A0A087XVA8_POEFO Loading...

Mono-ADP ribosylhydrolase 1

AlphaFold DB , UniProt , Accession A0A087XVA8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 366 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.7	Very low	37	Very low	236 Å²	236	148 Å²	148	100%	1.163	83%	0.834	S	S	*	*				0	99.2	0	-47.7	-40.8	-169.1	0	0	107
2	A	35.8	Very low	37.4	Very low	89 Å²	89	149.7 Å²	149.7	74%	0.736	84%	0.836	S	S	*	*			cis	87	89.6	30.3	0	0	0	0	0	114.3
3	L	37.5	Very low	37	Very low	161 Å²	161	155.8 Å²	155.8	84%	0.843	84%	0.838	S	S	*	*			trans	-179.3	119	156.8	-95.2	153.1	0	0	0	103.9
4	L	37.8	Very low	37.1	Very low	146 Å²	146	151.4 Å²	151.4	76%	0.764	83%	0.834	S	S	*	*			cis	64	129.1	44.3	-56.6	171.9	0	0	0	111.8
5	T	38.2	Very low	37	Very low	130 Å²	130	152.1 Å²	152.1	80%	0.798	84%	0.835	S	S	*	*			cis	-158.1	151	11.1	0.1	0	0	0	0	111.2
6	S	32.4	Very low	37.1	Very low	121 Å²	121	149.7 Å²	149.7	85%	0.846	83%	0.829	S	S	*	*			trans	-174.2	114.7	133.4	-170.9	0	0	0	0	112.6
7	A	40.1	Very low	37.2	Very low	94 Å²	94	149 Å²	149	78%	0.777	84%	0.835	S	S	*	*			trans	-158.7	121.9	158.5	0	0	0	0	0	108.6
8	R	36.1	Very low	37.1	Very low	246 Å²	246	146.6 Å²	146.6	93%	0.928	83%	0.829	S	S	*	*			trans	-97.5	116.1	174.8	-81.1	-175.5	171.8	178.3	-2.1	110.1
9	V	35.9	Very low	37.3	Very low	117 Å²	117	144.5 Å²	144.5	71%	0.709	83%	0.832	S	S	*	*			trans	-96.7	121.6	165.3	176.6	0	0	0	0	108.4
10	S	36.5	Very low	37.3	Very low	116 Å²	116	145.8 Å²	145.8	81%	0.811	84%	0.835	S	S	*	*			trans	-90.8	105.7	174.2	-65.3	0	0	0	0	109.8
11	H	34.4	Very low	37	Very low	172 Å²	172	143.6 Å²	143.6	80%	0.796	83%	0.829	S	S	*	*			trans	-70.9	133.6	177.7	-86.6	-87.3	0	0	0	112.5	R13	H11-R13 PolarHBondContact O-N 3.08Å
12	I	41.4	Very low	36.6	Very low	168 Å²	168	144.2 Å²	144.2	86%	0.862	82%	0.818	S	S	*	*			trans	-61	131.7	157.1	-62.5	169.6	0	0	0	107.8
13	R	32.2	Very low	36.4	Very low	230 Å²	230	147.6 Å²	147.6	87%	0.868	82%	0.822	S	S	*	*			trans	-128.9	109.5	173.3	-156.2	175.3	-165.2	178.4	4.5	109.7	H11	H11-R13 PolarHBondContact O-N 3.08Å
14	A	37.9	Very low	36	Very low	94 Å²	94	149.8 Å²	149.8	78%	0.777	82%	0.819	S	S	*	*			trans	-65.7	147.2	172	0	0	0	0	0	110.5
15	L	36	Very low	35.7	Very low	162 Å²	162	146.5 Å²	146.5	85%	0.848	81%	0.813	S	S	*	*			trans	-107	149.5	170.9	-76	172.2	0	0	0	110
16	P	38.7	Very low	35.3	Very low	113 Å²	113	145.8 Å²	145.8	73%	0.734	80%	0.804	S	S	*	*			trans	-78.4	148.1	-163.1	30.8	-36.1	0	0	0	113.3	S18	P16-S18 PolarHBondContact O-N 3.43Å
17	C	39.1	Very low	35.3	Very low	138 Å²	138	149.3 Å²	149.3	93%	0.932	81%	0.805	S	S	*	*			trans	-69.9	125.6	166.7	-165.7	0	0	0	0	109.6
18	S	34.9	Very low	35	Very low	105 Å²	105	153.4 Å²	153.4	73%	0.734	81%	0.808	S	S	*	*			trans	-123.2	139	171.2	57	0	0	0	0	109.9	P16	P16-S18 PolarHBondContact O-N 3.43Å
19	A	41.7	Very low	34.8	Very low	107 Å²	107	148.2 Å²	148.2	88%	0.884	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-80.5	124.3	-167.4	0	0	0	0	0	112.2
20	L	35.7	Very low	34.6	Very low	170 Å²	170	147.3 Å²	147.3	89%	0.89	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-90.4	142.5	162.2	-76.4	171	0	0	0	110.5
21	S	31.2	Very low	34.2	Very low	101 Å²	101	144.6 Å²	144.6	71%	0.706	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-71.2	141.4	-171.2	45.7	0	0	0	0	112.6	I23	S21-I23 PolarHBondContact O-N 3.1Å
22	R	34.3	Very low	34.1	Very low	249 Å²	249	142.4 Å²	142.4	94%	0.94	80%	0.797	S	S	*	*			trans	-72.4	96.8	168.7	-60.2	-176.4	-166.2	-168.9	4.3	108.7	R24	R22-R24 PolarHBondContact O-N 3.13Å
23	I	31.3	Very low	33.5	Very low	159 Å²	159	143.8 Å²	143.8	82%	0.815	80%	0.797	S	S	*	*			trans	-69.4	102.2	167.6	-62.6	178.7	0	0	0	107.6	S21 A25	S21-I23 PolarHBondContact O-N 3.1Å; I23-A25 PolarHBondContact O-N 3.07Å
24	R	30.2	Very low	33.5	Very low	207 Å²	207	141.5 Å²	141.5	78%	0.781	79%	0.794	S	S	*	*			trans	-80.5	112.3	174	-166.2	-174.1	-157.2	170.7	4.3	108.1	R22 D26	R22-R24 PolarHBondContact O-N 3.13Å; R24-D26 WeakPolarHBondContact CD-OD1 3.18Å; R24-D26 IonicContact NE-OD1 3.78Å; R24-D26 PolarHBondContact O-N 3.34Å
25	A	30.4	Very low	33.1	Very low	78 Å²	78	148 Å²	148	65%	0.645	80%	0.799	S	S	*	*			trans	-77.7	86.8	173.9	0	0	0	0	0	109.8	I23 F27	I23-A25 PolarHBondContact O-N 3.07Å; A25-F27 PolarHBondContact O-N 3.03Å
26	D	30.6	Very low	32.8	Very low	114 Å²	114	148.5 Å²	148.5	61%	0.61	80%	0.796	S	S	*	*			trans	-71.6	89.6	173.3	-76.1	-22.7	0	0	0	110.1	R24 Q28	R24-D26 WeakPolarHBondContact CD-OD1 3.18Å; R24-D26 IonicContact NE-OD1 3.78Å; R24-D26 PolarHBondContact O-N 3.34Å; D26-Q28 VanDerWaalsContact C-N 3.3Å; D26-Q28 PolarHBondContact O-N 3.16Å
27	F	33	Very low	32.5	Very low	195 Å²	195	150.8 Å²	150.8	86%	0.855	80%	0.801	S	S	*	*			trans	-68.1	87.5	167	-96.3	-89.2	0	0	0	110	A25 T29	A25-F27 PolarHBondContact O-N 3.03Å; F27-T29 PolarHBondContact O-N 3.24Å
28	Q	32.6	Very low	32.3	Very low	180 Å²	180	151.7 Å²	151.7	84%	0.841	80%	0.796	S	S	*	*			trans	-68.4	118.1	168.7	-72	-166.7	-6.6	0	0	110.2	D26 A30	D26-Q28 VanDerWaalsContact C-N 3.3Å; D26-Q28 PolarHBondContact O-N 3.16Å; Q28-A30 PolarHBondContact O-N 2.74Å
