G647	E635-Y639 HydrophobicContact CG-CD2 3.6Å; E635-Y639 HydrophobicContact CG-CE2 3.13Å; E635-Y639 WeakPolarHBondContact O-CD2 3.14Å; E635-Y639 PolarHBondContact O-N 3.37Å; E635-Y639 WeakPolarHBondContact OE1-CE2 3.04Å; E635-Y639 PolarHBondContact OE1-OH 3.05Å; E635-Y639 VanDerWaalsContact OE1-OH 3.14Å; Y639-S641 VanDerWaalsContact C-N 3.31Å; Y639-L642 PolarHBondContact O-N 2.91Å; Y639-F643 PolarHBondContact O-N 2.98Å; Y639-I644 HydrophobicContact CD1-CB 4.39Å; Y639-I644 HydrophobicContact CD1-CG2 4.24Å; Y639-I644 PolarHBondContact O-N 2.8Å; Y639-G645 WeakPolarHBondContact CB-O 3.3Å; Y639-G647 VanDerWaalsContact CD2-CA 3.46Å
640	G	54	Low	54.2	Low	0 Å²	0	64.4 Å²	64.4	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-58.3	-43.8	169.8	0	0	0	0	0	111.6	V636 I638 L642 F643 S668	V636-G640 PolarHBondContact O-N 2.87Å; I638-G640 PolarHBondContact O-N 2.99Å; G640-L642 VanDerWaalsContact C-N 3.3Å; G640-L642 PolarHBondContact O-N 2.88Å; G640-F643 PolarHBondContact O-N 2.78Å; G640-F643 VanDerWaalsContact O-N 3.12Å; G640-S668 VanDerWaalsContact O-CB 3.26Å; G640-S668 WeakPolarHBondContact O-CB 3.24Å; G640-S668 PolarHBondContact O-OG 3.25Å
641	S	54	Low	52.6	Low	37 Å²	37	65.4 Å²	65.4	26%	0.259	33%	0.334	S	S	.	.	H	α-helix	trans	-68.1	-30.6	-179.4	-63.3	0	0	0	0	113.1	F637 I638 Y639 F643 S668	F637-S641 VanDerWaalsContact O-CB 3.22Å; F637-S641 WeakPolarHBondContact O-CB 3.34Å; F637-S641 PolarHBondContact O-N 2.85Å; F637-S641 PolarHBondContact O-OG 2.78Å; I638-S641 PolarHBondContact O-N 3.1Å; I638-S641 VanDerWaalsContact O-N 3.15Å; Y639-S641 VanDerWaalsContact C-N 3.31Å; S641-F643 VanDerWaalsContact C-N 3.32Å; S641-S668 VanDerWaalsContact CA-CB 3.49Å; S641-S668 WeakPolarHBondContact CA-OG 3.4Å; S641-S668 PolarHBondContact N-OG 3.43Å; S641-S668 PolarHBondContact OG-OG 2.84Å
642	L	54.8	Low	51	Low	108 Å²	108	65 Å²	65	57%	0.565	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-0.3	176.2	-65.1	169.9	0	0	0	113.2	I638 Y639 G640 I644	I638-L642 HydrophobicContact CG2-CD1 3.96Å; I638-L642 WeakPolarHBondContact O-CG 3.41Å; I638-L642 PolarHBondContact O-N 2.95Å; Y639-L642 PolarHBondContact O-N 2.91Å; G640-L642 VanDerWaalsContact C-N 3.3Å; G640-L642 PolarHBondContact O-N 2.88Å; L642-I644 HydrophobicContact CB-CB 4.43Å; L642-I644 HydrophobicContact CB-CD1 3.49Å; L642-I644 VanDerWaalsContact CB-CD1 3.49Å; L642-I644 HydrophobicContact CB-CG1 3.63Å; L642-I644 HydrophobicContact CD1-CD1 3.71Å; L642-I644 HydrophobicContact CG-CD1 4.22Å; L642-I644 PolarHBondContact O-N 3.28Å
643	F	49.5	Very low	50.1	Low	130 Å²	130	69 Å²	69	57%	0.57	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	26.1	-171.4	-68.3	-94.1	0	0	0	113.8	Y639 G640 S641 G645 A669	Y639-F643 PolarHBondContact O-N 2.98Å; G640-F643 PolarHBondContact O-N 2.78Å; G640-F643 VanDerWaalsContact O-N 3.12Å; S641-F643 VanDerWaalsContact C-N 3.32Å; F643-G645 PolarHBondContact O-N 2.05Å; F643-A669 HydrophobicContact CE1-CB 4.06Å; F643-A669 HydrophobicContact CE2-CB 4.35Å; F643-A669 HydrophobicContact CZ-CB 3.43Å; F643-A669 VanDerWaalsContact CZ-CB 3.43Å
644	I	49.7	Very low	49.3	Very low	116 Å²	116	72.7 Å²	72.7	60%	0.595	38%	0.378	S	S	*	.	S	Bend	trans	-78.3	-9.1	-178.6	-66.4	173.4	0	0	0	111.1	Y639 L642	Y639-I644 HydrophobicContact CD1-CB 4.39Å; Y639-I644 HydrophobicContact CD1-CG2 4.24Å; Y639-I644 PolarHBondContact O-N 2.8Å; L642-I644 HydrophobicContact CB-CB 4.43Å; L642-I644 HydrophobicContact CB-CD1 3.49Å; L642-I644 VanDerWaalsContact CB-CD1 3.49Å; L642-I644 HydrophobicContact CB-CG1 3.63Å; L642-I644 HydrophobicContact CD1-CD1 3.71Å; L642-I644 HydrophobicContact CG-CD1 4.22Å; L642-I644 PolarHBondContact O-N 3.28Å
645	G	45.1	Very low	48.2	Very low	36 Å²	36	76.2 Å²	76.2	37%	0.371	40%	0.397	S	S	.	.			trans	97.4	161.8	-171.9	0	0	0	0	0	110.8	Y639 F643 G647	Y639-G645 WeakPolarHBondContact CB-O 3.3Å; F643-G645 PolarHBondContact O-N 2.05Å; G645-G647 PolarHBondContact O-N 2.87Å
646	T	45	Very low	47.3	Very low	41 Å²	41	79.5 Å²	79.5	25%	0.252	42%	0.417	S	S	.	.			trans	-67.7	107.6	-176.2	53.8	0	0	0	0	110	L661	T646-L661 HydrophobicContact CG2-CD2 4.42Å
647	G	44.8	Very low	46.5	Very low	14 Å²	14	82.7 Å²	82.7	14%	0.144	43%	0.433	C	S	.	.			trans	-66.9	133.8	167.3	0	0	0	0	0	110.3	V636 Y639 G645 C649	V636-G647 VanDerWaalsContact CG2-O 3.3Å; V636-G647 WeakPolarHBondContact CG2-O 3.34Å; Y639-G647 VanDerWaalsContact CD2-CA 3.46Å; G645-G647 PolarHBondContact O-N 2.87Å; G647-C649 PolarHBondContact O-N 3.42Å
648	R	45.1	Very low	45.5	Very low	211 Å²	211	86.5 Å²	86.5	80%	0.796	45%	0.45	S	S	*	.	S	Bend	trans	34.4	-16.4	168.8	-69.9	-166.1	176.5	-174.3	3.9	123.2
649	C	38	Very low	44.5	Very low	2 Å²	2	90 Å²	90	1%	0.014	47%	0.469	C	S	.	.			trans	-105.9	79.8	-179.9	-124.7	0	0	0	0	112.5	C627 E632 V636 G647	C627-C649 HydrophobicContact CB-CB 4.5Å; C627-C649 VanDerWaalsContact CB-SG 3.59Å; C627-C649 PolarHBondContact SG-SG 3.35Å; E632-C649 HydrophobicContact CB-CB 4.34Å; E632-C649 PolarHBondContact OE2-SG 3.03Å; E632-C649 VanDerWaalsContact OE2-SG 3.37Å; V636-C649 HydrophobicContact CG2-CB 3.34Å; G647-C649 PolarHBondContact O-N 3.42Å
650	V	39.4	Very low	44.2	Very low	51 Å²	51	87.1 Å²	87.1	31%	0.309	46%	0.46	S	S	.	.			trans	-143	70	144.7	-167.2	0	0	0	0	107.5	L657	V650-L657 HydrophobicContact CG1-CD1 3.76Å
651	T	38	Very low	44	Very low	100 Å²	100	91 Å²	91	61%	0.613	48%	0.48	S	S	*	.			trans	-102.4	64.2	167.4	56	0	0	0	0	109.1
652	M	36.4	Very low	43.8	Very low	124 Å²	124	92.2 Å²	92.2	61%	0.611	49%	0.486	S	S	*	.	S	Bend	trans	-129.7	144.2	160.5	-68.5	-141.9	123.1	0	0	108.5
653	K	39.7	Very low	43.7	Very low	146 Å²	146	88.7 Å²	88.7	64%	0.635	48%	0.476	S	S	*	.			trans	-42.3	141.8	-167.2	-72.5	172.6	170.2	-179.4	0	111.9	H537 D655 D656	H537-K653 PolarHBondContact CE1-NZ 3.24Å; H537-K653 PolarHBondContact NE2-NZ 3.46Å; K653-D655 PolarHBondContact O-N 3.02Å; K653-D656 PolarHBondContact O-N 3Å
654	A	43.2	Very low	43.9	Very low	77 Å²	77	83.3 Å²	83.3	64%	0.636	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	-12.2	-167.4	0	0	0	0	0	117.3	L657	A654-L657 WeakPolarHBondContact O-CB 3.31Å
655	D	41.1	Very low	44.1	Very low	140 Å²	140	79.2 Å²	79.2	75%	0.749	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-27.3	-177	-66.9	-12.1	0	0	0	113.5	K653 L657	K653-D655 PolarHBondContact O-N 3.02Å; D655-L657 VanDerWaalsContact C-N 3.28Å; D655-L657 PolarHBondContact O-N 3.05Å
656	D	39.5	Very low	44.6	Very low	131 Å²	131	79.7 Å²	79.7	70%	0.701	43%	0.428	S	S	*	.	S	Bend	trans	-88.6	5.7	177.3	-72.2	-32.3	0	0	0	113.5	K653 K658	K653-D656 PolarHBondContact O-N 3Å; D656-K658 PolarHBondContact O-N 2.84Å
657	L	42.4	Very low	45.1	Very low	68 Å²	68	80.3 Å²	80.3	36%	0.356	43%	0.426	S	S	.	.	H	α-helix	trans	-62.7	-13	-164.2	-167.9	68.4	0	0	0	115.9	V650 A654 D655 L661	V650-L657 HydrophobicContact CG1-CD1 3.76Å; A654-L657 WeakPolarHBondContact O-CB 3.31Å; D655-L657 VanDerWaalsContact C-N 3.28Å; D655-L657 PolarHBondContact O-N 3.05Å; L657-L661 HydrophobicContact CD1-CD1 4.27Å; L657-L661 HydrophobicContact CG-CD1 4.16Å
658	K	41.1	Very low	45.7	Very low	118 Å²	118	79.7 Å²	79.7	51%	0.513	42%	0.42	S	S	.	.	H	α-helix	trans	-96.8	-22.4	-163.4	-70	-177.1	-179.7	174.4	0	116.1	P548 D656	P548-K658 HydrophobicContact CG-CD 3.86Å; D656-K658 PolarHBondContact O-N 2.84Å
659	L	38.6	Very low	46.5	Very low	159 Å²	159	71 Å²	71	83%	0.832	39%	0.393	S	S	*	.	H	α-helix	trans	-81.1	-35.9	-177.9	-155.3	71.8	0	0	0	112.5	G663	L659-G663 PolarHBondContact O-N 3.25Å; L659-G663 VanDerWaalsContact O-N 3.1Å
660	S	49.9	Very low	47.6	Very low	20 Å²	20	71.3 Å²	71.3	14%	0.14	40%	0.395	C	S	.	.	H	α-helix	trans	-72.3	-47	-174.8	158.8	0	0	0	0	114.1	V662 G663 I664	S660-V662 PolarHBondContact O-N 3.2Å; S660-V662 VanDerWaalsContact O-N 3.13Å; S660-G663 PolarHBondContact O-N 3.22Å; S660-I664 PolarHBondContact O-N 2.89Å; S660-I664 WeakPolarHBondContact OG-CD1 3.49Å
661	L	48.6	Very low	48.7	Very low	81 Å²	81	70.6 Å²	70.6	42%	0.424	39%	0.388	S	S	.	.	H	α-helix	trans	-60.7	-27.6	-175.9	-97.8	154.5	0	0	0	113.9	T646 L657 P665	T646-L661 HydrophobicContact CG2-CD2 4.42Å; L657-L661 HydrophobicContact CD1-CD1 4.27Å; L657-L661 HydrophobicContact CG-CD1 4.16Å; L661-P665 WeakPolarHBondContact O-CD 3.49Å
662	V	50.8	Low	49.9	Very low	63 Å²	63	71.6 Å²	71.6	38%	0.382	39%	0.385	S	S	.	.	H	α-helix	trans	-99.3	-41.7	-177.1	-179	0	0	0	0	109.8	F561 S660 I664 L666	F561-V662 HydrophobicContact CD2-CG1 4.2Å; F561-V662 HydrophobicContact CE2-CG1 3.14Å; F561-V662 HydrophobicContact CZ-CG1 3.36Å; S660-V662 PolarHBondContact O-N 3.2Å; S660-V662 VanDerWaalsContact O-N 3.13Å; V662-I664 PolarHBondContact O-N 3.32Å; V662-L666 HydrophobicContact CB-CD1 4.45Å; V662-L666 HydrophobicContact CG1-CD1 3.37Å; V662-L666 WeakPolarHBondContact O-CB 3.4Å; V662-L666 WeakPolarHBondContact O-CD1 3.26Å; V662-L666 VanDerWaalsContact O-CG 3.22Å; V662-L666 WeakPolarHBondContact O-CG 3.22Å; V662-L666 PolarHBondContact O-N 3.02Å
663	G	52	Low	51.2	Low	35 Å²	35	72.2 Å²	72.2	36%	0.361	38%	0.38	S	S	.	.	H	α-helix	trans	-61.8	-42.1	-178.3	0	0	0	0	0	114.6	L659 S660 L666 Y667	L659-G663 PolarHBondContact O-N 3.25Å; L659-G663 VanDerWaalsContact O-N 3.1Å; S660-G663 PolarHBondContact O-N 3.22Å; G663-L666 PolarHBondContact O-N 3.31Å; G663-Y667 VanDerWaalsContact O-CB 3.23Å; G663-Y667 WeakPolarHBondContact O-CB 2.99Å; G663-Y667 PolarHBondContact O-N 3.29Å