29	T	32.3	Very low	32.6	Very low	138 Å²	138	152.3 Å²	152.3	85%	0.847	80%	0.798	S	S	*	*			trans	-66.4	103.8	-177.8	-49.5	0	0	0	0	111.7	F27 G31	F27-T29 PolarHBondContact O-N 3.24Å; T29-G31 PolarHBondContact O-N 3.04Å
30	A	32.3	Very low	32.6	Very low	98 Å²	98	153.6 Å²	153.6	81%	0.81	80%	0.797	S	S	*	*			trans	-70.2	77.1	170.1	0	0	0	0	0	111	Q28 V32	Q28-A30 PolarHBondContact O-N 2.74Å; A30-V32 PolarHBondContact O-N 2.87Å; A30-V32 VanDerWaalsContact O-N 3.09Å
31	G	28.8	Very low	32.4	Very low	59 Å²	59	149.3 Å²	149.3	61%	0.608	79%	0.794	S	S	*	*			trans	-70.3	99.6	-174.2	0	0	0	0	0	113.8	T29 K33	T29-G31 PolarHBondContact O-N 3.04Å; G31-K33 PolarHBondContact O-N 3.3Å; G31-K33 VanDerWaalsContact O-N 3.12Å
32	V	32.1	Very low	32.4	Very low	125 Å²	125	150.3 Å²	150.3	76%	0.758	80%	0.801	S	S	*	*			trans	-68.9	103.7	170.8	180	0	0	0	0	109.8	A30 F34	A30-V32 PolarHBondContact O-N 2.87Å; A30-V32 VanDerWaalsContact O-N 3.09Å; V32-F34 HydrophobicContact CG1-CE2 4.37Å; V32-F34 PolarHBondContact O-N 3.22Å
33	K	29.1	Very low	32.9	Very low	198 Å²	198	144.7 Å²	144.7	86%	0.861	80%	0.796	S	S	*	*			trans	-75.9	99.7	178.6	-73.7	-178.8	177	175.6	0	111.7	G31 R35	G31-K33 PolarHBondContact O-N 3.3Å; G31-K33 VanDerWaalsContact O-N 3.12Å; K33-R35 PolarHBondContact O-N 2.85Å
34	F	30.8	Very low	32.9	Very low	182 Å²	182	145.8 Å²	145.8	80%	0.798	80%	0.798	S	S	*	*			trans	-67.8	114.2	159.7	-85	-90.3	0	0	0	110	V32 H36	V32-F34 HydrophobicContact CG1-CE2 4.37Å; V32-F34 PolarHBondContact O-N 3.22Å; F34-H36 PolarHBondContact O-N 2.77Å
35	R	29.5	Very low	32.9	Very low	231 Å²	231	144.1 Å²	144.1	87%	0.872	80%	0.804	S	S	*	*			trans	-82.9	101	167.2	-80.5	-173.6	170.8	-169.3	-1.8	109.3	K33	K33-R35 PolarHBondContact O-N 2.85Å
36	H	30.8	Very low	32.9	Very low	172 Å²	172	152.1 Å²	152.1	80%	0.796	82%	0.817	S	S	*	*			trans	-71.1	126.7	156.8	-83.6	-88.1	0	0	0	109.2	F34	F34-H36 PolarHBondContact O-N 2.77Å
37	L	31	Very low	32.9	Very low	161 Å²	161	150.4 Å²	150.4	84%	0.843	83%	0.827	S	S	*	*			trans	-101	116.6	166.7	-72.4	171.1	0	0	0	108.4
38	L	35.7	Very low	32.7	Very low	157 Å²	157	148.1 Å²	148.1	82%	0.822	83%	0.829	S	S	*	*			trans	-134.3	139.5	162.9	-78	174.1	0	0	0	108.1
39	P	40.9	Very low	32.5	Very low	118 Å²	118	142.7 Å²	142.7	77%	0.766	82%	0.821	S	S	*	*			trans	-78.2	153.7	-179.4	32.5	-35.1	0	0	0	112.1
40	P	41.6	Very low	32.5	Very low	134 Å²	134	142.6 Å²	142.6	87%	0.87	82%	0.82	S	S	*	*			trans	-82	146.9	174.7	34	-34.2	0	0	0	111.9
41	G	31.7	Very low	32.4	Very low	80 Å²	80	144.3 Å²	144.3	83%	0.825	82%	0.821	S	S	*	*			trans	171.5	68.6	177	0	0	0	0	0	115.8
42	S	30.8	Very low	32.5	Very low	122 Å²	122	146.8 Å²	146.8	85%	0.853	83%	0.829	S	S	*	*			trans	-97.5	149	164.5	-47.1	0	0	0	0	108.8
43	P	44.8	Very low	33.5	Very low	130 Å²	130	146.3 Å²	146.3	84%	0.844	83%	0.828	S	S	*	*				-138.2	-177.8	73	36.3	-18.7	0	0	0	115.5
44	Q	32.2	Very low	33.5	Very low	183 Å²	183	143 Å²	143	86%	0.855	83%	0.825	S	S	*	*			trans	-70.9	159.8	-171.8	-48.9	170.3	14.9	0	0	114.1
45	L	31	Very low	33.5	Very low	172 Å²	172	143.4 Å²	143.4	90%	0.901	82%	0.821	S	S	*	*				-159.3	163.7	126.9	-111.1	166.2	0	0	0	112.3
46	R	28.9	Very low	33.4	Very low	245 Å²	245	137.9 Å²	137.9	93%	0.925	82%	0.817	S	S	*	*			trans	-79.1	151	179	-67.3	173.8	168.6	-174.1	-4.1	111.3
47	G	30.1	Very low	33.4	Very low	79 Å²	79	137.3 Å²	137.3	81%	0.814	82%	0.815	S	S	*	*			trans	-166.4	121.5	165.1	0	0	0	0	0	112.4
48	T	30.1	Very low	33.6	Very low	147 Å²	147	137 Å²	137	90%	0.902	81%	0.812	S	S	*	*			trans	-112.8	132.2	177.8	48.3	0	0	0	0	111.4
49	G	28.1	Very low	33.3	Very low	66 Å²	66	135.9 Å²	135.9	68%	0.68	81%	0.807	S	S	*	*			trans	111.4	130.7	137.9	0	0	0	0	0	119.8
50	V	31.4	Very low	32.9	Very low	135 Å²	135	136.5 Å²	136.5	82%	0.818	81%	0.809	S	S	*	*			trans	66.2	150.4	136.8	-140.1	0	0	0	0	120.7
51	T	30.8	Very low	32.3	Very low	134 Å²	134	134.2 Å²	134.2	82%	0.822	80%	0.801	S	S	*	*			trans	87.2	115.2	160.7	65.2	0	0	0	0	120.3
52	S	30.2	Very low	32.5	Very low	111 Å²	111	137.2 Å²	137.2	78%	0.776	80%	0.803	S	S	*	*			trans	-80.7	-170	149.7	-33.9	0	0	0	0	109.4
53	P	53	Low	32.3	Very low	116 Å²	116	142.5 Å²	142.5	75%	0.753	81%	0.805	S	S	*	*			cis	-137.2	-141.8	-1.9	38.9	-15.9	0	0	0	113.1
54	V	30.3	Very low	31.5	Very low	129 Å²	129	138.9 Å²	138.9	78%	0.782	79%	0.791	S	S	*	*			trans	81.9	144.9	169.6	-171	0	0	0	0	115.7
55	R	29.7	Very low	31.4	Very low	190 Å²	190	135.9 Å²	135.9	72%	0.717	78%	0.781	S	S	*	*			cis	155.3	105.8	-40.6	176	-162.5	-177	-169	3.8	110.5	H57	R55-H57 PolarHBondContact NE-NE2 2.83Å; R55-H57 PolarHBondContact NH2-NE2 2.92Å
56	S	28.8	Very low	31.4	Very low	114 Å²	114	137.7 Å²	137.7	80%	0.797	78%	0.775	S	S	*	*			trans	-160	134.5	155.5	42.7	0	0	0	0	107.7
57	H	30	Very low	31.3	Very low	161 Å²	161	135 Å²	135	75%	0.745	77%	0.771	S	S	*	*			cis	84.3	121.1	35.6	-76.5	-54.8	0	0	0	115.3	R55	R55-H57 PolarHBondContact NE-NE2 2.83Å; R55-H57 PolarHBondContact NH2-NE2 2.92Å
58	I	35.3	Very low	31.2	Very low	154 Å²	154	135.8 Å²	135.8	79%	0.79	76%	0.764	S	S	*	*			trans	131.6	125.8	171.8	-75.6	158.9	0	0	0	108.7
59	N	29.6	Very low	31.1	Very low	134 Å²	134	134.1 Å²	134.1	72%	0.717	75%	0.754	S	S	*	*			cis	89.6	142	32.5	-64.7	8	0	0	0	113.2
60	T	31.9	Very low	31.2	Very low	130 Å²	130	137.5 Å²	137.5	80%	0.798	76%	0.762	S	S	*	*			cis	-171.8	158.8	-9.4	23.6	0	0	0	0	106.9
61	A	30.7	Very low	31.1	Very low	86 Å²	86	135.9 Å²	135.9	71%	0.711	76%	0.762	S	S	*	*			cis	-166.7	165.3	-10.1	0	0	0	0	0	111.3
62	V	34.2	Very low	31.2	Very low	143 Å²	143	134 Å²	134	87%	0.867	76%	0.76	S	S	*	*			trans	15.3	131.9	148.5	-177	0	0	0	0	121.1
63	R	28.1	Very low	31.1	Very low	234 Å²	234	137.1 Å²	137.1	88%	0.883	77%	0.767	S	S	*	*			trans	-154.6	149.3	146.3	-127	172.5	175.6	158	-1.3	107.9
64	G	27.4	Very low	29.9	Very low	54 Å²	54	142.7 Å²	142.7	56%	0.557	77%	0.773	S	S	*	*			cis	95.9	119.6	20.5	0	0	0	0	0	109.4
65	D	30.2	Very low	29.8	Very low	120 Å²	120	146.6 Å²	146.6	64%	0.642	78%	0.78	S	S	*	*			cis	-152.6	143.9	15.8	-82.4	-74.6	0	0	0	111.1
66	R	30.9	Very low	29.8	Very low	209 Å²	209	143 Å²	143	79%	0.789	78%	0.784	S	S	*	*				72.4	128.6	102.9	-61.4	-177.9	-159.2	-140.2	1.4	120.3
67	F	27.4	Very low	30	Very low	188 Å²	188	143.5 Å²	143.5	83%	0.825	79%	0.787	S	S	*	*			trans	46.4	159.6	130.7	-70	-84.8	0	0	0	121.5
68	S	26.5	Very low	30.1	Very low	97 Å²	97	145.3 Å²	145.3	68%	0.678	80%	0.796	S	S	*	*			cis	-152.8	141.8	11.3	-120.5	0	0	0	0	109.4
69	T	29	Very low	29.8	Very low	111 Å²	111	142.7 Å²	142.7	68%	0.681	80%	0.797	S	S	*	*				74.4	130.9	85.2	-53.9	0	0	0	0	116.9
70	T	30.6	Very low	29.8	Very low	138 Å²	138	144.5 Å²	144.5	85%	0.847	81%	0.807	S	S	*	*			trans	130.5	147.5	154.5	53.7	0	0	0	0	113
71	A	29.3	Very low	29.6	Very low	100 Å²	100	142.3 Å²	142.3	83%	0.826	81%	0.81	S	S	*	*			cis	-160.2	175.5	-19.8	0	0	0	0	0	109
72	A	33	Very low	29.6	Very low	95 Å²	95	143.9 Å²	143.9	79%	0.785	82%	0.816	S	S	*	*			trans	-125.3	142.2	174.9	0	0	0	0	0	111.8
73	L	27.9	Very low	29.5	Very low	177 Å²	177	142.7 Å²	142.7	93%	0.927	81%	0.814	S	S	*	*			trans	-160.3	142.6	164.9	-116	161.4	0	0	0	114.3
74	R	27.9	Very low	29.8	Very low	233 Å²	233	137.1 Å²	137.1	88%	0.879	81%	0.811	S	S	*	*			trans	-56.6	153.5	177	-80.8	168.9	158.6	168.1	-7.7	114.6
75	K	26.8	Very low	30.7	Very low	211 Å²	211	140.5 Å²	140.5	92%	0.917	82%	0.823	S	S	*	*				-157.3	170.7	116.8	-114.2	171.8	-175.4	178.8	0	112.6
76	S	30.8	Very low	30.9	Very low	114 Å²	114	146.9 Å²	146.9	80%	0.797	84%	0.838	S	S	*	*			trans	-138.2	152.6	-167.3	54.1	0	0	0	0	111.8
77	S	32	Very low	30.8	Very low	124 Å²	124	140.8 Å²	140.8	87%	0.867	84%	0.84	S	S	*	*			trans	-148.2	151.2	159.9	52.7	0	0	0	0	111.2
78	Q	32.9	Very low	31.1	Very low	199 Å²	199	143.4 Å²	143.4	93%	0.93	85%	0.845	S	S	*	*			trans	-111.5	153.4	169.5	-63.8	171.6	-46.3	0	0	108.7
79	A	29.2	Very low	31.5	Very low	99 Å²	99	151 Å²	151	82%	0.818	86%	0.858	S	S	*	*			trans	-163.3	147.9	144	0	0	0	0	0	111.1
80	N	29.8	Very low	31.5	Very low	173 Å²	173	149.6 Å²	149.6	93%	0.925	87%	0.866	S	S	*	*			trans	-77.7	160.2	177.1	-67.2	-37.4	0	0	0	112.4
81	G	26.6	Very low	31.5	Very low	84 Å²	84	154.7 Å²	154.7	87%	0.866	87%	0.87	S	S	*	*			trans	-166.1	84.2	168.9	0	0	0	0	0	112.7
82	S	31.3	Very low	31.7	Very low	118 Å²	118	158 Å²	158	83%	0.825	87%	0.872	S	S	*	*			trans	-99.2	133.1	179.1	52.7	0	0	0	0	112.4
83	S	31	Very low	31.6	Very low	119 Å²	119	156.5 Å²	156.5	83%	0.832	87%	0.866	S	S	*	*			trans	-164.3	143	151.9	50.7	0	0	0	0	112.2
84	S	34.5	Very low	31.8	Very low	116 Å²	116	157.2 Å²	157.2	81%	0.811	86%	0.862	S	S	*	*			trans	-110.4	158.5	156.7	-47.2	0	0	0	0	108.1
85	P	46.6	Very low	32	Very low	126 Å²	126	156.1 Å²	156.1	82%	0.818	86%	0.864	S	S	*	*			trans	-121.7	150.8	143.2	34.6	-27.6	0	0	0	112.3
86	R	34.6	Very low	32.2	Very low	254 Å²	254	150.3 Å²	150.3	96%	0.958	86%	0.855	S	S	*	*			trans	-84.2	139.9	172.8	-64	169.6	174.5	161	-3.6	109.6
87	G	29.4	Very low	32.2	Very low	80 Å²	80	153.8 Å²	153.8	83%	0.825	86%	0.864	S	S	*	*			trans	-135.6	106.3	170.2	0	0	0	0	0	111.8
88	R	33.2	Very low	32.2	Very low	244 Å²	244	151.5 Å²	151.5	92%	0.921	86%	0.86	S	S	*	*			trans	-95	129.1	174.5	-82.3	-177.6	168.1	-172.1	-2.5	110.9
89	R	34.4	Very low	32.3	Very low	256 Å²	256	146.7 Å²	146.7	97%	0.966	85%	0.854	S	S	*	*			trans	-175.1	141	142.7	-96.8	154.4	-161	-120.5	7.1	107.6
90	G	30.6	Very low	32.4	Very low	81 Å²	81	145.7 Å²	145.7	84%	0.835	85%	0.846	S	S	*	*			cis	134.8	70	-6.6	0	0	0	0	0	113.3
91	W	30.6	Very low	32.6	Very low	246 Å²	246	147.6 Å²	147.6	93%	0.932	85%	0.846	S	S	*	*			trans	-135.8	111.1	169.8	-160.9	-21.3	0	0	0	109.7
92	L	33.4	Very low	32.9	Very low	169 Å²	169	147.1 Å²	147.1	89%	0.885	84%	0.842	S	S	*	*			trans	-120.4	101.3	167.6	-88.4	166.4	0	0	0	107.7	K94	L92-K94 PolarHBondContact O-N 3.28Å
93	G	29.3	Very low	33.3	Very low	64 Å²	64	148.8 Å²	148.8	66%	0.66	85%	0.847	S	S	*	*			trans	-75.6	119	171.8	0	0	0	0	0	110.1
94	K	33.1	Very low	33.4	Very low	192 Å²	192	146.4 Å²	146.4	84%	0.835	84%	0.841	S	S	*	*			trans	-97.9	122	173.6	-69.3	-177.4	-179.9	-179.7	0	110.7	L92	L92-K94 PolarHBondContact O-N 3.28Å