664	I	53.3	Low	52.2	Low	17 Å²	17	66.8 Å²	66.8	9%	0.087	36%	0.357	C	S	.	.	H	α-helix	trans	-69.1	-51.8	-172.3	-65.5	157.1	0	0	0	112.6	V636 S660 V662 L666 Y667 S668	V636-I664 HydrophobicContact CG1-CD1 3.68Å; V636-I664 HydrophobicContact CG1-CG1 4.32Å; V636-I664 HydrophobicContact CG1-CG2 3.73Å; S660-I664 PolarHBondContact O-N 2.89Å; S660-I664 WeakPolarHBondContact OG-CD1 3.49Å; V662-I664 PolarHBondContact O-N 3.32Å; I664-L666 VanDerWaalsContact C-N 3.29Å; I664-L666 PolarHBondContact O-N 3.43Å; I664-Y667 PolarHBondContact O-N 3.18Å; I664-S668 WeakPolarHBondContact O-CB 3.49Å; I664-S668 PolarHBondContact O-N 2.78Å
665	P	54.3	Low	53.2	Low	30 Å²	30	66.4 Å²	66.4	20%	0.195	34%	0.344	C	S	.	.	H	α-helix	trans	-63.2	-34.8	176.6	-21.9	33.9	0	0	0	112.7	L661 S668 A669	L661-P665 WeakPolarHBondContact O-CD 3.49Å; P665-S668 WeakPolarHBondContact O-CB 3.22Å; P665-S668 PolarHBondContact O-N 2.99Å; P665-A669 WeakPolarHBondContact O-CB 3.42Å; P665-A669 PolarHBondContact O-N 2.8Å
666	L	55.2	Low	54.3	Low	45 Å²	45	61.6 Å²	61.6	24%	0.236	32%	0.319	C	S	.	.	H	α-helix	trans	-68.2	-44.1	177.2	-71.8	157.5	0	0	0	111.5	F561 M565 V662 G663 I664 S668 A669 T670	F561-L666 HydrophobicContact CE2-CD1 3.56Å; F561-L666 HydrophobicContact CZ-CD1 3.32Å; F561-L666 HydrophobicContact CZ-CD2 4.32Å; F561-L666 HydrophobicContact CZ-CG 4.43Å; M565-L666 HydrophobicContact CE-CB 4.07Å; M565-L666 HydrophobicContact CE-CD1 4.47Å; M565-L666 HydrophobicContact CE-CD2 3.45Å; M565-L666 VanDerWaalsContact CE-CD2 3.45Å; M565-L666 HydrophobicContact CE-CG 4.17Å; M565-L666 HydrophobicContact CG-CD1 4.41Å; M565-L666 HydrophobicContact CG-CD2 4.37Å; M565-L666 HydrophobicContact SD-CB 4.04Å; M565-L666 HydrophobicContact SD-CD1 3.67Å; M565-L666 HydrophobicContact SD-CD2 3.72Å; M565-L666 HydrophobicContact SD-CG 3.99Å; V662-L666 HydrophobicContact CB-CD1 4.45Å; V662-L666 HydrophobicContact CG1-CD1 3.37Å; V662-L666 WeakPolarHBondContact O-CB 3.4Å; V662-L666 WeakPolarHBondContact O-CD1 3.26Å; V662-L666 VanDerWaalsContact O-CG 3.22Å; V662-L666 WeakPolarHBondContact O-CG 3.22Å; V662-L666 PolarHBondContact O-N 3.02Å; G663-L666 PolarHBondContact O-N 3.31Å; I664-L666 VanDerWaalsContact C-N 3.29Å; I664-L666 PolarHBondContact O-N 3.43Å; L666-S668 VanDerWaalsContact C-N 3.32Å; L666-S668 PolarHBondContact O-N 2.99Å; L666-A669 WeakPolarHBondContact O-CB 3.47Å; L666-A669 PolarHBondContact O-N 3.13Å; L666-T670 WeakPolarHBondContact O-CG2 3.41Å; L666-T670 PolarHBondContact O-N 2.55Å
667	Y	56.7	Low	55.2	Low	54 Å²	54	57.2 Å²	57.2	21%	0.212	30%	0.298	C	S	.	.	H	α-helix	trans	-61.8	-43.3	175.5	-172.3	-83.7	0	0	0	110.7	Y568 T618 G663 I664 A669 T670 M671	Y568-Y667 VanDerWaalsContact OH-CD2 3.26Å; Y568-Y667 WeakPolarHBondContact OH-CD2 3.17Å; Y568-Y667 VanDerWaalsContact OH-CE2 3.28Å; Y568-Y667 WeakPolarHBondContact OH-CE2 3.39Å; T618-Y667 HydrophobicContact CG2-CD1 3.57Å; T618-Y667 HydrophobicContact CG2-CE1 3.15Å; T618-Y667 WeakPolarHBondContact OG1-CE1 3.23Å; T618-Y667 PolarHBondContact OG1-OH 2.84Å; G663-Y667 VanDerWaalsContact O-CB 3.23Å; G663-Y667 WeakPolarHBondContact O-CB 2.99Å; G663-Y667 PolarHBondContact O-N 3.29Å; I664-Y667 PolarHBondContact O-N 3.18Å; Y667-A669 PolarHBondContact O-N 2.98Å; Y667-T670 WeakPolarHBondContact O-CA 3.5Å; Y667-T670 WeakPolarHBondContact O-CB 3.28Å; Y667-T670 PolarHBondContact O-N 3.44Å; Y667-T670 VanDerWaalsContact O-N 3.09Å; Y667-T670 PolarHBondContact O-OG1 3.08Å; Y667-M671 HydrophobicContact CD1-CG 3.87Å; Y667-M671 HydrophobicContact CE1-CE 3.87Å; Y667-M671 HydrophobicContact CE1-CG 3.44Å; Y667-M671 VanDerWaalsContact CE1-CG 3.44Å; Y667-M671 HydrophobicContact CE1-SD 3.96Å; Y667-M671 HydrophobicContact CE2-CE 4.14Å; Y667-M671 WeakPolarHBondContact O-CG 3.28Å; Y667-M671 PolarHBondContact O-N 3.4Å
668	S	57.6	Low	56	Low	2 Å²	2	54.8 Å²	54.8	1%	0.014	29%	0.286	C	S	.	.	H	α-helix	trans	-58.7	-44.3	171.7	-98.5	0	0	0	0	113.9	G640 S641 I664 P665 L666 T670 M671 F672	G640-S668 VanDerWaalsContact O-CB 3.26Å; G640-S668 WeakPolarHBondContact O-CB 3.24Å; G640-S668 PolarHBondContact O-OG 3.25Å; S641-S668 VanDerWaalsContact CA-CB 3.49Å; S641-S668 WeakPolarHBondContact CA-OG 3.4Å; S641-S668 PolarHBondContact N-OG 3.43Å; S641-S668 PolarHBondContact OG-OG 2.84Å; I664-S668 WeakPolarHBondContact O-CB 3.49Å; I664-S668 PolarHBondContact O-N 2.78Å; P665-S668 WeakPolarHBondContact O-CB 3.22Å; P665-S668 PolarHBondContact O-N 2.99Å; L666-S668 VanDerWaalsContact C-N 3.32Å; L666-S668 PolarHBondContact O-N 2.99Å; S668-T670 PolarHBondContact O-N 2.92Å; S668-M671 PolarHBondContact O-N 3.27Å; S668-F672 WeakPolarHBondContact O-CB 3.33Å; S668-F672 PolarHBondContact O-N 3.17Å
669	A	61.8	Low	57	Low	29 Å²	29	53.1 Å²	53.1	24%	0.24	29%	0.286	C	S	.	.	H	α-helix	trans	-57.5	-41.2	173.4	0	0	0	0	0	110.9	F643 P665 L666 Y667 W673	F643-A669 HydrophobicContact CE1-CB 4.06Å; F643-A669 HydrophobicContact CE2-CB 4.35Å; F643-A669 HydrophobicContact CZ-CB 3.43Å; F643-A669 VanDerWaalsContact CZ-CB 3.43Å; P665-A669 WeakPolarHBondContact O-CB 3.42Å; P665-A669 PolarHBondContact O-N 2.8Å; L666-A669 WeakPolarHBondContact O-CB 3.47Å; L666-A669 PolarHBondContact O-N 3.13Å; Y667-A669 PolarHBondContact O-N 2.98Å; A669-W673 VanDerWaalsContact O-CB 3.24Å; A669-W673 WeakPolarHBondContact O-CB 3.44Å; A669-W673 PolarHBondContact O-N 2.88Å
670	T	59.9	Low	58.1	Low	7 Å²	7	53.1 Å²	53.1	4%	0.043	28%	0.275	C	S	.	.	H	α-helix	trans	-68.1	-39.6	178.6	74.8	0	0	0	0	112.2	Y568 L569 L666 Y667 S668 W673 F674	Y568-T670 HydrophobicContact CD1-CG2 3.94Å; Y568-T670 HydrophobicContact CE1-CG2 3.62Å; L569-T670 HydrophobicContact CD2-CG2 3.4Å; L569-T670 VanDerWaalsContact CD2-CG2 3.4Å; L569-T670 HydrophobicContact CG-CG2 4.25Å; L666-T670 WeakPolarHBondContact O-CG2 3.41Å; L666-T670 PolarHBondContact O-N 2.55Å; Y667-T670 WeakPolarHBondContact O-CA 3.5Å; Y667-T670 WeakPolarHBondContact O-CB 3.28Å; Y667-T670 PolarHBondContact O-N 3.44Å; Y667-T670 VanDerWaalsContact O-N 3.09Å; Y667-T670 PolarHBondContact O-OG1 3.08Å; S668-T670 PolarHBondContact O-N 2.92Å; T670-W673 PolarHBondContact O-N 2.91Å; T670-F674 VanDerWaalsContact O-CB 3.22Å; T670-F674 WeakPolarHBondContact O-CB 3.38Å; T670-F674 PolarHBondContact O-N 2.73Å
671	M	62.4	Low	58.7	Low	36 Å²	36	54.8 Å²	54.8	18%	0.177	28%	0.282	C	S	.	.	H	α-helix	trans	-67.8	-42.1	176.8	-71.2	-62.4	114.8	0	0	111.8	L614 Y667 S668 F674 L675	L614-M671 HydrophobicContact CB-SD 4.19Å; L614-M671 HydrophobicContact CD1-SD 4.24Å; Y667-M671 HydrophobicContact CD1-CG 3.87Å; Y667-M671 HydrophobicContact CE1-CE 3.87Å; Y667-M671 HydrophobicContact CE1-CG 3.44Å; Y667-M671 VanDerWaalsContact CE1-CG 3.44Å; Y667-M671 HydrophobicContact CE1-SD 3.96Å; Y667-M671 HydrophobicContact CE2-CE 4.14Å; Y667-M671 WeakPolarHBondContact O-CG 3.28Å; Y667-M671 PolarHBondContact O-N 3.4Å; S668-M671 PolarHBondContact O-N 3.27Å; M671-F674 WeakPolarHBondContact O-CB 2.86Å; M671-F674 PolarHBondContact O-N 3.03Å; M671-L675 WeakPolarHBondContact O-CB 3.43Å; M671-L675 PolarHBondContact O-N 3.26Å
672	F	63.9	Low	59.2	Low	122 Å²	122	51.9 Å²	51.9	54%	0.535	27%	0.267	S	S	.	.	H	α-helix	trans	-65.2	-44.2	175.3	-176.3	-100.9	0	0	0	111.4	S668 F674 L675 V676	S668-F672 WeakPolarHBondContact O-CB 3.33Å; S668-F672 PolarHBondContact O-N 3.17Å; F672-F674 VanDerWaalsContact C-N 3.34Å; F672-F674 PolarHBondContact O-N 2.83Å; F672-L675 WeakPolarHBondContact O-CB 3.4Å; F672-L675 PolarHBondContact O-N 3.39Å; F672-V676 HydrophobicContact CD1-CG2 4.29Å; F672-V676 HydrophobicContact CE1-CG2 3.9Å; F672-V676 HydrophobicContact CZ-CG2 4.08Å; F672-V676 WeakPolarHBondContact O-CG2 3.42Å; F672-V676 PolarHBondContact O-N 2.88Å
673	W	64.2	Low	59.7	Low	137 Å²	137	55.7 Å²	55.7	52%	0.519	28%	0.275	S	S	.	.	H	α-helix	trans	-63.1	-40.6	175.7	-172.4	-103.1	0	0	0	112.1	A669 T670 V676 C677	A669-W673 VanDerWaalsContact O-CB 3.24Å; A669-W673 WeakPolarHBondContact O-CB 3.44Å; A669-W673 PolarHBondContact O-N 2.88Å; T670-W673 PolarHBondContact O-N 2.91Å; W673-V676 PolarHBondContact O-N 3.03Å; W673-C677 WeakPolarHBondContact O-CB 3.34Å; W673-C677 PolarHBondContact O-N 2.8Å; W673-C677 PolarHBondContact O-SG 3.47Å
674	F	59.5	Low	59.9	Low	32 Å²	32	60.5 Å²	60.5	14%	0.14	29%	0.288	C	S	.	.	H	α-helix	trans	-58.6	-48.8	172.8	179	-88.7	0	0	0	111.5	G576 F610 T611 L614 T670 M671 F672 V676 C677 T678	G576-F674 VanDerWaalsContact CA-CE2 3.49Å; F610-F674 AromaticContact CD1-CE1 3.98Å; F610-F674 HydrophobicContact CD1-CE1 3.98Å; F610-F674 AromaticContact CD1-CZ 3.92Å; F610-F674 HydrophobicContact CD1-CZ 3.92Å; F610-F674 AromaticContact CE1-CE1 3.96Å; F610-F674 HydrophobicContact CE1-CE1 3.96Å; F610-F674 HydrophobicContact CE1-CE2 4.48Å; F610-F674 AromaticContact CE1-CZ 3.58Å; F610-F674 HydrophobicContact CE1-CZ 3.58Å; T611-F674 HydrophobicContact CG2-CD1 4.44Å; T611-F674 HydrophobicContact CG2-CE1 4.35Å; L614-F674 HydrophobicContact CD1-CD1 4.48Å; L614-F674 HydrophobicContact CD1-CE1 4.15Å; L614-F674 HydrophobicContact CD1-CZ 4.45Å; T670-F674 VanDerWaalsContact O-CB 3.22Å; T670-F674 WeakPolarHBondContact O-CB 3.38Å; T670-F674 PolarHBondContact O-N 2.73Å; M671-F674 WeakPolarHBondContact O-CB 2.86Å; M671-F674 PolarHBondContact O-N 3.03Å; F672-F674 VanDerWaalsContact C-N 3.34Å; F672-F674 PolarHBondContact O-N 2.83Å; F674-V676 VanDerWaalsContact C-N 3.33Å; F674-V676 PolarHBondContact O-N 2.99Å; F674-C677 PolarHBondContact O-N 2.77Å; F674-T678 WeakPolarHBondContact CE1-OG1 3.32Å; F674-T678 PolarHBondContact O-N 2.8Å; F674-T678 PolarHBondContact O-OG1 3.46Å