95	F	31.8	Very low	34.1	Very low	210 Å²	210	148.4 Å²	148.4	92%	0.921	85%	0.848	S	S	*	*			trans	-142.9	147.6	149.2	-67.7	-80.7	0	0	0	106.7
96	A	31.2	Very low	34.1	Very low	88 Å²	88	146.2 Å²	146.2	73%	0.727	85%	0.849	S	S	*	*			cis	-176.8	113.1	-20.7	0	0	0	0	0	100.8	G98	A96-G98 PolarHBondContact O-N 3.43Å
97	L	30.8	Very low	34.3	Very low	187 Å²	187	138.8 Å²	138.8	98%	0.979	84%	0.841	S	S	*	*			trans	-79.5	109.1	-171.8	-159.7	79	0	0	0	109.8
98	G	31.6	Very low	34.7	Very low	77 Å²	77	143 Å²	143	79%	0.794	84%	0.844	S	S	*	*			trans	-117.7	117.4	174	0	0	0	0	0	110.4	A96	A96-G98 PolarHBondContact O-N 3.43Å
99	A	34.9	Very low	35	Very low	98 Å²	98	138.5 Å²	138.5	81%	0.81	84%	0.844	S	S	*	*			trans	-139.5	124.1	-179.8	0	0	0	0	0	111
100	A	31.6	Very low	35.1	Very low	77 Å²	77	135.7 Å²	135.7	64%	0.636	84%	0.842	S	S	*	*			trans	-166	142.6	155.2	0	0	0	0	0	110.1
101	F	35.1	Very low	35.5	Very low	213 Å²	213	136.2 Å²	136.2	93%	0.934	84%	0.838	S	S	*	*			trans	58.3	124.9	168.2	-45.4	-67.2	0	0	0	118
102	G	31.4	Very low	36	Very low	75 Å²	75	132.2 Å²	132.2	77%	0.773	83%	0.834	S	S	*	*			cis	123.9	55.9	-5.5	0	0	0	0	0	114.9
103	V	40.5	Very low	36.4	Very low	153 Å²	153	133.3 Å²	133.3	93%	0.927	83%	0.834	S	S	*	*			trans	-144.1	145.6	169.3	-175.8	0	0	0	0	109.4
104	G	33.3	Very low	37	Very low	69 Å²	69	136.6 Å²	136.6	71%	0.711	84%	0.841	S	S	*	*			trans	91.7	69.8	154	0	0	0	0	0	117.7	G106	G104-G106 PolarHBondContact O-N 2.74Å
105	T	48.4	Very low	37.2	Very low	157 Å²	157	130.8 Å²	130.8	96%	0.963	84%	0.836	S	S	*	*			trans	-68.9	116.5	159.1	46.2	0	0	0	0	110.7
106	G	45.8	Very low	37.8	Very low	81 Å²	81	126.4 Å²	126.4	84%	0.835	83%	0.826	S	S	*	*	S	Bend	trans	131.1	54.4	158.2	0	0	0	0	0	119	G104	G104-G106 PolarHBondContact O-N 2.74Å
107	A	40.3	Very low	38.1	Very low	97 Å²	97	130 Å²	130	80%	0.802	83%	0.833	S	S	*	*	S	Bend	trans	-163.6	43	161.4	0	0	0	0	0	115.4
108	L	37.1	Very low	38.6	Very low	168 Å²	168	126.7 Å²	126.7	88%	0.88	82%	0.82	S	S	*	*			trans	-150.1	43.1	-178.8	-149.6	75.3	0	0	0	117.3
109	V	40.6	Very low	39.2	Very low	151 Å²	151	127.2 Å²	127.2	92%	0.915	82%	0.817	S	S	*	*	S	Bend	trans	-133.8	45.4	173.1	-161.1	0	0	0	0	112
110	Q	36.2	Very low	39.6	Very low	197 Å²	197	130.6 Å²	130.6	92%	0.921	82%	0.818	S	S	*	*			trans	-150.9	47.4	178.3	-147.5	165.3	4	0	0	114.6
111	A	39.4	Very low	40.7	Very low	91 Å²	91	132 Å²	132	75%	0.752	82%	0.821	S	S	*	*	S	Bend	trans	-141.6	27.1	-177.7	0	0	0	0	0	115.3
112	L	41	Very low	41.9	Very low	162 Å²	162	127.3 Å²	127.3	85%	0.848	81%	0.805	S	S	*	*	S	Bend	trans	-135.5	-1.1	-176.9	-84.9	175.5	0	0	0	117.1
113	H	41	Very low	43.7	Very low	193 Å²	193	131.6 Å²	131.6	89%	0.894	80%	0.802	S	S	*	*	S	Bend	trans	-129.4	24.6	-173.7	-88.7	10.6	0	0	0	115.7
114	T	42.3	Very low	45.7	Very low	132 Å²	132	124.8 Å²	124.8	81%	0.81	76%	0.761	S	S	*	*			trans	-118.5	18.3	164.8	48.7	0	0	0	0	112.6	V116	T114-V116 PolarHBondContact O-N 2.96Å
115	G	37.3	Very low	48.1	Very low	71 Å²	71	125.5 Å²	125.5	73%	0.732	75%	0.748	S	S	*	*			trans	-70.8	45.8	171.7	0	0	0	0	0	113.7	L117	G115-L117 PolarHBondContact O-N 3.31Å
116	V	43.6	Very low	49.9	Very low	117 Å²	117	118.5 Å²	118.5	71%	0.709	71%	0.705	S	S	*	*			trans	-70	89	162.7	-177.1	0	0	0	0	106.3	T114 T118	T114-V116 PolarHBondContact O-N 2.96Å; V116-T118 HydrophobicContact CG1-CG2 4.05Å; V116-T118 PolarHBondContact O-N 2.87Å
117	L	37.7	Very low	51.6	Low	164 Å²	164	119 Å²	119	86%	0.859	69%	0.688	S	S	*	*			trans	-60.9	93.4	157.3	-76.6	170.2	0	0	0	106.6	G115 A119	G115-L117 PolarHBondContact O-N 3.31Å; L117-A119 PolarHBondContact O-N 2.77Å
118	T	41.9	Very low	53.4	Low	117 Å²	117	115.6 Å²	115.6	72%	0.718	66%	0.658	S	S	*	*			trans	-63.9	79.8	159.2	42.1	0	0	0	0	107	V116 M120	V116-T118 HydrophobicContact CG1-CG2 4.05Å; V116-T118 PolarHBondContact O-N 2.87Å; T118-M120 VanDerWaalsContact C-N 3.35Å; T118-M120 PolarHBondContact O-N 3.04Å
119	A	42.9	Very low	54.7	Low	89 Å²	89	111.1 Å²	111.1	74%	0.736	65%	0.646	S	S	*	*			trans	-53.7	104.3	170	0	0	0	0	0	106.4	L117 P121	L117-A119 PolarHBondContact O-N 2.77Å; A119-P121 VanDerWaalsContact O-N 3.16Å
120	M	44.3	Very low	55.7	Low	168 Å²	168	112.9 Å²	112.9	83%	0.828	64%	0.644	S	S	*	*			trans	-57.8	126.9	-178	-75.2	-159.8	157.2	0	0	107	T118 L122	T118-M120 VanDerWaalsContact C-N 3.35Å; T118-M120 PolarHBondContact O-N 3.04Å; M120-L122 PolarHBondContact O-N 3.33Å
121	P	54.3	Low	57.3	Low	106 Å²	106	107.4 Å²	107.4	69%	0.688	62%	0.615	S	S	*	*			trans	-56.3	117.1	-172	21.8	-32.8	0	0	0	107.7	A119 K123	A119-P121 VanDerWaalsContact O-N 3.16Å; P121-K123 VanDerWaalsContact C-N 3.33Å; P121-K123 PolarHBondContact O-N 3.19Å
122	L	59.7	Low	59.4	Low	115 Å²	115	105.9 Å²	105.9	60%	0.602	59%	0.594	S	S	*	*			trans	-61	96.3	-170.2	-179.1	70.3	0	0	0	108.3	M120 I124 F139	M120-L122 PolarHBondContact O-N 3.33Å; L122-I124 VanDerWaalsContact C-N 3.31Å; L122-I124 WeakPolarHBondContact O-CG2 3.45Å; L122-I124 PolarHBondContact O-N 2.83Å; L122-F139 WeakPolarHBondContact O-CE2 3.38Å; L122-F139 VanDerWaalsContact O-CZ 3.25Å; L122-F139 WeakPolarHBondContact O-CZ 3.22Å
123	K	70.7	Confident	61.9	Low	166 Å²	166	100.4 Å²	100.4	72%	0.722	56%	0.562	S	S	*	*			trans	-73.7	89.4	-170.5	-168.1	176.3	-176.1	179.1	0	109.3	P121 Y151	P121-K123 VanDerWaalsContact C-N 3.33Å; P121-K123 PolarHBondContact O-N 3.19Å; K123-Y151 HydrophobicContact CG-CE1 4.22Å
124	I	82.6	Confident	64.5	Low	10 Å²	10	95.9 Å²	95.9	5%	0.051	54%	0.54	C	S	.	.			trans	-62	141.8	-177.8	66	167.8	0	0	0	110.2	L122 L126 A136 F139 L140 Y151	L122-I124 VanDerWaalsContact C-N 3.31Å; L122-I124 WeakPolarHBondContact O-CG2 3.45Å; L122-I124 PolarHBondContact O-N 2.83Å; I124-L126 HydrophobicContact CD1-CD2 3.6Å; I124-L126 HydrophobicContact CG1-CD2 4.13Å; I124-A136 HydrophobicContact CD1-CB 3.81Å; I124-F139 HydrophobicContact CB-CD1 4.5Å; I124-F139 HydrophobicContact CD1-CB 4.47Å; I124-F139 HydrophobicContact CD1-CD1 3.51Å; I124-F139 HydrophobicContact CD1-CE1 4.11Å; I124-F139 HydrophobicContact CD1-CG 4.31Å; I124-F139 HydrophobicContact CG1-CD1 3.76Å; I124-F139 HydrophobicContact CG1-CE1 3.86Å; I124-F139 HydrophobicContact CG2-CD1 3.94Å; I124-F139 HydrophobicContact CG2-CD2 4.47Å; I124-F139 HydrophobicContact CG2-CE1 4.21Å; I124-F139 HydrophobicContact CG2-CG 4.06Å; I124-L140 HydrophobicContact CD1-CD1 4.41Å; I124-L140 HydrophobicContact CD1-CD2 4.32Å; I124-L140 HydrophobicContact CD1-CG 3.98Å; I124-Y151 HydrophobicContact CG1-CD1 4.22Å; I124-Y151 HydrophobicContact CG1-CE1 3.82Å
125	N	82.5	Confident	66.9	Low	84 Å²	84	95 Å²	95	45%	0.449	53%	0.527	S	S	.	.			trans	-96.8	108.1	174.9	-176.1	-1.2	0	0	0	109.2	D127 S128	N125-D127 PolarHBondContact O-N 3.04Å; N125-D127 WeakPolarHBondContact OD1-CB 3.5Å; N125-D127 PolarHBondContact OD1-N 2.73Å; N125-S128 PolarHBondContact O-N 2.72Å
126	L	85.9	Confident	69.6	Low	10 Å²	10	91.7 Å²	91.7	5%	0.052	49%	0.493	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-8.1	179.9	-62	-178.4	0	0	0	113.9	I124 A136 L140 Y151 P227 L228 Y250	I124-L126 HydrophobicContact CD1-CD2 3.6Å; I124-L126 HydrophobicContact CG1-CD2 4.13Å; L126-A136 HydrophobicContact CD2-CB 4.4Å; L126-L140 HydrophobicContact CD2-CD1 4.01Å; L126-Y151 HydrophobicContact CD1-CD1 4.39Å; L126-P227 WeakPolarHBondContact O-CD 3.49Å; L126-P227 WeakPolarHBondContact O-CG 3.49Å; L126-L228 HydrophobicContact CD2-CD1 3.84Å; L126-Y250 HydrophobicContact CD2-CD1 4.49Å
127	D	82.9	Confident	72.1	Confident	90 Å²	90	88.2 Å²	88.2	48%	0.481	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-12.4	176.4	-67.8	-79.2	0	0	0	113.5	N125 A129 R153	N125-D127 PolarHBondContact O-N 3.04Å; N125-D127 WeakPolarHBondContact OD1-CB 3.5Å; N125-D127 PolarHBondContact OD1-N 2.73Å; D127-A129 PolarHBondContact O-N 2.88Å; D127-A129 VanDerWaalsContact O-N 3.13Å; D127-R153 IonicContact OD1-CZ 2.73Å; D127-R153 VanDerWaalsContact OD1-CZ 3.27Å; D127-R153 IonicContact OD1-NH1 2.69Å; D127-R153 PolarHBondContact OD1-NH1 3.04Å; D127-R153 IonicContact OD1-NH2 3.1Å; D127-R153 PolarHBondContact OD1-NH2 2.79Å; D127-R153 IonicContact OD2-CZ 3.44Å; D127-R153 IonicContact OD2-NH1 3.89Å; D127-R153 PolarHBondContact OD2-NH1 3.01Å; D127-R153 IonicContact OD2-NH2 3.31Å
128	S	77.5	Confident	74.8	Confident	26 Å²	26	85.7 Å²	85.7	18%	0.182	46%	0.455	C	S	.	.			trans	-73.5	107	-179.8	-179.9	0	0	0	0	110.8	N125 E130 R131	N125-S128 PolarHBondContact O-N 2.72Å; S128-E130 PolarHBondContact O-N 3.44Å; S128-R131 PolarHBondContact O-N 3.19Å
129	A	64	Low	77.4	Confident	74 Å²	74	81.9 Å²	81.9	61%	0.612	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-14.5	173.2	0	0	0	0	0	113.5	D127	D127-A129 PolarHBondContact O-N 2.88Å; D127-A129 VanDerWaalsContact O-N 3.13Å
130	E	62.8	Low	79.9	Confident	189 Å²	189	77.7 Å²	77.7	88%	0.883	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-14.6	-179	-59.8	176.8	153	0	0	113.5	S128	S128-E130 PolarHBondContact O-N 3.44Å
131	R	68.1	Low	82.3	Confident	81 Å²	81	72.5 Å²	72.5	31%	0.306	37%	0.369	S	S	.	.	S	Bend	trans	-77.2	144.2	179.2	-83.8	-171	174.2	-89.5	1.7	112.2	S128 W133 E135	S128-R131 PolarHBondContact O-N 3.19Å; R131-W133 PolarHBondContact O-N 3.04Å; R131-E135 IonicContact NH1-OE2 2.73Å; R131-E135 PolarHBondContact NH1-OE2 3.44Å
132	D	85.5	Confident	84.3	Confident	60 Å²	60	71.8 Å²	71.8	32%	0.321	37%	0.367	S	S	.	.			trans	-64.6	126.7	167	-164.4	-19.6	0	0	0	109.2	K134 E135	D132-K134 PolarHBondContact O-N 2.72Å; D132-K134 WeakPolarHBondContact OD1-CB 3.4Å; D132-K134 VanDerWaalsContact OD1-CG 3.31Å; D132-K134 WeakPolarHBondContact OD1-CG 3.23Å; D132-K134 PolarHBondContact OD1-N 2.86Å; D132-K134 IonicContact OD1-NZ 3.56Å; D132-K134 PolarHBondContact OD1-NZ 2.73Å; D132-K134 IonicContact OD2-NZ 3.6Å; D132-K134 PolarHBondContact OD2-NZ 3.1Å; D132-E135 HydrophobicContact CB-CG 4.42Å; D132-E135 PolarHBondContact O-N 2.91Å