675	L	63.9	Low	60.2	Low	69 Å²	69	63.1 Å²	63.1	36%	0.361	30%	0.3	S	S	.	.	H	α-helix	trans	-55.5	-48.1	175.8	178.6	73.5	0	0	0	111.1	T611 M671 F672 C677 T678 V679	T611-L675 HydrophobicContact CG2-CD1 3.94Å; M671-L675 WeakPolarHBondContact O-CB 3.43Å; M671-L675 PolarHBondContact O-N 3.26Å; F672-L675 WeakPolarHBondContact O-CB 3.4Å; F672-L675 PolarHBondContact O-N 3.39Å; L675-C677 PolarHBondContact O-N 3.14Å; L675-T678 PolarHBondContact O-N 2.78Å; L675-V679 VanDerWaalsContact O-CG2 3.31Å; L675-V679 WeakPolarHBondContact O-CG2 3.23Å; L675-V679 PolarHBondContact O-N 2.84Å
676	V	63.9	Low	60.3	Low	38 Å²	38	62.5 Å²	62.5	23%	0.23	30%	0.296	C	S	.	.	H	α-helix	trans	-61.8	-43.3	178.2	172.8	0	0	0	0	111.4	F672 W673 F674 R680	F672-V676 HydrophobicContact CD1-CG2 4.29Å; F672-V676 HydrophobicContact CE1-CG2 3.9Å; F672-V676 HydrophobicContact CZ-CG2 4.08Å; F672-V676 WeakPolarHBondContact O-CG2 3.42Å; F672-V676 PolarHBondContact O-N 2.88Å; W673-V676 PolarHBondContact O-N 3.03Å; F674-V676 VanDerWaalsContact C-N 3.33Å; F674-V676 PolarHBondContact O-N 2.99Å; V676-R680 WeakPolarHBondContact O-CB 3.46Å; V676-R680 VanDerWaalsContact O-CG 3.32Å; V676-R680 WeakPolarHBondContact O-CG 3.35Å; V676-R680 PolarHBondContact O-N 3.05Å
677	C	59.5	Low	60.3	Low	40 Å²	40	62.8 Å²	62.8	27%	0.27	30%	0.298	S	S	.	.	H	α-helix	trans	-62.1	-44	175.7	-79.2	0	0	0	0	112.1	W673 F674 L675 R680 L681	W673-C677 WeakPolarHBondContact O-CB 3.34Å; W673-C677 PolarHBondContact O-N 2.8Å; W673-C677 PolarHBondContact O-SG 3.47Å; F674-C677 PolarHBondContact O-N 2.77Å; L675-C677 PolarHBondContact O-N 3.14Å; C677-R680 PolarHBondContact O-N 2.83Å; C677-L681 WeakPolarHBondContact O-CB 3.32Å; C677-L681 PolarHBondContact O-N 2.69Å
678	T	59.9	Low	60.2	Low	17 Å²	17	64.1 Å²	64.1	10%	0.104	31%	0.308	C	S	.	.	H	α-helix	trans	-65.9	-43.8	179.1	-54.8	0	0	0	0	111.2	S607 F674 L675 R680 L681 V682	S607-T678 WeakPolarHBondContact OG-CG2 3.44Å; F674-T678 WeakPolarHBondContact CE1-OG1 3.32Å; F674-T678 PolarHBondContact O-N 2.8Å; F674-T678 PolarHBondContact O-OG1 3.46Å; L675-T678 PolarHBondContact O-N 2.78Å; T678-R680 VanDerWaalsContact C-N 3.32Å; T678-R680 PolarHBondContact O-N 2.83Å; T678-L681 PolarHBondContact O-N 3.07Å; T678-V682 HydrophobicContact CG2-CG2 4.32Å; T678-V682 WeakPolarHBondContact O-CB 3.23Å; T678-V682 VanDerWaalsContact O-CG2 3.28Å; T678-V682 WeakPolarHBondContact O-CG2 3.31Å; T678-V682 PolarHBondContact O-N 3.1Å
679	V	60.9	Low	60.1	Low	83 Å²	83	64.6 Å²	64.6	50%	0.503	31%	0.311	S	S	.	.	H	α-helix	trans	-60.1	-42.7	174	171.5	0	0	0	0	111.2	L675 R683	L675-V679 VanDerWaalsContact O-CG2 3.31Å; L675-V679 WeakPolarHBondContact O-CG2 3.23Å; L675-V679 PolarHBondContact O-N 2.84Å; V679-R683 VanDerWaalsContact O-CB 3.27Å; V679-R683 WeakPolarHBondContact O-CB 3.22Å; V679-R683 PolarHBondContact O-N 3.31Å
680	R	61.4	Low	59.8	Low	158 Å²	158	63.7 Å²	63.7	60%	0.596	30%	0.301	S	S	*	.	H	α-helix	trans	-63.5	-43	176.1	-77.5	179	173.4	-176.6	-1.1	112.2	V676 C677 T678 R683 Q684	V676-R680 WeakPolarHBondContact O-CB 3.46Å; V676-R680 VanDerWaalsContact O-CG 3.32Å; V676-R680 WeakPolarHBondContact O-CG 3.35Å; V676-R680 PolarHBondContact O-N 3.05Å; C677-R680 PolarHBondContact O-N 2.83Å; T678-R680 VanDerWaalsContact C-N 3.32Å; T678-R680 PolarHBondContact O-N 2.83Å; R680-R683 PolarHBondContact O-N 2.91Å; R680-Q684 WeakPolarHBondContact O-CB 3.19Å; R680-Q684 PolarHBondContact O-N 3.48Å
681	L	62.5	Low	59.3	Low	56 Å²	56	68.8 Å²	68.8	29%	0.293	32%	0.323	S	S	.	.	H	α-helix	trans	-67.4	-46.5	179.5	-167	77.9	0	0	0	111.4	S580 C677 T678 R683 Q684 E685	S580-L681 VanDerWaalsContact OG-CD2 3.3Å; S580-L681 WeakPolarHBondContact OG-CD2 3.16Å; C677-L681 WeakPolarHBondContact O-CB 3.32Å; C677-L681 PolarHBondContact O-N 2.69Å; T678-L681 PolarHBondContact O-N 3.07Å; L681-R683 VanDerWaalsContact C-N 3.28Å; L681-R683 PolarHBondContact O-N 3.41Å; L681-Q684 PolarHBondContact O-N 2.86Å; L681-E685 PolarHBondContact O-N 2.82Å
682	V	59.6	Low	58.9	Low	19 Å²	19	73.7 Å²	73.7	12%	0.115	35%	0.346	C	S	.	.	H	α-helix	trans	-59	-41.9	174.7	172.1	0	0	0	0	110.5	L604 T678 S686	L604-V682 HydrophobicContact CD2-CG1 3.89Å; L604-V682 HydrophobicContact CG-CG1 4.2Å; T678-V682 HydrophobicContact CG2-CG2 4.32Å; T678-V682 WeakPolarHBondContact O-CB 3.23Å; T678-V682 VanDerWaalsContact O-CG2 3.28Å; T678-V682 WeakPolarHBondContact O-CG2 3.31Å; T678-V682 PolarHBondContact O-N 3.1Å; V682-S686 VanDerWaalsContact O-CB 3.25Å; V682-S686 WeakPolarHBondContact O-CB 3.25Å; V682-S686 PolarHBondContact O-N 3.22Å; V682-S686 PolarHBondContact O-OG 3.31Å
683	R	61	Low	58.5	Low	144 Å²	144	72.3 Å²	72.3	54%	0.543	34%	0.341	S	S	.	.	H	α-helix	trans	-62.9	-40.9	174.3	-174	176.6	178	169.4	0.8	112.1	V679 R680 L681 S686 L687	V679-R683 VanDerWaalsContact O-CB 3.27Å; V679-R683 WeakPolarHBondContact O-CB 3.22Å; V679-R683 PolarHBondContact O-N 3.31Å; R680-R683 PolarHBondContact O-N 2.91Å; L681-R683 VanDerWaalsContact C-N 3.28Å; L681-R683 PolarHBondContact O-N 3.41Å; R683-S686 WeakPolarHBondContact CA-OG 3.38Å; R683-S686 PolarHBondContact O-OG 2.82Å; R683-L687 HydrophobicContact CG-CD1 4.25Å; R683-L687 WeakPolarHBondContact O-CB 3.49Å; R683-L687 WeakPolarHBondContact O-CD1 3.26Å; R683-L687 WeakPolarHBondContact O-CG 3.1Å; R683-L687 PolarHBondContact O-N 3.37Å; R683-L687 VanDerWaalsContact O-N 3.17Å
684	Q	57.1	Low	58	Low	136 Å²	136	66.2 Å²	66.2	64%	0.636	32%	0.318	S	S	*	.	H	α-helix	trans	-69.3	-42.6	-179.8	-173.3	173.3	-10.2	0	0	112.3	R680 L681 L687 L688	R680-Q684 WeakPolarHBondContact O-CB 3.19Å; R680-Q684 PolarHBondContact O-N 3.48Å; L681-Q684 PolarHBondContact O-N 2.86Å; Q684-L687 WeakPolarHBondContact O-CB 3.24Å; Q684-L687 PolarHBondContact O-N 3.45Å; Q684-L688 PolarHBondContact O-N 3.03Å
685	E	58.7	Low	57.4	Low	71 Å²	71	66.6 Å²	66.6	33%	0.332	32%	0.324	S	S	.	.	H	α-helix	trans	-71.1	-44	177.4	-79.6	-62.7	160.1	0	0	112.4	L681 L687 L688 I689	L681-E685 PolarHBondContact O-N 2.82Å; E685-L687 PolarHBondContact O-N 3.37Å; E685-L688 CarbonylContact O-C 3.53Å; E685-L688 WeakPolarHBondContact O-CA 3.46Å; E685-L688 WeakPolarHBondContact O-CB 3.44Å; E685-L688 PolarHBondContact O-N 3.29Å; E685-I689 WeakPolarHBondContact O-CG1 3.4Å; E685-I689 PolarHBondContact O-N 3.21Å
686	S	55.9	Low	56.7	Low	18 Å²	18	64.9 Å²	64.9	13%	0.126	32%	0.323	C	S	.	.	H	α-helix	trans	-56.7	-40	173.4	51.5	0	0	0	0	111.4	V682 R683 L690	V682-S686 VanDerWaalsContact O-CB 3.25Å; V682-S686 WeakPolarHBondContact O-CB 3.25Å; V682-S686 PolarHBondContact O-N 3.22Å; V682-S686 PolarHBondContact O-OG 3.31Å; R683-S686 WeakPolarHBondContact CA-OG 3.38Å; R683-S686 PolarHBondContact O-OG 2.82Å; S686-L690 WeakPolarHBondContact O-CB 3Å; S686-L690 PolarHBondContact O-N 2.98Å
687	L	55.9	Low	56.1	Low	50 Å²	50	64.1 Å²	64.1	26%	0.262	32%	0.321	S	S	.	.	H	α-helix	trans	-65.9	-34.6	171.1	-84	163.2	0	0	0	113.5	R683 Q684 E685 K691	R683-L687 HydrophobicContact CG-CD1 4.25Å; R683-L687 WeakPolarHBondContact O-CB 3.49Å; R683-L687 WeakPolarHBondContact O-CD1 3.26Å; R683-L687 WeakPolarHBondContact O-CG 3.1Å; R683-L687 PolarHBondContact O-N 3.37Å; R683-L687 VanDerWaalsContact O-N 3.17Å; Q684-L687 WeakPolarHBondContact O-CB 3.24Å; Q684-L687 PolarHBondContact O-N 3.45Å; E685-L687 PolarHBondContact O-N 3.37Å; L687-K691 WeakPolarHBondContact O-CB 3.41Å; L687-K691 VanDerWaalsContact O-CG 3.25Å; L687-K691 WeakPolarHBondContact O-CG 2.96Å; L687-K691 PolarHBondContact O-N 2.76Å
688	L	55.6	Low	55.5	Low	82 Å²	82	63.3 Å²	63.3	43%	0.429	31%	0.314	S	S	.	.	H	α-helix	trans	-69.1	-45.9	177.6	-163.8	100.9	0	0	0	111.3	Q684 E685 L690 K691 Q692	Q684-L688 PolarHBondContact O-N 3.03Å; E685-L688 CarbonylContact O-C 3.53Å; E685-L688 WeakPolarHBondContact O-CA 3.46Å; E685-L688 WeakPolarHBondContact O-CB 3.44Å; E685-L688 PolarHBondContact O-N 3.29Å; L688-L690 VanDerWaalsContact C-N 3.35Å; L688-K691 WeakPolarHBondContact O-CB 3.43Å; L688-K691 PolarHBondContact O-N 3.09Å; L688-K691 VanDerWaalsContact O-N 3.15Å; L688-Q692 PolarHBondContact O-N 3.19Å
689	I	55.6	Low	54.8	Low	13 Å²	13	67.3 Å²	67.3	7%	0.067	34%	0.341	C	S	.	.	H	α-helix	trans	-61	-45.9	174.3	-62.8	168.1	0	0	0	109.6	Y584 V596 E685 K691 Q692 E693	Y584-I689 HydrophobicContact CE2-CD1 4.39Å; V596-I689 HydrophobicContact CG1-CG2 3.78Å; V596-I689 HydrophobicContact CG2-CG2 4.11Å; E685-I689 WeakPolarHBondContact O-CG1 3.4Å; E685-I689 PolarHBondContact O-N 3.21Å; I689-K691 VanDerWaalsContact C-N 3.26Å; I689-K691 PolarHBondContact O-N 3.07Å; I689-Q692 PolarHBondContact O-N 2.87Å; I689-Q692 VanDerWaalsContact O-N 3.08Å; I689-E693 HydrophobicContact CG2-CG 4.15Å; I689-E693 WeakPolarHBondContact O-CB 3.48Å; I689-E693 PolarHBondContact O-N 3.02Å