133	W	93.4	Very high	86	Confident	46 Å²	46	68.2 Å²	68.2	17%	0.174	35%	0.348	C	S	.	.	H	α-helix	trans	-65.8	-20.1	177	61.5	-100.2	0	0	0	112	R131 K137 L228 N231 E232 S235 Y250	R131-W133 PolarHBondContact O-N 3.04Å; W133-K137 HydrophobicContact CE3-CD 4.33Å; W133-K137 HydrophobicContact CZ3-CD 4.04Å; W133-K137 WeakPolarHBondContact O-CB 3.3Å; W133-K137 PolarHBondContact O-N 3.41Å; W133-L228 HydrophobicContact CB-CB 4.37Å; W133-L228 HydrophobicContact CB-CD2 4.42Å; W133-N231 HydrophobicContact CB-CB 4.3Å; W133-N231 HydrophobicContact CG-CB 4.36Å; W133-E232 HydrophobicContact CD2-CB 3.76Å; W133-E232 HydrophobicContact CD2-CG 3.96Å; W133-E232 HydrophobicContact CE3-CB 3.78Å; W133-E232 HydrophobicContact CE3-CG 3.57Å; W133-E232 HydrophobicContact CG-CB 4.08Å; W133-E232 HydrophobicContact CH2-CG 3.95Å; W133-E232 HydrophobicContact CZ2-CG 4.3Å; W133-E232 HydrophobicContact CZ3-CB 4.3Å; W133-E232 HydrophobicContact CZ3-CG 3.57Å; W133-E232 WeakPolarHBondContact CZ3-OE1 3.46Å; W133-S235 VanDerWaalsContact CZ2-OG 3.3Å; W133-S235 WeakPolarHBondContact CZ2-OG 3.29Å; W133-Y250 HydrophobicContact CB-CE1 4.43Å; W133-Y250 PolarHBondContact O-OH 3.43Å; W133-Y250 VanDerWaalsContact O-OH 3.11Å
134	K	94.6	Very high	87.1	Confident	99 Å²	99	63 Å²	63	43%	0.43	33%	0.333	S	S	.	.	H	α-helix	trans	-67	-51.6	174.7	-61.9	-178.4	-144	101.1	0	112.2	D132 A136 K137 D138	D132-K134 PolarHBondContact O-N 2.72Å; D132-K134 WeakPolarHBondContact OD1-CB 3.4Å; D132-K134 VanDerWaalsContact OD1-CG 3.31Å; D132-K134 WeakPolarHBondContact OD1-CG 3.23Å; D132-K134 PolarHBondContact OD1-N 2.86Å; D132-K134 IonicContact OD1-NZ 3.56Å; D132-K134 PolarHBondContact OD1-NZ 2.73Å; D132-K134 IonicContact OD2-NZ 3.6Å; D132-K134 PolarHBondContact OD2-NZ 3.1Å; K134-A136 PolarHBondContact O-N 2.94Å; K134-K137 WeakPolarHBondContact O-CB 3.33Å; K134-K137 PolarHBondContact O-N 2.94Å; K134-D138 PolarHBondContact O-N 3.24Å
135	E	92.7	Very high	87.6	Confident	112 Å²	112	65.3 Å²	65.3	52%	0.523	35%	0.347	S	S	.	.	H	α-helix	trans	-54.3	-44.3	175.9	-68.5	-175.5	175.2	0	0	111.1	R131 D132 F139	R131-E135 IonicContact NH1-OE2 2.73Å; R131-E135 PolarHBondContact NH1-OE2 3.44Å; D132-E135 HydrophobicContact CB-CG 4.42Å; D132-E135 PolarHBondContact O-N 2.91Å; E135-F139 WeakPolarHBondContact O-CB 3.49Å; E135-F139 PolarHBondContact O-N 2.79Å
136	A	94.4	Very high	88.1	Confident	2 Å²	2	69.1 Å²	69.1	2%	0.017	36%	0.36	C	S	.	.	H	α-helix	trans	-67.1	-39	179	0	0	0	0	0	112.6	I124 L126 K134 L140 L228 Y250	I124-A136 HydrophobicContact CD1-CB 3.81Å; L126-A136 HydrophobicContact CD2-CB 4.4Å; K134-A136 PolarHBondContact O-N 2.94Å; A136-L140 VanDerWaalsContact O-CB 3.28Å; A136-L140 WeakPolarHBondContact O-CB 3.4Å; A136-L140 WeakPolarHBondContact O-CG 3.45Å; A136-L140 PolarHBondContact O-N 3.06Å; A136-L228 HydrophobicContact CB-CD1 3.6Å; A136-Y250 HydrophobicContact CB-CD1 4.39Å; A136-Y250 HydrophobicContact CB-CE1 4.05Å
137	K	95.9	Very high	88.5	Confident	45 Å²	45	72.5 Å²	72.5	20%	0.196	38%	0.378	C	S	.	.	H	α-helix	trans	-65.1	-52.8	176.4	170.9	171	-176.4	177.1	0	111.5	W133 K134 F139 L140 L141 E232 C248	W133-K137 HydrophobicContact CE3-CD 4.33Å; W133-K137 HydrophobicContact CZ3-CD 4.04Å; W133-K137 WeakPolarHBondContact O-CB 3.3Å; W133-K137 PolarHBondContact O-N 3.41Å; K134-K137 WeakPolarHBondContact O-CB 3.33Å; K134-K137 PolarHBondContact O-N 2.94Å; K137-F139 VanDerWaalsContact C-N 3.32Å; K137-F139 PolarHBondContact O-N 3.02Å; K137-L140 PolarHBondContact O-N 2.95Å; K137-L141 HydrophobicContact CG-CD1 3.71Å; K137-L141 HydrophobicContact CG-CG 4.47Å; K137-L141 WeakPolarHBondContact O-CB 3.33Å; K137-L141 VanDerWaalsContact O-CG 3.27Å; K137-L141 WeakPolarHBondContact O-CG 3.22Å; K137-L141 PolarHBondContact O-N 2.69Å; K137-E232 WeakPolarHBondContact CD-OE1 3.41Å; K137-E232 IonicContact NZ-OE1 3.47Å; K137-E232 PolarHBondContact NZ-OE1 2.91Å; K137-C248 HydrophobicContact CB-CB 4.06Å; K137-C248 HydrophobicContact CD-CB 4.14Å; K137-C248 HydrophobicContact CG-CB 3.86Å
138	D	95	Very high	89.1	Confident	110 Å²	110	68.5 Å²	68.5	59%	0.588	36%	0.356	S	S	*	.	H	α-helix	trans	-62.5	-42.2	-178.1	-64.8	-15.9	0	0	0	110.7	K134 S142	K134-D138 PolarHBondContact O-N 3.24Å; D138-S142 WeakPolarHBondContact O-CB 3.45Å; D138-S142 PolarHBondContact O-N 3.05Å; D138-S142 VanDerWaalsContact O-N 3.15Å
139	F	94.8	Very high	90	Very high	38 Å²	38	73.2 Å²	73.2	17%	0.167	37%	0.37	C	S	.	.	H	α-helix	trans	-59.5	-55.3	172	178.3	-95.2	0	0	0	112.2	L122 I124 E135 K137 L141 S142 L143 Y151	L122-F139 WeakPolarHBondContact O-CE2 3.38Å; L122-F139 VanDerWaalsContact O-CZ 3.25Å; L122-F139 WeakPolarHBondContact O-CZ 3.22Å; I124-F139 HydrophobicContact CB-CD1 4.5Å; I124-F139 HydrophobicContact CD1-CB 4.47Å; I124-F139 HydrophobicContact CD1-CD1 3.51Å; I124-F139 HydrophobicContact CD1-CE1 4.11Å; I124-F139 HydrophobicContact CD1-CG 4.31Å; I124-F139 HydrophobicContact CG1-CD1 3.76Å; I124-F139 HydrophobicContact CG1-CE1 3.86Å; I124-F139 HydrophobicContact CG2-CD1 3.94Å; I124-F139 HydrophobicContact CG2-CD2 4.47Å; I124-F139 HydrophobicContact CG2-CE1 4.21Å; I124-F139 HydrophobicContact CG2-CG 4.06Å; E135-F139 WeakPolarHBondContact O-CB 3.49Å; E135-F139 PolarHBondContact O-N 2.79Å; K137-F139 VanDerWaalsContact C-N 3.32Å; K137-F139 PolarHBondContact O-N 3.02Å; F139-L141 VanDerWaalsContact C-N 3.29Å; F139-L141 PolarHBondContact O-N 3.29Å; F139-S142 PolarHBondContact O-N 2.65Å; F139-S142 VanDerWaalsContact O-N 3.09Å; F139-S142 PolarHBondContact O-OG 2.75Å; F139-L143 HydrophobicContact CD1-CD1 4.25Å; F139-L143 HydrophobicContact CE1-CD1 3.7Å; F139-L143 HydrophobicContact CE1-CG 4.26Å; F139-L143 HydrophobicContact CZ-CD1 4.17Å; F139-L143 HydrophobicContact CZ-CD2 4.22Å; F139-L143 HydrophobicContact CZ-CG 4.46Å; F139-L143 PolarHBondContact O-N 2.91Å; F139-Y151 HydrophobicContact CE1-CE1 4.24Å; F139-Y151 HydrophobicContact CE1-CE2 4.02Å; F139-Y151 AromaticContact CE1-CZ 3.68Å