690	L	53.8	Low	54.1	Low	9 Å²	9	72.4 Å²	72.4	5%	0.047	36%	0.357	C	S	.	.	H	α-helix	trans	-57.4	-41.4	175.2	-133.3	123	0	0	0	111.1	S686 L688 Q692 L694 W733 M734	S686-L690 WeakPolarHBondContact O-CB 3Å; S686-L690 PolarHBondContact O-N 2.98Å; L688-L690 VanDerWaalsContact C-N 3.35Å; L690-Q692 PolarHBondContact O-N 3.23Å; L690-L694 WeakPolarHBondContact O-CB 3.42Å; L690-L694 PolarHBondContact O-N 3.01Å; L690-W733 HydrophobicContact CD1-CH2 4.24Å; L690-W733 HydrophobicContact CD1-CZ3 3.67Å; L690-M734 HydrophobicContact CD1-CE 4.47Å; L690-M734 HydrophobicContact CD1-CG 4.4Å; L690-M734 HydrophobicContact CD2-CE 3.82Å; L690-M734 HydrophobicContact CG-CE 3.85Å
691	K	50.6	Low	53.5	Low	115 Å²	115	66.2 Å²	66.2	50%	0.5	34%	0.337	S	S	.	.	H	α-helix	trans	-67.1	-30.5	176.5	-78.8	171.2	-178.1	172.2	0	113.9	L687 L688 I689 P695	L687-K691 WeakPolarHBondContact O-CB 3.41Å; L687-K691 VanDerWaalsContact O-CG 3.25Å; L687-K691 WeakPolarHBondContact O-CG 2.96Å; L687-K691 PolarHBondContact O-N 2.76Å; L688-K691 WeakPolarHBondContact O-CB 3.43Å; L688-K691 PolarHBondContact O-N 3.09Å; L688-K691 VanDerWaalsContact O-N 3.15Å; I689-K691 VanDerWaalsContact C-N 3.26Å; I689-K691 PolarHBondContact O-N 3.07Å; K691-P695 WeakPolarHBondContact O-CD 3.29Å
692	Q	54.1	Low	52.8	Low	139 Å²	139	69.2 Å²	69.2	65%	0.65	35%	0.353	S	S	*	.	H	α-helix	trans	-79.9	-40.7	177.4	-81.5	-178.1	-25.7	0	0	112.4	L688 I689 L690 P695	L688-Q692 PolarHBondContact O-N 3.19Å; I689-Q692 PolarHBondContact O-N 2.87Å; I689-Q692 VanDerWaalsContact O-N 3.08Å; L690-Q692 PolarHBondContact O-N 3.23Å; Q692-P695 WeakPolarHBondContact O-CD 3.17Å
693	E	54.2	Low	52.2	Low	93 Å²	93	68.8 Å²	68.8	44%	0.435	35%	0.35	S	S	.	.	H	α-helix	trans	-84.8	-32.8	-174.9	-68.9	-70.5	172.6	0	0	113	V596 I689 G696 A697	V596-E693 HydrophobicContact CG2-CB 4.25Å; V596-E693 HydrophobicContact CG2-CG 3.87Å; I689-E693 HydrophobicContact CG2-CG 4.15Å; I689-E693 WeakPolarHBondContact O-CB 3.48Å; I689-E693 PolarHBondContact O-N 3.02Å; E693-G696 PolarHBondContact O-N 2.94Å; E693-A697 PolarHBondContact O-N 2.85Å
694	L	54	Low	51.3	Low	8 Å²	8	65.1 Å²	65.1	4%	0.042	35%	0.351	C	S	.	.	H	α-helix	trans	-56.2	-43.2	-177.7	-176.6	68.5	0	0	0	113.2	L690 G696 A697 I698 L725 M734 T749	L690-L694 WeakPolarHBondContact O-CB 3.42Å; L690-L694 PolarHBondContact O-N 3.01Å; L694-G696 VanDerWaalsContact C-N 3.33Å; L694-G696 PolarHBondContact O-N 2.92Å; L694-A697 PolarHBondContact O-N 3.25Å; L694-I698 HydrophobicContact CD1-CD1 3.94Å; L694-I698 HydrophobicContact CD1-CG1 4.26Å; L694-I698 HydrophobicContact CG-CD1 3.79Å; L694-I698 HydrophobicContact CG-CG1 4.48Å; L694-I698 WeakPolarHBondContact O-CB 3.5Å; L694-I698 WeakPolarHBondContact O-CD1 3.48Å; L694-I698 WeakPolarHBondContact O-CG1 3.35Å; L694-I698 PolarHBondContact O-N 3.31Å; L694-L725 HydrophobicContact CD1-CD2 3.73Å; L694-M734 HydrophobicContact CD1-CE 3.84Å; L694-T749 HydrophobicContact CD2-CG2 4.08Å
695	P	46.9	Very low	50.7	Low	40 Å²	40	63.7 Å²	63.7	26%	0.26	35%	0.347	S	S	.	.	H	α-helix	trans	-60.8	-39.5	173.6	-21.7	32.7	0	0	0	113.2	K691 Q692 C699	K691-P695 WeakPolarHBondContact O-CD 3.29Å; Q692-P695 WeakPolarHBondContact O-CD 3.17Å; P695-C699 VanDerWaalsContact O-CB 3.3Å; P695-C699 WeakPolarHBondContact O-CB 3.4Å; P695-C699 PolarHBondContact O-N 2.85Å
696	G	49.2	Very low	50.1	Low	34 Å²	34	67.4 Å²	67.4	35%	0.351	36%	0.362	S	S	.	.	H	α-helix	trans	-70.6	-40.6	179.4	0	0	0	0	0	112.8	E693 L694 C699 K700	E693-G696 PolarHBondContact O-N 2.94Å; L694-G696 VanDerWaalsContact C-N 3.33Å; L694-G696 PolarHBondContact O-N 2.92Å; G696-C699 PolarHBondContact O-N 2.86Å; G696-K700 WeakPolarHBondContact O-CG 3.34Å; G696-K700 PolarHBondContact O-N 2.91Å
697	A	51.9	Low	49.6	Very low	21 Å²	21	68.2 Å²	68.2	17%	0.174	36%	0.364	C	S	.	.	H	α-helix	trans	-64.9	-42.8	175.5	0	0	0	0	0	111.8	E693 L694 C699 K700 S701 L728	E693-A697 PolarHBondContact O-N 2.85Å; L694-A697 PolarHBondContact O-N 3.25Å; A697-C699 VanDerWaalsContact C-N 3.31Å; A697-C699 PolarHBondContact O-N 2.81Å; A697-K700 PolarHBondContact O-N 3.49Å; A697-S701 WeakPolarHBondContact O-CB 3.3Å; A697-S701 PolarHBondContact O-N 2.88Å; A697-S701 PolarHBondContact O-OG 3.29Å; A697-L728 HydrophobicContact CB-CD1 3.99Å; A697-L728 HydrophobicContact CB-CD2 4.43Å
698	I	47.9	Very low	48.9	Very low	24 Å²	24	73.1 Å²	73.1	12%	0.123	39%	0.385	C	S	.	.	H	α-helix	trans	-63	-38.4	173.5	-68.7	169.4	0	0	0	110.6	L694 S701 I703 L753	L694-I698 HydrophobicContact CD1-CD1 3.94Å; L694-I698 HydrophobicContact CD1-CG1 4.26Å; L694-I698 HydrophobicContact CG-CD1 3.79Å; L694-I698 HydrophobicContact CG-CG1 4.48Å; L694-I698 WeakPolarHBondContact O-CB 3.5Å; L694-I698 WeakPolarHBondContact O-CD1 3.48Å; L694-I698 WeakPolarHBondContact O-CG1 3.35Å; L694-I698 PolarHBondContact O-N 3.31Å; I698-S701 PolarHBondContact O-N 3.2Å; I698-S701 PolarHBondContact O-OG 3.38Å; I698-I703 HydrophobicContact CG2-CD1 4.31Å; I698-L753 HydrophobicContact CD1-CD1 3.63Å
699	C	44.9	Very low	48.5	Very low	101 Å²	101	72.4 Å²	72.4	68%	0.682	39%	0.387	S	S	*	.	H	α-helix	trans	-72.8	-34.9	179.6	-154.3	0	0	0	0	113.2	P695 G696 A697	P695-C699 VanDerWaalsContact O-CB 3.3Å; P695-C699 WeakPolarHBondContact O-CB 3.4Å; P695-C699 PolarHBondContact O-N 2.85Å; G696-C699 PolarHBondContact O-N 2.86Å; A697-C699 VanDerWaalsContact C-N 3.31Å; A697-C699 PolarHBondContact O-N 2.81Å
700	K	45.4	Very low	47.8	Very low	190 Å²	190	77.5 Å²	77.5	83%	0.826	42%	0.424	S	S	*	.	H	α-helix	trans	-72.8	-28	174.1	-77.1	-178.6	178.9	177.4	0	113.2	G696 A697	G696-K700 WeakPolarHBondContact O-CG 3.34Å; G696-K700 PolarHBondContact O-N 2.91Å; A697-K700 PolarHBondContact O-N 3.49Å
701	S	49.3	Very low	47.4	Very low	27 Å²	27	85.5 Å²	85.5	19%	0.189	46%	0.461	C	S	.	.	S	Bend	trans	-70	140.7	173.9	70	0	0	0	0	110.1	A697 I698 I703	A697-S701 WeakPolarHBondContact O-CB 3.3Å; A697-S701 PolarHBondContact O-N 2.88Å; A697-S701 PolarHBondContact O-OG 3.29Å; I698-S701 PolarHBondContact O-N 3.2Å; I698-S701 PolarHBondContact O-OG 3.38Å; S701-I703 PolarHBondContact O-N 3.02Å; S701-I703 WeakPolarHBondContact OG-CB 3.42Å; S701-I703 WeakPolarHBondContact OG-CD1 3.37Å; S701-I703 WeakPolarHBondContact OG-CG1 3.43Å
702	N	46.8	Very low	47.3	Very low	119 Å²	119	81.1 Å²	81.1	64%	0.636	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	9.2	176.3	-94.6	-8.1	0	0	0	114.4	A704 L705 K706	N702-A704 PolarHBondContact O-N 3.35Å; N702-L705 PolarHBondContact O-N 2.96Å; N702-K706 PolarHBondContact O-N 3.11Å; N702-K706 VanDerWaalsContact O-N 3.13Å
703	I	46.9	Very low	47.2	Very low	10 Å²	10	81.7 Å²	81.7	5%	0.051	45%	0.445	C	S	.	.	H	α-helix	trans	-50.6	-39.6	170.9	-68.3	177.3	0	0	0	111.3	I698 S701 L705 K706 F707 S724	I698-I703 HydrophobicContact CG2-CD1 4.31Å; S701-I703 PolarHBondContact O-N 3.02Å; S701-I703 WeakPolarHBondContact OG-CB 3.42Å; S701-I703 WeakPolarHBondContact OG-CD1 3.37Å; S701-I703 WeakPolarHBondContact OG-CG1 3.43Å; I703-L705 VanDerWaalsContact C-N 3.28Å; I703-L705 PolarHBondContact O-N 3.22Å; I703-K706 PolarHBondContact O-N 2.84Å; I703-K706 VanDerWaalsContact O-N 3.11Å; I703-F707 HydrophobicContact CB-CE2 4.41Å; I703-F707 HydrophobicContact CG2-CD2 3.23Å; I703-F707 HydrophobicContact CG2-CE2 2.92Å; I703-F707 HydrophobicContact CG2-CG 4.42Å; I703-F707 HydrophobicContact CG2-CZ 3.91Å; I703-F707 WeakPolarHBondContact O-CD2 3.13Å; I703-F707 PolarHBondContact O-N 3.3Å; I703-S724 WeakPolarHBondContact CD1-OG 3.46Å; I703-S724 WeakPolarHBondContact CG1-OG 3.33Å
704	A	42.4	Very low	46.9	Very low	67 Å²	67	78.4 Å²	78.4	55%	0.554	43%	0.429	S	S	*	.	H	α-helix	trans	-61.1	-34.8	178.2	0	0	0	0	0	113.1	N702	N702-A704 PolarHBondContact O-N 3.35Å
705	L	44.2	Very low	46.8	Very low	107 Å²	107	83.1 Å²	83.1	56%	0.56	46%	0.458	S	S	*	.	H	α-helix	trans	-75.1	-35.2	174.1	-72.3	169.1	0	0	0	111.8	N702 I703 F707 Q708	N702-L705 PolarHBondContact O-N 2.96Å; I703-L705 VanDerWaalsContact C-N 3.28Å; I703-L705 PolarHBondContact O-N 3.22Å; L705-F707 VanDerWaalsContact C-N 3.31Å; L705-F707 PolarHBondContact O-N 3.18Å; L705-Q708 PolarHBondContact O-N 3.14Å
706	K	46.2	Very low	47.3	Very low	149 Å²	149	84.5 Å²	84.5	65%	0.648	46%	0.463	S	S	*	.	H	α-helix	trans	-71.8	-20.8	177.6	-76.8	-175	174	-175.3	0	114	N702 I703 Q708	N702-K706 PolarHBondContact O-N 3.11Å; N702-K706 VanDerWaalsContact O-N 3.13Å; I703-K706 PolarHBondContact O-N 2.84Å; I703-K706 VanDerWaalsContact O-N 3.11Å; K706-Q708 VanDerWaalsContact C-N 3.31Å
707	F	46.3	Very low	47.6	Very low	35 Å²	35	83.9 Å²	83.9	15%	0.154	45%	0.452	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	14.3	176.1	-76	-57.9	0	0	0	114.2	I703 L705 S709 L712 I717 K720 R757	I703-F707 HydrophobicContact CB-CE2 4.41Å; I703-F707 HydrophobicContact CG2-CD2 3.23Å; I703-F707 HydrophobicContact CG2-CE2 2.92Å; I703-F707 HydrophobicContact CG2-CG 4.42Å; I703-F707 HydrophobicContact CG2-CZ 3.91Å; I703-F707 WeakPolarHBondContact O-CD2 3.13Å; I703-F707 PolarHBondContact O-N 3.3Å; L705-F707 VanDerWaalsContact C-N 3.31Å; L705-F707 PolarHBondContact O-N 3.18Å; F707-S709 PolarHBondContact O-N 3.45Å; F707-L712 HydrophobicContact CD1-CD1 3.86Å; F707-L712 HydrophobicContact CD1-CD2 4.4Å; F707-L712 HydrophobicContact CE1-CD1 4.28Å; F707-L712 HydrophobicContact CE1-CD2 3.99Å; F707-I717 HydrophobicContact CE1-CG1 4.2Å; F707-I717 HydrophobicContact CZ-CG2 4.32Å; F707-K720 HydrophobicContact CE1-CD 4.46Å; F707-R757 PolarHBondContact O-NH2 3.13Å