140	L	95.9	Very high	91.4	Very high	0 Å²	0	72.5 Å²	72.5	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-64.7	-29.5	-175.8	-74.9	174.1	0	0	0	113.9	I124 L126 A136 K137 L143 R148 Y151 Y250	I124-L140 HydrophobicContact CD1-CD1 4.41Å; I124-L140 HydrophobicContact CD1-CD2 4.32Å; I124-L140 HydrophobicContact CD1-CG 3.98Å; L126-L140 HydrophobicContact CD2-CD1 4.01Å; A136-L140 VanDerWaalsContact O-CB 3.28Å; A136-L140 WeakPolarHBondContact O-CB 3.4Å; A136-L140 WeakPolarHBondContact O-CG 3.45Å; A136-L140 PolarHBondContact O-N 3.06Å; K137-L140 PolarHBondContact O-N 2.95Å; L140-L143 HydrophobicContact CD2-CD1 4.32Å; L140-R148 VanDerWaalsContact O-CD 3.27Å; L140-R148 WeakPolarHBondContact O-CD 3.28Å; L140-R148 PolarHBondContact O-NE 2.76Å; L140-Y151 HydrophobicContact CD2-CD1 4.45Å; L140-Y151 HydrophobicContact CD2-CD2 4.15Å; L140-Y151 HydrophobicContact CD2-CG 3.96Å; L140-Y250 HydrophobicContact CD1-CD1 4.2Å
141	L	95.8	Very high	93	Very high	60 Å²	60	65.2 Å²	65.2	31%	0.314	33%	0.334	S	S	.	.	H	α-helix	trans	-80.3	-20.4	176.4	-65.5	175.1	0	0	0	112.6	K137 F139 K255 Y256	K137-L141 HydrophobicContact CG-CD1 3.71Å; K137-L141 HydrophobicContact CG-CG 4.47Å; K137-L141 WeakPolarHBondContact O-CB 3.33Å; K137-L141 VanDerWaalsContact O-CG 3.27Å; K137-L141 WeakPolarHBondContact O-CG 3.22Å; K137-L141 PolarHBondContact O-N 2.69Å; F139-L141 VanDerWaalsContact C-N 3.29Å; F139-L141 PolarHBondContact O-N 3.29Å; L141-K255 HydrophobicContact CD2-CB 4.3Å; L141-Y256 HydrophobicContact CD1-CE1 3.76Å; L141-Y256 HydrophobicContact CD2-CD1 4.29Å; L141-Y256 HydrophobicContact CD2-CE1 3.61Å; L141-Y256 HydrophobicContact CG-CE1 4.37Å
142	S	95.7	Very high	94.3	Very high	91 Å²	91	63 Å²	63	64%	0.636	33%	0.326	S	S	*	.	H	α-helix	trans	-77.3	-18.8	172.2	77.5	0	0	0	0	114.1	D138 F139	D138-S142 WeakPolarHBondContact O-CB 3.45Å; D138-S142 PolarHBondContact O-N 3.05Å; D138-S142 VanDerWaalsContact O-N 3.15Å; F139-S142 PolarHBondContact O-N 2.65Å; F139-S142 VanDerWaalsContact O-N 3.09Å; F139-S142 PolarHBondContact O-OG 2.75Å
143	L	95	Very high	94.8	Very high	40 Å²	40	65.1 Å²	65.1	21%	0.209	33%	0.329	C	S	.	.	S	Bend	trans	-78.9	147.4	-175.1	-70.6	-175.8	0	0	0	113.3	F139 L140 D147 R148 Y151	F139-L143 HydrophobicContact CD1-CD1 4.25Å; F139-L143 HydrophobicContact CE1-CD1 3.7Å; F139-L143 HydrophobicContact CE1-CG 4.26Å; F139-L143 HydrophobicContact CZ-CD1 4.17Å; F139-L143 HydrophobicContact CZ-CD2 4.22Å; F139-L143 HydrophobicContact CZ-CG 4.46Å; F139-L143 PolarHBondContact O-N 2.91Å; L140-L143 HydrophobicContact CD2-CD1 4.32Å; L143-D147 HydrophobicContact CB-CB 4.32Å; L143-D147 HydrophobicContact CD1-CB 4.41Å; L143-D147 HydrophobicContact CD2-CB 4.17Å; L143-R148 HydrophobicContact CB-CG 3.61Å; L143-R148 HydrophobicContact CD1-CG 4.32Å; L143-Y151 HydrophobicContact CD1-CD2 3.94Å; L143-Y151 HydrophobicContact CD1-CE2 3.64Å
144	S	95	Very high	94.6	Very high	57 Å²	57	64 Å²	64	40%	0.399	33%	0.328	S	S	.	.			trans	-65.9	156.9	167.2	89.7	0	0	0	0	110.9	K146 D147 R148	S144-K146 PolarHBondContact O-N 2.82Å; S144-K146 PolarHBondContact OG-N 3.35Å; S144-D147 WeakPolarHBondContact CB-OD2 3.31Å; S144-D147 PolarHBondContact O-N 3.24Å; S144-D147 VanDerWaalsContact OG-CG 3.31Å; S144-D147 PolarHBondContact OG-N 3.5Å; S144-D147 PolarHBondContact OG-OD2 3.49Å; S144-R148 WeakPolarHBondContact O-CG 3.13Å; S144-R148 PolarHBondContact O-N 2.74Å
145	V	92.1	Very high	94.4	Very high	58 Å²	58	64.2 Å²	64.2	35%	0.352	34%	0.342	S	S	.	.	H	α-helix	trans	-55.2	-39	176.5	-179.5	0	0	0	0	111.3	D147 R148 R149 E199	V145-D147 VanDerWaalsContact C-N 3.3Å; V145-D147 PolarHBondContact O-N 3.07Å; V145-R148 PolarHBondContact O-N 3.22Å; V145-R149 WeakPolarHBondContact O-CG 3.31Å; V145-R149 PolarHBondContact O-N 3.36Å; V145-E199 HydrophobicContact CG1-CG 4.12Å
146	K	93.9	Very high	94.5	Very high	164 Å²	164	61.6 Å²	61.6	71%	0.713	35%	0.345	S	S	*	.	H	α-helix	trans	-59.4	-39.3	177	-178	-174.8	173.5	-172.1	0	112.4	S144	S144-K146 PolarHBondContact O-N 2.82Å; S144-K146 PolarHBondContact OG-N 3.35Å
147	D	94.5	Very high	94.6	Very high	80 Å²	80	63.4 Å²	63.4	43%	0.428	36%	0.357	S	S	.	.	H	α-helix	trans	-83.9	-34.8	-177.7	-51	-54.2	0	0	0	111.4	L143 S144 V145 R149 G150	L143-D147 HydrophobicContact CB-CB 4.32Å; L143-D147 HydrophobicContact CD1-CB 4.41Å; L143-D147 HydrophobicContact CD2-CB 4.17Å; S144-D147 WeakPolarHBondContact CB-OD2 3.31Å; S144-D147 PolarHBondContact O-N 3.24Å; S144-D147 VanDerWaalsContact OG-CG 3.31Å; S144-D147 PolarHBondContact OG-N 3.5Å; S144-D147 PolarHBondContact OG-OD2 3.49Å; V145-D147 VanDerWaalsContact C-N 3.3Å; V145-D147 PolarHBondContact O-N 3.07Å; D147-R149 PolarHBondContact O-N 2.92Å; D147-G150 PolarHBondContact O-N 2.9Å