708	Q	41.5	Very low	47.8	Very low	153 Å²	153	85.6 Å²	85.6	72%	0.715	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-12.4	170	-84.1	-174	-26.6	0	0	113.4	L705 K706 S710	L705-Q708 PolarHBondContact O-N 3.14Å; K706-Q708 VanDerWaalsContact C-N 3.31Å; Q708-S710 PolarHBondContact O-N 2Å
709	S	46.2	Very low	48.5	Very low	66 Å²	66	87.4 Å²	87.4	46%	0.462	47%	0.471	S	S	.	.	S	Bend	trans	-78.4	116.2	170.1	60.1	0	0	0	0	109.9	F707 E711 L712	F707-S709 PolarHBondContact O-N 3.45Å; S709-E711 PolarHBondContact O-N 3.28Å; S709-L712 VanDerWaalsContact OG-CD1 3.3Å; S709-L712 WeakPolarHBondContact OG-CD1 3.35Å
710	S	41.8	Very low	49	Very low	121 Å²	121	85.3 Å²	85.3	85%	0.846	45%	0.45	S	S	*	.	S	Bend	trans	-70.8	10.8	-170.5	47.2	0	0	0	0	116.5	Q708	Q708-S710 PolarHBondContact O-N 2Å
711	E	44.6	Very low	49.8	Very low	177 Å²	177	76.6 Å²	76.6	83%	0.827	41%	0.413	S	S	*	.			trans	-136.8	79.2	-175.8	-68.8	-173.1	170.6	0	0	111	S709	S709-E711 PolarHBondContact O-N 3.28Å
712	L	48.6	Very low	50.4	Low	23 Å²	23	77.3 Å²	77.3	12%	0.12	41%	0.414	C	S	.	.			trans	-124.5	103.3	-178.5	-113.5	134.5	0	0	0	110.7	F707 S709 D716 I717 K720	F707-L712 HydrophobicContact CD1-CD1 3.86Å; F707-L712 HydrophobicContact CD1-CD2 4.4Å; F707-L712 HydrophobicContact CE1-CD1 4.28Å; F707-L712 HydrophobicContact CE1-CD2 3.99Å; S709-L712 VanDerWaalsContact OG-CD1 3.3Å; S709-L712 WeakPolarHBondContact OG-CD1 3.35Å; L712-D716 HydrophobicContact CD2-CB 3.57Å; L712-D716 WeakPolarHBondContact CD2-OD2 3.26Å; L712-D716 HydrophobicContact CG-CB 4.45Å; L712-I717 HydrophobicContact CB-CG1 4.34Å; L712-I717 HydrophobicContact CD2-CG1 4.09Å; L712-K720 HydrophobicContact CD2-CD 3.71Å; L712-K720 VanDerWaalsContact CD2-NZ 3.34Å
713	E	51.4	Low	51.1	Low	150 Å²	150	77 Å²	77	70%	0.701	41%	0.409	S	S	*	.			trans	-63.9	157.2	173.4	-68.3	-172.6	161.4	0	0	112	V715 D716 I717	E713-V715 VanDerWaalsContact C-N 3.29Å; E713-V715 PolarHBondContact O-N 3.08Å; E713-D716 WeakPolarHBondContact O-CA 3.49Å; E713-D716 WeakPolarHBondContact O-CB 3.42Å; E713-D716 PolarHBondContact O-N 3.2Å; E713-I717 PolarHBondContact O-N 3.09Å
714	Y	47.6	Very low	51.6	Low	25 Å²	25	77.8 Å²	77.8	10%	0.098	42%	0.415	C	S	.	.	H	α-helix	trans	-54.3	-40.5	-176.5	-177.6	-118	0	0	0	114.4	D716 I717 H718 D747 L750 V770	Y714-D716 PolarHBondContact O-N 2.69Å; Y714-I717 PolarHBondContact O-N 2.83Å; Y714-H718 WeakPolarHBondContact O-CB 3.49Å; Y714-H718 PolarHBondContact O-N 2.72Å; Y714-D747 PolarHBondContact OH-OD1 3.4Å; Y714-L750 HydrophobicContact CE2-CD1 4.26Å; Y714-V770 HydrophobicContact CD2-CB 3.99Å; Y714-V770 HydrophobicContact CD2-CG1 3.59Å; Y714-V770 HydrophobicContact CD2-CG2 3.13Å; Y714-V770 HydrophobicContact CE2-CB 4.2Å; Y714-V770 HydrophobicContact CE2-CG1 3.31Å; Y714-V770 HydrophobicContact CE2-CG2 3.83Å; Y714-V770 HydrophobicContact CG-CB 4.5Å; Y714-V770 HydrophobicContact CG-CG1 4.41Å; Y714-V770 HydrophobicContact CG-CG2 3.52Å
715	V	53.4	Low	52.3	Low	107 Å²	107	74.7 Å²	74.7	65%	0.648	39%	0.389	S	S	*	.	H	α-helix	trans	-59.8	-37.8	178.3	-179.8	0	0	0	0	109.9	E713 S719	E713-V715 VanDerWaalsContact C-N 3.29Å; E713-V715 PolarHBondContact O-N 3.08Å; V715-S719 VanDerWaalsContact O-CB 3.29Å; V715-S719 WeakPolarHBondContact O-CB 3.23Å; V715-S719 PolarHBondContact O-N 3.28Å
716	D	57.4	Low	53.2	Low	68 Å²	68	76.8 Å²	76.8	36%	0.364	39%	0.393	S	S	.	.	H	α-helix	trans	-78.4	-33.4	-177.4	-149	40.9	0	0	0	111.2	L712 E713 Y714 K720	L712-D716 HydrophobicContact CD2-CB 3.57Å; L712-D716 WeakPolarHBondContact CD2-OD2 3.26Å; L712-D716 HydrophobicContact CG-CB 4.45Å; E713-D716 WeakPolarHBondContact O-CA 3.49Å; E713-D716 WeakPolarHBondContact O-CB 3.42Å; E713-D716 PolarHBondContact O-N 3.2Å; Y714-D716 PolarHBondContact O-N 2.69Å; D716-K720 WeakPolarHBondContact O-CB 3.42Å; D716-K720 WeakPolarHBondContact O-CG 3.28Å; D716-K720 PolarHBondContact O-N 3.09Å; D716-K720 IonicContact OD2-NZ 2.79Å; D716-K720 PolarHBondContact OD2-NZ 2.79Å
717	I	54.3	Low	53.7	Low	22 Å²	22	75 Å²	75	11%	0.113	40%	0.395	C	S	.	.	H	α-helix	trans	-64.1	-48.6	168.9	-61.4	172.4	0	0	0	110.9	F707 L712 E713 Y714 K720 V721 L750 V754	F707-I717 HydrophobicContact CE1-CG1 4.2Å; F707-I717 HydrophobicContact CZ-CG2 4.32Å; L712-I717 HydrophobicContact CB-CG1 4.34Å; L712-I717 HydrophobicContact CD2-CG1 4.09Å; E713-I717 PolarHBondContact O-N 3.09Å; Y714-I717 PolarHBondContact O-N 2.83Å; I717-K720 PolarHBondContact O-N 3.45Å; I717-V721 HydrophobicContact CG2-CG2 4.43Å; I717-V721 WeakPolarHBondContact O-CB 3.35Å; I717-V721 VanDerWaalsContact O-CG2 3.32Å; I717-V721 WeakPolarHBondContact O-CG2 3.11Å; I717-V721 PolarHBondContact O-N 3.07Å; I717-L750 HydrophobicContact CG2-CD2 4.33Å; I717-V754 HydrophobicContact CD1-CG2 4.45Å
718	H	57.6	Low	54.1	Low	56 Å²	56	75.7 Å²	75.7	26%	0.259	40%	0.4	S	S	.	.	H	α-helix	trans	-62.4	-46.9	-179.5	-171.3	92	0	0	0	110.9	Y714 K720 V721 M722	Y714-H718 WeakPolarHBondContact O-CB 3.49Å; Y714-H718 PolarHBondContact O-N 2.72Å; H718-K720 PolarHBondContact O-N 3.28Å; H718-V721 PolarHBondContact O-N 3.25Å; H718-M722 WeakPolarHBondContact CE1-CE 3.49Å; H718-M722 WeakPolarHBondContact NE2-CE 2.87Å; H718-M722 WeakPolarHBondContact O-CB 3.34Å; H718-M722 VanDerWaalsContact O-CG 3.25Å; H718-M722 WeakPolarHBondContact O-CG 3.41Å; H718-M722 PolarHBondContact O-N 3.04Å
719	S	60.7	Low	54.8	Low	62 Å²	62	74.8 Å²	74.8	43%	0.434	41%	0.407	S	S	.	.	H	α-helix	trans	-56.7	-49.6	175.6	-174.5	0	0	0	0	111.7	V715 V721 M722 E723	V715-S719 VanDerWaalsContact O-CB 3.29Å; V715-S719 WeakPolarHBondContact O-CB 3.23Å; V715-S719 PolarHBondContact O-N 3.28Å; S719-V721 PolarHBondContact O-N 3.32Å; S719-M722 PolarHBondContact O-N 3.38Å; S719-E723 WeakPolarHBondContact O-CB 3.4Å; S719-E723 PolarHBondContact O-N 3.14Å
720	K	57.4	Low	55.3	Low	57 Å²	57	73.4 Å²	73.4	25%	0.248	40%	0.395	C	S	.	.	H	α-helix	trans	-65.4	-35.7	179.5	-79.2	165.8	-179.2	156.2	0	113.3	F707 L712 D716 I717 H718 S724	F707-K720 HydrophobicContact CE1-CD 4.46Å; L712-K720 HydrophobicContact CD2-CD 3.71Å; L712-K720 VanDerWaalsContact CD2-NZ 3.34Å; D716-K720 WeakPolarHBondContact O-CB 3.42Å; D716-K720 WeakPolarHBondContact O-CG 3.28Å; D716-K720 PolarHBondContact O-N 3.09Å; D716-K720 IonicContact OD2-NZ 2.79Å; D716-K720 PolarHBondContact OD2-NZ 2.79Å; I717-K720 PolarHBondContact O-N 3.45Å; H718-K720 PolarHBondContact O-N 3.28Å; K720-S724 WeakPolarHBondContact O-CB 3.46Å; K720-S724 PolarHBondContact O-N 2.88Å; K720-S724 PolarHBondContact O-OG 2.89Å
721	V	60.8	Low	56	Low	7 Å²	7	67.7 Å²	67.7	4%	0.042	36%	0.355	C	S	.	.	H	α-helix	trans	-67.4	-43.5	173.2	170.4	0	0	0	0	110.7	I717 H718 S719 S724 L725 L750	I717-V721 HydrophobicContact CG2-CG2 4.43Å; I717-V721 WeakPolarHBondContact O-CB 3.35Å; I717-V721 VanDerWaalsContact O-CG2 3.32Å; I717-V721 WeakPolarHBondContact O-CG2 3.11Å; I717-V721 PolarHBondContact O-N 3.07Å; H718-V721 PolarHBondContact O-N 3.25Å; S719-V721 PolarHBondContact O-N 3.32Å; V721-S724 PolarHBondContact O-N 2.95Å; V721-L725 HydrophobicContact CG1-CD1 4.22Å; V721-L725 WeakPolarHBondContact O-CB 3.27Å; V721-L725 WeakPolarHBondContact O-CG 3.37Å; V721-L725 PolarHBondContact O-N 2.94Å; V721-L750 HydrophobicContact CB-CD2 4.21Å; V721-L750 HydrophobicContact CG1-CD2 4.18Å; V721-L750 HydrophobicContact CG2-CD2 3.77Å
722	M	63.2	Low	56.8	Low	43 Å²	43	62.9 Å²	62.9	21%	0.212	35%	0.346	C	S	.	.	H	α-helix	trans	-62.8	-42.4	175.9	-70.2	-58.6	-172.9	0	0	111.9	H718 S719 L725 K726 L735 L746	H718-M722 WeakPolarHBondContact CE1-CE 3.49Å; H718-M722 WeakPolarHBondContact NE2-CE 2.87Å; H718-M722 WeakPolarHBondContact O-CB 3.34Å; H718-M722 VanDerWaalsContact O-CG 3.25Å; H718-M722 WeakPolarHBondContact O-CG 3.41Å; H718-M722 PolarHBondContact O-N 3.04Å; S719-M722 PolarHBondContact O-N 3.38Å; M722-L725 PolarHBondContact O-N 2.81Å; M722-L725 HydrophobicContact SD-CD1 4.34Å; M722-K726 WeakPolarHBondContact O-CG 3.47Å; M722-K726 PolarHBondContact O-N 3.23Å; M722-K726 VanDerWaalsContact O-N 3.11Å; M722-L735 HydrophobicContact CB-CD2 4.43Å; M722-L735 HydrophobicContact CG-CD2 4.48Å; M722-L735 HydrophobicContact SD-CD2 3.24Å; M722-L735 WeakPolarHBondContact SD-CD2 3.37Å; M722-L746 HydrophobicContact CE-CD2 3.3Å; M722-L746 HydrophobicContact SD-CD2 4.43Å
723	E	61.6	Low	57.1	Low	113 Å²	113	65.9 Å²	65.9	53%	0.528	36%	0.355	S	S	.	.	H	α-helix	trans	-64.7	-41.3	176.9	-167.9	177.6	-161.7	0	0	111.7	S719 K726 T727	S719-E723 WeakPolarHBondContact O-CB 3.4Å; S719-E723 PolarHBondContact O-N 3.14Å; E723-K726 WeakPolarHBondContact O-CB 3.42Å; E723-K726 PolarHBondContact O-N 3.06Å; E723-K726 VanDerWaalsContact O-N 3.16Å; E723-T727 PolarHBondContact O-N 2.87Å
724	S	56.1	Low	57.2	Low	25 Å²	25	59.5 Å²	59.5	18%	0.175	33%	0.326	C	S	.	.	H	α-helix	trans	-74	-29.2	178.1	-54.2	0	0	0	0	113.1	I703 K720 V721 K726 T727	I703-S724 WeakPolarHBondContact CD1-OG 3.46Å; I703-S724 WeakPolarHBondContact CG1-OG 3.33Å; K720-S724 WeakPolarHBondContact O-CB 3.46Å; K720-S724 PolarHBondContact O-N 2.88Å; K720-S724 PolarHBondContact O-OG 2.89Å; V721-S724 PolarHBondContact O-N 2.95Å; S724-K726 VanDerWaalsContact C-N 3.3Å; S724-T727 PolarHBondContact O-N 2.93Å; S724-T727 PolarHBondContact O-OG1 2.74Å
725	L	57.3	Low	57.8	Low	3 Å²	3	59.8 Å²	59.8	2%	0.016	33%	0.329	C	S	.	.	H	α-helix	trans	-60.7	-43.4	167.4	-79.2	170.3	0	0	0	109.8	L694 V721 M722 T727 L728 G731 M734 L735 L738	L694-L725 HydrophobicContact CD1-CD2 3.73Å; V721-L725 HydrophobicContact CG1-CD1 4.22Å; V721-L725 WeakPolarHBondContact O-CB 3.27Å; V721-L725 WeakPolarHBondContact O-CG 3.37Å; V721-L725 PolarHBondContact O-N 2.94Å; M722-L725 PolarHBondContact O-N 2.81Å; M722-L725 HydrophobicContact SD-CD1 4.34Å; L725-T727 PolarHBondContact O-N 2.7Å; L725-T727 VanDerWaalsContact O-N 3.17Å; L725-L728 HydrophobicContact CD2-CD1 4.16Å; L725-L728 PolarHBondContact O-N 2.74Å; L725-L728 VanDerWaalsContact O-N 3.14Å; L725-G731 WeakPolarHBondContact O-CA 3.48Å; L725-M734 HydrophobicContact CD2-CB 4.36Å; L725-M734 HydrophobicContact CD2-CE 4.16Å; L725-M734 HydrophobicContact CD2-SD 4.01Å; L725-L735 HydrophobicContact CB-CD1 4.42Å; L725-L735 HydrophobicContact CB-CD2 3.97Å; L725-L735 HydrophobicContact CB-CG 4.09Å; L725-L735 HydrophobicContact CD1-CD2 3.97Å; L725-L738 HydrophobicContact CD1-CD1 3.9Å
726	K	62.6	Low	58	Low	150 Å²	150	62 Å²	62	65%	0.652	33%	0.332	S	S	*	.	H	α-helix	trans	-58.3	-28.3	177.6	-67.3	176.6	-176.6	175.8	0	113.9	M722 E723 S724 L735	M722-K726 WeakPolarHBondContact O-CG 3.47Å; M722-K726 PolarHBondContact O-N 3.23Å; M722-K726 VanDerWaalsContact O-N 3.11Å; E723-K726 WeakPolarHBondContact O-CB 3.42Å; E723-K726 PolarHBondContact O-N 3.06Å; E723-K726 VanDerWaalsContact O-N 3.16Å; S724-K726 VanDerWaalsContact C-N 3.3Å; K726-L735 HydrophobicContact CB-CD1 4.37Å; K726-L735 HydrophobicContact CD-CD1 4.49Å; K726-L735 HydrophobicContact CG-CD1 3.38Å
727	T	56.8	Low	57.7	Low	111 Å²	111	61.7 Å²	61.7	68%	0.681	33%	0.329	S	S	*	.	H	α-helix	trans	-83.5	-13.8	-178.5	63.5	0	0	0	0	113.7	E723 S724 L725	E723-T727 PolarHBondContact O-N 2.87Å; S724-T727 PolarHBondContact O-N 2.93Å; S724-T727 PolarHBondContact O-OG1 2.74Å; L725-T727 PolarHBondContact O-N 2.7Å; L725-T727 VanDerWaalsContact O-N 3.17Å
728	L	55.1	Low	57.6	Low	51 Å²	51	61.4 Å²	61.4	27%	0.267	33%	0.328	S	S	.	.	S	Bend	trans	-72.4	144.6	173.1	-70.9	164.3	0	0	0	110	A697 L725 D730 G731	A697-L728 HydrophobicContact CB-CD1 3.99Å; A697-L728 HydrophobicContact CB-CD2 4.43Å; L725-L728 HydrophobicContact CD2-CD1 4.16Å; L725-L728 PolarHBondContact O-N 2.74Å; L725-L728 VanDerWaalsContact O-N 3.14Å; L728-D730 PolarHBondContact O-N 2.78Å; L728-D730 VanDerWaalsContact O-N 3.09Å; L728-G731 WeakPolarHBondContact O-CA 3.48Å; L728-G731 PolarHBondContact O-N 2.99Å
729	P	57	Low	57.3	Low	133 Å²	133	64.2 Å²	64.2	86%	0.864	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-32.5	178.6	-23.8	31.5	0	0	0	113.5
730	D	55.9	Low	56.7	Low	38 Å²	38	63.3 Å²	63.3	20%	0.203	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	10.6	178.3	-68.1	-27.6	0	0	0	113	S595 S597 L728 A732 W733 M734	S595-D730 WeakPolarHBondContact CB-OD2 3.34Å; S597-D730 VanDerWaalsContact CB-OD1 3.31Å; S597-D730 WeakPolarHBondContact CB-OD1 3.32Å; S597-D730 PolarHBondContact N-OD2 3.4Å; S597-D730 PolarHBondContact OG-OD1 3.04Å; S597-D730 PolarHBondContact OG-OD2 2.9Å; S597-D730 VanDerWaalsContact OG-OD2 3.12Å; L728-D730 PolarHBondContact O-N 2.78Å; L728-D730 VanDerWaalsContact O-N 3.09Å; D730-A732 PolarHBondContact O-N 3Å; D730-W733 PolarHBondContact O-N 3.43Å; D730-M734 WeakPolarHBondContact O-CG 3.37Å; D730-M734 PolarHBondContact O-N 2.99Å; D730-M734 VanDerWaalsContact O-N 3.12Å
731	G	57	Low	56.1	Low	0 Å²	0	66.7 Å²	66.7	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-58.1	-48.6	-169.6	0	0	0	0	0	115.9	L725 L728 W733 M734 L735	L725-G731 WeakPolarHBondContact O-CA 3.48Å; L728-G731 WeakPolarHBondContact O-CA 3.48Å; L728-G731 PolarHBondContact O-N 2.99Å; G731-W733 VanDerWaalsContact C-N 3.27Å; G731-W733 PolarHBondContact O-N 3.12Å; G731-M734 PolarHBondContact O-N 3.12Å; G731-L735 VanDerWaalsContact O-CG 3.3Å; G731-L735 WeakPolarHBondContact O-CG 3.34Å; G731-L735 PolarHBondContact O-N 3Å
732	A	60.5	Low	55.2	Low	77 Å²	77	69.7 Å²	69.7	64%	0.636	39%	0.388	S	S	*	.	H	α-helix	trans	-60.6	-38.2	179.5	0	0	0	0	0	112.1	D730 L735 H736	D730-A732 PolarHBondContact O-N 3Å; A732-L735 PolarHBondContact O-N 3.08Å; A732-H736 PolarHBondContact O-N 2.93Å
733	W	55	Low	54.5	Low	85 Å²	85	75.1 Å²	75.1	32%	0.322	41%	0.406	S	S	.	.	H	α-helix	trans	-68.6	-43.6	177.1	-179.3	82.6	0	0	0	111.7	V596 V600 L690 D730 G731 L735 H736 I737	V596-W733 HydrophobicContact CG1-CZ3 4.43Å; V600-W733 HydrophobicContact CB-CH2 4.13Å; V600-W733 HydrophobicContact CB-CZ2 4.13Å; V600-W733 HydrophobicContact CG1-CH2 4.14Å; V600-W733 HydrophobicContact CG1-CZ2 3.81Å; V600-W733 HydrophobicContact CG2-CH2 3.88Å; V600-W733 HydrophobicContact CG2-CZ2 4.37Å; L690-W733 HydrophobicContact CD1-CH2 4.24Å; L690-W733 HydrophobicContact CD1-CZ3 3.67Å; D730-W733 PolarHBondContact O-N 3.43Å; G731-W733 VanDerWaalsContact C-N 3.27Å; G731-W733 PolarHBondContact O-N 3.12Å; W733-L735 VanDerWaalsContact C-N 3.33Å; W733-L735 PolarHBondContact O-N 3.38Å; W733-H736 PolarHBondContact O-N 2.83Å; W733-I737 HydrophobicContact CD2-CD1 3.81Å; W733-I737 HydrophobicContact CE3-CD1 3.97Å; W733-I737 HydrophobicContact CH2-CD1 3.35Å; W733-I737 HydrophobicContact CZ2-CD1 3.18Å; W733-I737 HydrophobicContact CZ3-CD1 3.76Å; W733-I737 PolarHBondContact O-N 3.1Å
734	M	54.6	Low	53.8	Low	16 Å²	16	73.6 Å²	73.6	8%	0.079	41%	0.407	C	S	.	.	H	α-helix	trans	-59.6	-44.2	174.6	-64.1	176.7	88.2	0	0	111.1	L690 L694 L725 D730 G731 H736 I737 L738	L690-M734 HydrophobicContact CD1-CE 4.47Å; L690-M734 HydrophobicContact CD1-CG 4.4Å; L690-M734 HydrophobicContact CD2-CE 3.82Å; L690-M734 HydrophobicContact CG-CE 3.85Å; L694-M734 HydrophobicContact CD1-CE 3.84Å; L725-M734 HydrophobicContact CD2-CB 4.36Å; L725-M734 HydrophobicContact CD2-CE 4.16Å; L725-M734 HydrophobicContact CD2-SD 4.01Å; D730-M734 WeakPolarHBondContact O-CG 3.37Å; D730-M734 PolarHBondContact O-N 2.99Å; D730-M734 VanDerWaalsContact O-N 3.12Å; G731-M734 PolarHBondContact O-N 3.12Å; M734-H736 PolarHBondContact O-N 2.81Å; M734-I737 PolarHBondContact O-N 3.01Å; M734-L738 WeakPolarHBondContact O-CD1 3.32Å; M734-L738 WeakPolarHBondContact O-CG 3.4Å; M734-L738 PolarHBondContact O-N 2.84Å; M734-L738 VanDerWaalsContact O-N 3.14Å
735	L	59.8	Low	53.5	Low	31 Å²	31	74.4 Å²	74.4	16%	0.162	41%	0.412	C	S	.	.	H	α-helix	trans	-61.3	-43.8	177.9	-72	167.3	0	0	0	112.3	M722 L725 K726 G731 A732 W733 I737 L738 D739	M722-L735 HydrophobicContact CB-CD2 4.43Å; M722-L735 HydrophobicContact CG-CD2 4.48Å; M722-L735 HydrophobicContact SD-CD2 3.24Å; M722-L735 WeakPolarHBondContact SD-CD2 3.37Å; L725-L735 HydrophobicContact CB-CD1 4.42Å; L725-L735 HydrophobicContact CB-CD2 3.97Å; L725-L735 HydrophobicContact CB-CG 4.09Å; L725-L735 HydrophobicContact CD1-CD2 3.97Å; K726-L735 HydrophobicContact CB-CD1 4.37Å; K726-L735 HydrophobicContact CD-CD1 4.49Å; K726-L735 HydrophobicContact CG-CD1 3.38Å; G731-L735 VanDerWaalsContact O-CG 3.3Å; G731-L735 WeakPolarHBondContact O-CG 3.34Å; G731-L735 PolarHBondContact O-N 3Å; A732-L735 PolarHBondContact O-N 3.08Å; W733-L735 VanDerWaalsContact C-N 3.33Å; W733-L735 PolarHBondContact O-N 3.38Å; L735-I737 VanDerWaalsContact C-N 3.29Å; L735-I737 PolarHBondContact O-N 3.02Å; L735-L738 CarbonylContact O-C 3.6Å; L735-L738 PolarHBondContact O-N 3.06Å; L735-L738 VanDerWaalsContact O-N 3.11Å; L735-D739 WeakPolarHBondContact O-CB 3.44Å; L735-D739 PolarHBondContact O-N 3.32Å
736	H	57.5	Low	53.3	Low	155 Å²	155	74.8 Å²	74.8	72%	0.718	41%	0.414	S	S	*	.	H	α-helix	trans	-65.5	-31.4	-179.2	-162.6	-55.9	0	0	0	112.9	A732 W733 M734	A732-H736 PolarHBondContact O-N 2.93Å; W733-H736 PolarHBondContact O-N 2.83Å; M734-H736 PolarHBondContact O-N 2.81Å
737	I	51.1	Low	52.9	Low	60 Å²	60	69 Å²	69	31%	0.308	39%	0.391	S	S	.	.	H	α-helix	trans	-72.3	-36.8	173.6	-70.4	173.2	0	0	0	111	W733 M734 L735 S740	W733-I737 HydrophobicContact CD2-CD1 3.81Å; W733-I737 HydrophobicContact CE3-CD1 3.97Å; W733-I737 HydrophobicContact CH2-CD1 3.35Å; W733-I737 HydrophobicContact CZ2-CD1 3.18Å; W733-I737 HydrophobicContact CZ3-CD1 3.76Å; W733-I737 PolarHBondContact O-N 3.1Å; M734-I737 PolarHBondContact O-N 3.01Å; L735-I737 VanDerWaalsContact C-N 3.29Å; L735-I737 PolarHBondContact O-N 3.02Å; I737-S740 WeakPolarHBondContact O-CB 3.39Å
738	L	51.4	Low	52.6	Low	17 Å²	17	70.4 Å²	70.4	9%	0.089	38%	0.383	C	S	.	.	H	α-helix	trans	-75.5	-27.2	-179.5	-66.9	169.8	0	0	0	113.1	L725 M734 L735 S740 L746	L725-L738 HydrophobicContact CD1-CD1 3.9Å; M734-L738 WeakPolarHBondContact O-CD1 3.32Å; M734-L738 WeakPolarHBondContact O-CG 3.4Å; M734-L738 PolarHBondContact O-N 2.84Å; M734-L738 VanDerWaalsContact O-N 3.14Å; L735-L738 CarbonylContact O-C 3.6Å; L735-L738 PolarHBondContact O-N 3.06Å; L735-L738 VanDerWaalsContact O-N 3.11Å; L738-S740 PolarHBondContact O-N 3.35Å; L738-L746 HydrophobicContact CD1-CD1 3.74Å; L738-L746 HydrophobicContact CD1-CD2 4.41Å; L738-L746 HydrophobicContact CD2-CB 4.14Å; L738-L746 HydrophobicContact CD2-CD1 3.95Å; L738-L746 HydrophobicContact CD2-CG 4.5Å; L738-L746 HydrophobicContact CG-CD1 4.42Å
739	D	51.3	Low	52.5	Low	115 Å²	115	69 Å²	69	62%	0.615	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	0.3	178	-152.1	21.5	0	0	0	113.2	L735 R743	L735-D739 WeakPolarHBondContact O-CB 3.44Å; L735-D739 PolarHBondContact O-N 3.32Å; D739-R743 IonicContact OD1-NH2 3.55Å
740	S	48.6	Very low	52.3	Low	42 Å²	42	62.9 Å²	62.9	29%	0.294	34%	0.337	S	S	.	.	S	Bend	trans	-63.7	141.8	167.9	-168.4	0	0	0	0	110.5	I737 L738 S742	I737-S740 WeakPolarHBondContact O-CB 3.39Å; L738-S740 PolarHBondContact O-N 3.35Å; S740-S742 CarbonylContact O-C 3.53Å; S740-S742 PolarHBondContact O-N 2.99Å
741	P	44.2	Very low	52.1	Low	128 Å²	128	62.1 Å²	62.1	83%	0.831	33%	0.333	S	S	*	.	S	Bend	trans	-57.1	-9	-173.9	17.1	-30.8	0	0	0	115.9	R743	P741-R743 VanDerWaalsContact C-N 3.27Å; P741-R743 PolarHBondContact O-N 3.42Å; P741-R743 VanDerWaalsContact O-N 3.13Å
742	S	42.7	Very low	51.8	Low	70 Å²	70	70.2 Å²	70.2	49%	0.49	36%	0.363	S	S	.	.			trans	-81.8	59.3	167.7	63	0	0	0	0	112.8	S740 C744	S740-S742 CarbonylContact O-C 3.53Å; S740-S742 PolarHBondContact O-N 2.99Å; S742-C744 PolarHBondContact O-N 3.16Å; S742-C744 VanDerWaalsContact O-N 3.15Å
743	R	47.8	Very low	51.3	Low	157 Å²	157	69.3 Å²	69.3	59%	0.592	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-18.7	-180	-74.5	-176.4	176.4	-177.9	-2.4	115.2	D739 P741 S745 L746	D739-R743 IonicContact OD1-NH2 3.55Å; P741-R743 VanDerWaalsContact C-N 3.27Å; P741-R743 PolarHBondContact O-N 3.42Å; P741-R743 VanDerWaalsContact O-N 3.13Å; R743-S745 PolarHBondContact O-N 2.8Å; R743-L746 PolarHBondContact O-N 2.79Å
744	C	48.5	Very low	51	Low	82 Å²	82	66.6 Å²	66.6	55%	0.554	34%	0.34	S	S	*	.	H	α-helix	trans	-54.5	-21	-175.2	-66	0	0	0	0	116.5	S742 R748	S742-C744 PolarHBondContact O-N 3.16Å; S742-C744 VanDerWaalsContact O-N 3.15Å; C744-R748 WeakPolarHBondContact O-CG 3.34Å; C744-R748 PolarHBondContact O-N 2.91Å
745	S	49.3	Very low	50.8	Low	41 Å²	41	68.2 Å²	68.2	29%	0.287	35%	0.353	S	S	.	.	H	α-helix	trans	-81.5	-35.6	-177.1	83.2	0	0	0	0	113.7	R743 T749	R743-S745 PolarHBondContact O-N 2.8Å; S745-T749 PolarHBondContact O-N 3Å; S745-T749 PolarHBondContact O-OG1 2.94Å
746	L	53.3	Low	50.2	Low	11 Å²	11	76.1 Å²	76.1	6%	0.058	38%	0.381	C	S	.	.	H	α-helix	trans	-70.2	-46.8	177.5	-171.3	67.4	0	0	0	110	M722 L738 R743 R748 T749 L750	M722-L746 HydrophobicContact CE-CD2 3.3Å; M722-L746 HydrophobicContact SD-CD2 4.43Å; L738-L746 HydrophobicContact CD1-CD1 3.74Å; L738-L746 HydrophobicContact CD1-CD2 4.41Å; L738-L746 HydrophobicContact CD2-CB 4.14Å; L738-L746 HydrophobicContact CD2-CD1 3.95Å; L738-L746 HydrophobicContact CD2-CG 4.5Å; L738-L746 HydrophobicContact CG-CD1 4.42Å; R743-L746 PolarHBondContact O-N 2.79Å; L746-R748 VanDerWaalsContact C-N 3.32Å; L746-R748 PolarHBondContact O-N 2.8Å; L746-T749 WeakPolarHBondContact O-CA 3.49Å; L746-T749 WeakPolarHBondContact O-CB 3.34Å; L746-T749 PolarHBondContact O-N 2.84Å; L746-L750 HydrophobicContact CG-CD1 4.25Å; L746-L750 PolarHBondContact O-N 3.12Å
747	D	53.5	Low	49.8	Very low	30 Å²	30	76.9 Å²	76.9	16%	0.16	38%	0.377	C	S	.	.	H	α-helix	trans	-55.3	-43.9	178.2	-71.8	-20.6	0	0	0	112.3	Y714 T749 L750 L751 V774	Y714-D747 PolarHBondContact OH-OD1 3.4Å; D747-T749 VanDerWaalsContact C-N 3.29Å; D747-T749 PolarHBondContact O-N 2.94Å; D747-L750 PolarHBondContact O-N 2.98Å; D747-L751 WeakPolarHBondContact O-CB 3.3Å; D747-L751 PolarHBondContact O-N 3.09Å; D747-V774 HydrophobicContact CB-CB 4.21Å; D747-V774 HydrophobicContact CB-CG1 3.54Å; D747-V774 HydrophobicContact CB-CG2 3.55Å
748	R	51.2	Low	49.7	Very low	139 Å²	139	76.2 Å²	76.2	53%	0.525	37%	0.373	S	S	.	.	H	α-helix	trans	-63.7	-31.8	174	-78.1	-178.8	-170.7	-179.1	5.3	113.5	C744 L746 R752	C744-R748 WeakPolarHBondContact O-CG 3.34Å; C744-R748 PolarHBondContact O-N 2.91Å; L746-R748 VanDerWaalsContact C-N 3.32Å; L746-R748 PolarHBondContact O-N 2.8Å; R748-R752 WeakPolarHBondContact O-CG 3.41Å; R748-R752 PolarHBondContact O-N 3.46Å
749	T	52.4	Low	49.2	Very low	22 Å²	22	86.9 Å²	86.9	14%	0.135	41%	0.412	C	S	.	.	H	α-helix	trans	-78.3	-40.4	-179.1	-52.1	0	0	0	0	110.7	L694 S745 L746 D747 L751 R752 L753	L694-T749 HydrophobicContact CD2-CG2 4.08Å; S745-T749 PolarHBondContact O-N 3Å; S745-T749 PolarHBondContact O-OG1 2.94Å; L746-T749 WeakPolarHBondContact O-CA 3.49Å; L746-T749 WeakPolarHBondContact O-CB 3.34Å; L746-T749 PolarHBondContact O-N 2.84Å; D747-T749 VanDerWaalsContact C-N 3.29Å; D747-T749 PolarHBondContact O-N 2.94Å; T749-L751 VanDerWaalsContact C-N 3.35Å; T749-R752 PolarHBondContact O-N 2.92Å; T749-L753 PolarHBondContact O-N 3.43Å
750	L	53.3	Low	48.9	Very low	5 Å²	5	86.5 Å²	86.5	3%	0.026	42%	0.418	C	S	.	.	H	α-helix	trans	-56.8	-47.6	169.1	-70.9	170.6	0	0	0	110.8	Y714 I717 V721 L746 D747 R752 L753 V754	Y714-L750 HydrophobicContact CE2-CD1 4.26Å; I717-L750 HydrophobicContact CG2-CD2 4.33Å; V721-L750 HydrophobicContact CB-CD2 4.21Å; V721-L750 HydrophobicContact CG1-CD2 4.18Å; V721-L750 HydrophobicContact CG2-CD2 3.77Å; L746-L750 HydrophobicContact CG-CD1 4.25Å; L746-L750 PolarHBondContact O-N 3.12Å; D747-L750 PolarHBondContact O-N 2.98Å; L750-R752 VanDerWaalsContact C-N 3.31Å; L750-R752 PolarHBondContact O-N 2.77Å; L750-L753 PolarHBondContact O-N 3.47Å; L750-L753 VanDerWaalsContact O-N 3.15Å; L750-V754 VanDerWaalsContact O-CG2 3.31Å; L750-V754 WeakPolarHBondContact O-CG2 3.36Å; L750-V754 PolarHBondContact O-N 3.06Å
751	L	51.7	Low	48.4	Very low	21 Å²	21	91 Å²	91	11%	0.11	44%	0.436	C	S	.	.	H	α-helix	trans	-56.9	-39.9	174.7	-111.8	133.3	0	0	0	113.5	D747 T749 S755 V770 A771 V774 F778	D747-L751 WeakPolarHBondContact O-CB 3.3Å; D747-L751 PolarHBondContact O-N 3.09Å; T749-L751 VanDerWaalsContact C-N 3.35Å; L751-S755 VanDerWaalsContact O-CB 3.29Å; L751-S755 WeakPolarHBondContact O-CB 3.48Å; L751-S755 PolarHBondContact O-N 2.95Å; L751-S755 PolarHBondContact O-OG 3.29Å; L751-S755 VanDerWaalsContact O-OG 3.07Å; L751-V770 HydrophobicContact CD1-CG1 3.97Å; L751-V770 HydrophobicContact CG-CG1 3.99Å; L751-A771 HydrophobicContact CD2-CB 4.09Å; L751-V774 HydrophobicContact CD1-CB 3.64Å; L751-V774 HydrophobicContact CD1-CG1 3.8Å; L751-V774 HydrophobicContact CD1-CG2 3.72Å; L751-F778 HydrophobicContact CD2-CE2 3.6Å; L751-F778 HydrophobicContact CD2-CZ 3.97Å
752	R	51	Low	48.4	Very low	170 Å²	170	94.1 Å²	94.1	64%	0.642	44%	0.44	S	S	*	.	H	α-helix	trans	-71.3	-34.1	176.8	-76.4	178.4	-177.2	178.1	-1.2	113.2	R748 T749 L750 S755 R756	R748-R752 WeakPolarHBondContact O-CG 3.41Å; R748-R752 PolarHBondContact O-N 3.46Å; T749-R752 PolarHBondContact O-N 2.92Å; L750-R752 VanDerWaalsContact C-N 3.31Å; L750-R752 PolarHBondContact O-N 2.77Å; R752-S755 WeakPolarHBondContact CA-OG 3.5Å; R752-S755 PolarHBondContact O-OG 3.46Å; R752-R756 VanDerWaalsContact O-CB 3.29Å; R752-R756 WeakPolarHBondContact O-CB 3.42Å; R752-R756 WeakPolarHBondContact O-CG 3.3Å; R752-R756 PolarHBondContact O-N 2.99Å
753	L	48.9	Very low	48.5	Very low	59 Å²	59	97.2 Å²	97.2	31%	0.309	46%	0.456	S	S	.	.	H	α-helix	trans	-67.6	-46.5	175.8	-81.8	160.8	0	0	0	110.5	I698 T749 L750 R757	I698-L753 HydrophobicContact CD1-CD1 3.63Å; T749-L753 PolarHBondContact O-N 3.43Å; L750-L753 PolarHBondContact O-N 3.47Å; L750-L753 VanDerWaalsContact O-N 3.15Å; L753-R757 PolarHBondContact O-N 2.99Å
754	V	50	Low	48.6	Very low	27 Å²	27	93.3 Å²	93.3	16%	0.164	45%	0.447	C	S	.	.	H	α-helix	trans	-60	-48.2	173.9	175	0	0	0	0	110.2	I717 L750 R756 R757 E758 V767	I717-V754 HydrophobicContact CD1-CG2 4.45Å; L750-V754 VanDerWaalsContact O-CG2 3.31Å; L750-V754 WeakPolarHBondContact O-CG2 3.36Å; L750-V754 PolarHBondContact O-N 3.06Å; V754-R756 PolarHBondContact O-N 3.48Å; V754-R757 PolarHBondContact O-N 2.89Å; V754-E758 PolarHBondContact O-N 2.76Å; V754-V767 HydrophobicContact CG1-CB 4.18Å; V754-V767 HydrophobicContact CG1-CG1 4.12Å; V754-V767 HydrophobicContact CG1-CG2 3.29Å
755	S	48.6	Very low	48.8	Very low	50 Å²	50	93 Å²	93	35%	0.35	45%	0.45	S	S	.	.	H	α-helix	trans	-73.2	-26.4	-178.8	71	0	0	0	0	115.6	L751 R752	L751-S755 VanDerWaalsContact O-CB 3.29Å; L751-S755 WeakPolarHBondContact O-CB 3.48Å; L751-S755 PolarHBondContact O-N 2.95Å; L751-S755 PolarHBondContact O-OG 3.29Å; L751-S755 VanDerWaalsContact O-OG 3.07Å; R752-S755 WeakPolarHBondContact CA-OG 3.5Å; R752-S755 PolarHBondContact O-OG 3.46Å
756	R	48.2	Very low	48.8	Very low	198 Å²	198	93.4 Å²	93.4	75%	0.747	45%	0.451	S	S	*	.	H	α-helix	trans	-70.4	-32.9	172.1	-89.9	-175.4	172.2	-179.2	-2.7	112.3	R752 V754 E758	R752-R756 VanDerWaalsContact O-CB 3.29Å; R752-R756 WeakPolarHBondContact O-CB 3.42Å; R752-R756 WeakPolarHBondContact O-CG 3.3Å; R752-R756 PolarHBondContact O-N 2.99Å; V754-R756 PolarHBondContact O-N 3.48Å; R756-E758 VanDerWaalsContact C-N 3.3Å
757	R	49.8	Very low	48.6	Very low	170 Å²	170	93.5 Å²	93.5	64%	0.642	45%	0.452	S	S	*	.	H	α-helix	trans	-68.4	-33	175.4	-166.8	-180	-174.7	-173.5	2.5	111.2	F707 L753 V754	F707-R757 PolarHBondContact O-NH2 3.13Å; L753-R757 PolarHBondContact O-N 2.99Å; V754-R757 PolarHBondContact O-N 2.89Å
758	E	48.4	Very low	48.5	Very low	47 Å²	47	98.8 Å²	98.8	22%	0.22	47%	0.474	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	19	-170.2	-92	-179.2	-156.9	0	0	116.2	V754 R756 S760 M761 D764 V767	V754-E758 PolarHBondContact O-N 2.76Å; R756-E758 VanDerWaalsContact C-N 3.3Å; E758-S760 PolarHBondContact O-N 3.26Å; E758-M761 CarbonylContact O-C 3.57Å; E758-M761 PolarHBondContact O-N 3.46Å; E758-D764 WeakPolarHBondContact OE1-CB 3.42Å; E758-V767 WeakPolarHBondContact OE1-CG2 3.22Å; E758-V767 WeakPolarHBondContact OE2-CG2 3.16Å
759	R	40.3	Very low	48.6	Very low	241 Å²	241	96.7 Å²	96.7	91%	0.909	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-12.6	167.7	-93.3	-171.3	-173	-178.8	1	113.6
760	S	44.8	Very low	48.3	Very low	106 Å²	106	95.8 Å²	95.8	74%	0.741	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-6.7	172.2	62.3	0	0	0	0	116.1	E758	E758-S760 PolarHBondContact O-N 3.26Å
761	M	37.7	Very low	48.1	Very low	137 Å²	137	95.6 Å²	95.6	68%	0.675	46%	0.463	S	S	*	.			trans	-151.4	95.5	179.2	-74.4	-167.1	168.3	0	0	111.4	E758 T763	E758-M761 CarbonylContact O-C 3.57Å; E758-M761 PolarHBondContact O-N 3.46Å; M761-T763 VanDerWaalsContact C-N 3.26Å; M761-T763 PolarHBondContact O-N 3.41Å; M761-T763 VanDerWaalsContact O-N 3.15Å
762	Q	44.4	Very low	48.1	Very low	193 Å²	193	100.5 Å²	100.5	90%	0.902	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	23	-171.6	-127.7	175.8	3.4	0	0	115
763	T	45.5	Very low	47.9	Very low	136 Å²	136	97.8 Å²	97.8	83%	0.834	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.6	20.4	-168.1	54.8	0	0	0	0	116.2	M761	M761-T763 VanDerWaalsContact C-N 3.26Å; M761-T763 PolarHBondContact O-N 3.41Å; M761-T763 VanDerWaalsContact O-N 3.15Å
764	D	50.6	Low	47.8	Very low	74 Å²	74	96.3 Å²	96.3	40%	0.396	48%	0.475	S	S	.	.			trans	-80.7	125.7	179.8	-160.8	-46.6	0	0	0	112.6	E758 T766 V767	E758-D764 WeakPolarHBondContact OE1-CB 3.42Å; D764-T766 PolarHBondContact O-N 2.98Å; D764-T766 VanDerWaalsContact OD1-CB 3.23Å; D764-T766 WeakPolarHBondContact OD1-CB 3.49Å; D764-T766 PolarHBondContact OD1-N 3.04Å; D764-T766 PolarHBondContact OD1-OG1 3.46Å; D764-V767 HydrophobicContact CB-CG2 4.32Å; D764-V767 PolarHBondContact O-N 2.94Å
765	A	52.4	Low	47.4	Very low	75 Å²	75	98.3 Å²	98.3	62%	0.62	50%	0.501	S	S	*	.	H	α-helix	trans	-60	-27.2	179.1	0	0	0	0	0	112.7	K768 H769	A765-K768 PolarHBondContact O-N 2.9Å; A765-H769 WeakPolarHBondContact O-CB 3.25Å; A765-H769 PolarHBondContact O-N 2.95Å
766	T	48.6	Very low	46.8	Very low	51 Å²	51	103.6 Å²	103.6	31%	0.313	51%	0.513	S	S	.	.	H	α-helix	trans	-62.6	-47.3	178.1	-45.1	0	0	0	0	110	D764 K768 H769 V770	D764-T766 PolarHBondContact O-N 2.98Å; D764-T766 VanDerWaalsContact OD1-CB 3.23Å; D764-T766 WeakPolarHBondContact OD1-CB 3.49Å; D764-T766 PolarHBondContact OD1-N 3.04Å; D764-T766 PolarHBondContact OD1-OG1 3.46Å; T766-K768 VanDerWaalsContact C-N 3.31Å; T766-K768 PolarHBondContact O-N 2.61Å; T766-H769 WeakPolarHBondContact O-CB 3.37Å; T766-H769 PolarHBondContact O-N 3.42Å; T766-V770 VanDerWaalsContact O-CG2 3.28Å; T766-V770 WeakPolarHBondContact O-CG2 3.3Å; T766-V770 PolarHBondContact O-N 2.91Å
767	V	50	Low	46.3	Very low	12 Å²	12	100.8 Å²	100.8	7%	0.073	52%	0.518	C	S	.	.	H	α-helix	trans	-64	-38.9	179.6	-173.4	0	0	0	0	111.6	V754 E758 D764 V770 A771 F778	V754-V767 HydrophobicContact CG1-CB 4.18Å; V754-V767 HydrophobicContact CG1-CG1 4.12Å; V754-V767 HydrophobicContact CG1-CG2 3.29Å; E758-V767 WeakPolarHBondContact OE1-CG2 3.22Å; E758-V767 WeakPolarHBondContact OE2-CG2 3.16Å; D764-V767 HydrophobicContact CB-CG2 4.32Å; D764-V767 PolarHBondContact O-N 2.94Å; V767-V770 PolarHBondContact O-N 3.12Å; V767-A771 WeakPolarHBondContact O-CB 3.49Å; V767-A771 PolarHBondContact O-N 2.71Å; V767-F778 HydrophobicContact CG1-CE2 3.94Å; V767-F778 HydrophobicContact CG1-CZ 4.2Å
768	K	51.1	Low	45.5	Very low	141 Å²	141	98.7 Å²	98.7	61%	0.613	51%	0.514	S	S	*	.	H	α-helix	trans	-65.3	-41.2	176.1	-164	177.9	-176.5	177.2	0	111.8	A765 T766 A771 M772	A765-K768 PolarHBondContact O-N 2.9Å; T766-K768 VanDerWaalsContact C-N 3.31Å; T766-K768 PolarHBondContact O-N 2.61Å; K768-A771 PolarHBondContact O-N 2.68Å; K768-M772 HydrophobicContact CG-CE 4.49Å; K768-M772 PolarHBondContact O-N 3.47Å
769	H	52.2	Low	44.8	Very low	96 Å²	96	105.3 Å²	105.3	44%	0.444	57%	0.565	S	S	.	*	H	α-helix	trans	-63.1	-45.3	176.4	-169.4	84.7	0	0	0	111.4	A765 T766 A771 M772 Q773	A765-H769 WeakPolarHBondContact O-CB 3.25Å; A765-H769 PolarHBondContact O-N 2.95Å; T766-H769 WeakPolarHBondContact O-CB 3.37Å; T766-H769 PolarHBondContact O-N 3.42Å; H769-A771 PolarHBondContact O-N 3Å; H769-M772 PolarHBondContact O-N 3Å; H769-Q773 PolarHBondContact NE2-NE2 3.07Å; H769-Q773 PolarHBondContact O-N 3.26Å
770	V	47.8	Very low	45	Very low	2 Å²	2	98.5 Å²	98.5	1%	0.012	55%	0.548	C	S	.	.	H	α-helix	trans	-61.5	-45.1	175.2	178.9	0	0	0	0	111.3	Y714 L751 T766 V767 M772 Q773 V774	Y714-V770 HydrophobicContact CD2-CB 3.99Å; Y714-V770 HydrophobicContact CD2-CG1 3.59Å; Y714-V770 HydrophobicContact CD2-CG2 3.13Å; Y714-V770 HydrophobicContact CE2-CB 4.2Å; Y714-V770 HydrophobicContact CE2-CG1 3.31Å; Y714-V770 HydrophobicContact CE2-CG2 3.83Å; Y714-V770 HydrophobicContact CG-CB 4.5Å; Y714-V770 HydrophobicContact CG-CG1 4.41Å; Y714-V770 HydrophobicContact CG-CG2 3.52Å; L751-V770 HydrophobicContact CD1-CG1 3.97Å; L751-V770 HydrophobicContact CG-CG1 3.99Å; T766-V770 VanDerWaalsContact O-CG2 3.28Å; T766-V770 WeakPolarHBondContact O-CG2 3.3Å; T766-V770 PolarHBondContact O-N 2.91Å; V767-V770 PolarHBondContact O-N 3.12Å; V770-M772 VanDerWaalsContact C-N 3.34Å; V770-M772 PolarHBondContact O-N 3.43Å; V770-Q773 PolarHBondContact O-N 3.38Å; V770-V774 HydrophobicContact CG1-CG2 4.34Å; V770-V774 VanDerWaalsContact O-CG2 3.22Å; V770-V774 WeakPolarHBondContact O-CG2 3.22Å; V770-V774 PolarHBondContact O-N 3.29Å
771	A	48.5	Very low	45	Very low	1 Å²	1	98.1 Å²	98.1	1%	0.008	54%	0.538	C	S	.	.	H	α-helix	trans	-59.2	-43.5	177.8	0	0	0	0	0	113.1	L751 V767 K768 H769 V774 G775 R776 F778	L751-A771 HydrophobicContact CD2-CB 4.09Å; V767-A771 WeakPolarHBondContact O-CB 3.49Å; V767-A771 PolarHBondContact O-N 2.71Å; K768-A771 PolarHBondContact O-N 2.68Å; H769-A771 PolarHBondContact O-N 3Å; A771-V774 CarbonylContact O-C 3.6Å; A771-V774 PolarHBondContact O-N 3.09Å; A771-G775 PolarHBondContact O-N 3.49Å; A771-G775 VanDerWaalsContact O-N 3.16Å; A771-R776 CarbonylContact C-O 3.56Å; A771-R776 PolarHBondContact O-N 2.81Å; A771-F778 HydrophobicContact CB-CD2 3.33Å; A771-F778 HydrophobicContact CB-CE2 3.55Å
772	M	50.7	Low	45.4	Very low	125 Å²	125	95.9 Å²	95.9	62%	0.616	53%	0.53	S	S	*	.	H	α-helix	trans	-62.5	-45.3	175.7	-82.7	-164.7	-75	0	0	112	K768 H769 V770 V774 G775	K768-M772 HydrophobicContact CG-CE 4.49Å; K768-M772 PolarHBondContact O-N 3.47Å; H769-M772 PolarHBondContact O-N 3Å; V770-M772 VanDerWaalsContact C-N 3.34Å; V770-M772 PolarHBondContact O-N 3.43Å; M772-V774 PolarHBondContact O-N 3.31Å; M772-G775 PolarHBondContact O-N 3.07Å; M772-G775 VanDerWaalsContact O-N 3.09Å
773	Q	46.9	Very low	45.4	Very low	113 Å²	113	90.2 Å²	90.2	53%	0.528	51%	0.509	S	S	.	.	H	α-helix	trans	-62.8	-32.6	177.8	-73.9	-161	-3.3	0	0	112.8	H769 V770 G775	H769-Q773 PolarHBondContact NE2-NE2 3.07Å; H769-Q773 PolarHBondContact O-N 3.26Å; V770-Q773 PolarHBondContact O-N 3.38Å; Q773-G775 VanDerWaalsContact C-N 3.26Å; Q773-G775 PolarHBondContact O-N 3.5Å
774	V	47.3	Very low	45.4	Very low	28 Å²	28	87.4 Å²	87.4	17%	0.17	49%	0.488	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	2.4	179.1	-177.8	0	0	0	0	112.2	D747 L751 V770 A771 M772 R776	D747-V774 HydrophobicContact CB-CB 4.21Å; D747-V774 HydrophobicContact CB-CG1 3.54Å; D747-V774 HydrophobicContact CB-CG2 3.55Å; L751-V774 HydrophobicContact CD1-CB 3.64Å; L751-V774 HydrophobicContact CD1-CG1 3.8Å; L751-V774 HydrophobicContact CD1-CG2 3.72Å; V770-V774 HydrophobicContact CG1-CG2 4.34Å; V770-V774 VanDerWaalsContact O-CG2 3.22Å; V770-V774 WeakPolarHBondContact O-CG2 3.22Å; V770-V774 PolarHBondContact O-N 3.29Å; A771-V774 CarbonylContact O-C 3.6Å; A771-V774 PolarHBondContact O-N 3.09Å; M772-V774 PolarHBondContact O-N 3.31Å; V774-R776 PolarHBondContact O-N 3.1Å
775	G	41.6	Very low	45.1	Very low	69 Å²	69	88.3 Å²	88.3	71%	0.711	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.7	25.6	174.6	0	0	0	0	0	114.5	A771 M772 Q773	A771-G775 PolarHBondContact O-N 3.49Å; A771-G775 VanDerWaalsContact O-N 3.16Å; M772-G775 PolarHBondContact O-N 3.07Å; M772-G775 VanDerWaalsContact O-N 3.09Å; Q773-G775 VanDerWaalsContact C-N 3.26Å; Q773-G775 PolarHBondContact O-N 3.5Å
776	R	36.2	Very low	44.6	Very low	161 Å²	161	89.2 Å²	89.2	61%	0.608	49%	0.485	S	S	*	.			trans	-110.2	127.5	165.6	-83.9	-157.1	174.6	-160.8	-2.8	110.9	A771 V774	A771-R776 CarbonylContact C-O 3.56Å; A771-R776 PolarHBondContact O-N 2.81Å; V774-R776 PolarHBondContact O-N 3.1Å
777	T	36.6	Very low	44.3	Very low	138 Å²	138	92.2 Å²	92.2	85%	0.847	50%	0.499	S	S	*	.			trans	-72	120.8	160.2	43.8	0	0	0	0	108.4	S779	T777-S779 PolarHBondContact O-N 2.86Å
778	F	33.5	Very low	43.8	Very low	126 Å²	126	98.8 Å²	98.8	55%	0.553	53%	0.534	S	S	*	.			trans	-69.9	118.5	161.3	-96	-81.8	0	0	0	106.9	L751 V767 A771	L751-F778 HydrophobicContact CD2-CE2 3.6Å; L751-F778 HydrophobicContact CD2-CZ 3.97Å; V767-F778 HydrophobicContact CG1-CE2 3.94Å; V767-F778 HydrophobicContact CG1-CZ 4.2Å; A771-F778 HydrophobicContact CB-CD2 3.33Å; A771-F778 HydrophobicContact CB-CE2 3.55Å
779	S	33.2	Very low	43.1	Very low	186 Å²	186	95 Å²	95	100%	1.301	53%	0.527	S	S	*	.			trans	-80.6	0	162.2	60.3	0	0	0	0	109.6	T777	T777-S779 PolarHBondContact O-N 2.86Å

Retrieved 779 of 779 residues in 621.3 ms (Link to these results)

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