148	R	95	Very high	94.7	Very high	7 Å²	7	62.3 Å²	62.3	3%	0.026	36%	0.355	C	S	.	.	H	α-helix	trans	-56.8	-36.3	172.4	-73.2	-168.5	69.8	-112.1	-9.3	112.3	L140 L143 S144 V145 G150 Y151 Y152 L252 P253 A254	L140-R148 VanDerWaalsContact O-CD 3.27Å; L140-R148 WeakPolarHBondContact O-CD 3.28Å; L140-R148 PolarHBondContact O-NE 2.76Å; L143-R148 HydrophobicContact CB-CG 3.61Å; L143-R148 HydrophobicContact CD1-CG 4.32Å; S144-R148 WeakPolarHBondContact O-CG 3.13Å; S144-R148 PolarHBondContact O-N 2.74Å; V145-R148 PolarHBondContact O-N 3.22Å; R148-G150 PolarHBondContact O-N 3.21Å; R148-Y151 PolarHBondContact O-N 3.11Å; R148-Y152 VanDerWaalsContact C-CE1 3.45Å; R148-Y152 HydrophobicContact CB-CE1 3.89Å; R148-Y152 PolarHBondContact NH1-OH 3.23Å; R148-Y152 VanDerWaalsContact O-CD1 3.23Å; R148-Y152 WeakPolarHBondContact O-CD1 3.49Å; R148-Y152 WeakPolarHBondContact O-CE1 3.42Å; R148-L252 PolarHBondContact NH2-O 3.33Å; R148-L252 VanDerWaalsContact NH2-O 3.14Å; R148-P253 PolarHBondContact NH1-O 3.42Å; R148-A254 PolarHBondContact NH2-O 2.85Å
149	R	95.4	Very high	94.8	Very high	125 Å²	125	58.4 Å²	58.4	47%	0.472	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-52.3	-28.6	174.4	-74.3	168.3	-179.4	-176.1	0.6	113.8	V145 D147 Y151 Y152 E199	V145-R149 WeakPolarHBondContact O-CG 3.31Å; V145-R149 PolarHBondContact O-N 3.36Å; D147-R149 PolarHBondContact O-N 2.92Å; R149-Y151 PolarHBondContact O-N 2.82Å; R149-Y152 HydrophobicContact CB-CD2 4.27Å; R149-Y152 HydrophobicContact CB-CE2 4.06Å; R149-Y152 HydrophobicContact CG-CD2 4.04Å; R149-Y152 HydrophobicContact CG-CE2 3.43Å; R149-Y152 VanDerWaalsContact CG-CE2 3.43Å; R149-Y152 PolarHBondContact O-N 3.21Å; R149-E199 WeakPolarHBondContact CG-OE1 3.39Å; R149-E199 IonicContact CZ-OE1 2.87Å; R149-E199 IonicContact CZ-OE2 3.31Å; R149-E199 IonicContact NE-OE1 2.97Å; R149-E199 PolarHBondContact NE-OE1 2.91Å; R149-E199 IonicContact NE-OE2 3.75Å; R149-E199 IonicContact NH2-OE1 2.72Å; R149-E199 PolarHBondContact NH2-OE1 2.75Å; R149-E199 IonicContact NH2-OE2 3.27Å; R149-E199 PolarHBondContact NH2-OE2 3.09Å
150	G	94.4	Very high	95	Very high	59 Å²	59	58.4 Å²	58.4	61%	0.608	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-68.9	-7	175.3	0	0	0	0	0	115.4	D147 R148	D147-G150 PolarHBondContact O-N 2.9Å; R148-G150 PolarHBondContact O-N 3.21Å
151	Y	95	Very high	95	Very high	36 Å²	36	65.4 Å²	65.4	14%	0.141	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-117	-0.1	-179.3	-63.3	-87.4	0	0	0	113.4	K123 I124 L126 F139 L140 L143 R148 R149 R153	K123-Y151 HydrophobicContact CG-CE1 4.22Å; I124-Y151 HydrophobicContact CG1-CD1 4.22Å; I124-Y151 HydrophobicContact CG1-CE1 3.82Å; L126-Y151 HydrophobicContact CD1-CD1 4.39Å; F139-Y151 HydrophobicContact CE1-CE1 4.24Å; F139-Y151 HydrophobicContact CE1-CE2 4.02Å; F139-Y151 AromaticContact CE1-CZ 3.68Å; L140-Y151 HydrophobicContact CD2-CD1 4.45Å; L140-Y151 HydrophobicContact CD2-CD2 4.15Å; L140-Y151 HydrophobicContact CD2-CG 3.96Å; L143-Y151 HydrophobicContact CD1-CD2 3.94Å; L143-Y151 HydrophobicContact CD1-CE2 3.64Å; R148-Y151 PolarHBondContact O-N 3.11Å; R149-Y151 PolarHBondContact O-N 2.82Å; Y151-R153 PolarHBondContact O-N 3.3Å
152	Y	96.3	Very high	95.1	Very high	35 Å²	35	68.1 Å²	68.1	14%	0.137	39%	0.389	C	S	.	.			trans	-70.9	130.6	-178.8	-63.4	-8.4	0	0	0	111.4	R148 R149 E199 G251 P253	R148-Y152 VanDerWaalsContact C-CE1 3.45Å; R148-Y152 HydrophobicContact CB-CE1 3.89Å; R148-Y152 PolarHBondContact NH1-OH 3.23Å; R148-Y152 VanDerWaalsContact O-CD1 3.23Å; R148-Y152 WeakPolarHBondContact O-CD1 3.49Å; R148-Y152 WeakPolarHBondContact O-CE1 3.42Å; R149-Y152 HydrophobicContact CB-CD2 4.27Å; R149-Y152 HydrophobicContact CB-CE2 4.06Å; R149-Y152 HydrophobicContact CG-CD2 4.04Å; R149-Y152 HydrophobicContact CG-CE2 3.43Å; R149-Y152 VanDerWaalsContact CG-CE2 3.43Å; R149-Y152 PolarHBondContact O-N 3.21Å; Y152-E199 HydrophobicContact CE2-CG 4.36Å; Y152-E199 WeakPolarHBondContact CE2-OE1 3.31Å; Y152-E199 PolarHBondContact OH-OE1 3.15Å; Y152-G251 WeakPolarHBondContact CA-O 3.42Å; Y152-P253 HydrophobicContact CD2-CB 3.99Å; Y152-P253 HydrophobicContact CD2-CG 3.9Å; Y152-P253 HydrophobicContact CE1-CB 4.45Å; Y152-P253 HydrophobicContact CE2-CB 3.71Å; Y152-P253 HydrophobicContact CE2-CG 4.16Å; Y152-P253 HydrophobicContact CG-CB 4.48Å; Y152-P253 HydrophobicContact CG-CG 4.2Å; Y152-P253 VanDerWaalsContact CZ-CA 3.46Å; Y152-P253 PolarHBondContact OH-O 2.95Å
153	R	95	Very high	95.3	Very high	103 Å²	103	63.9 Å²	63.9	39%	0.389	36%	0.359	S	S	.	.			trans	-91.1	-16.1	-178.7	-57.9	175.1	71.9	93.9	4.4	112.3	D127 Y151 A224 G251	D127-R153 IonicContact OD1-CZ 2.73Å; D127-R153 VanDerWaalsContact OD1-CZ 3.27Å; D127-R153 IonicContact OD1-NH1 2.69Å; D127-R153 PolarHBondContact OD1-NH1 3.04Å; D127-R153 IonicContact OD1-NH2 3.1Å; D127-R153 PolarHBondContact OD1-NH2 2.79Å; D127-R153 IonicContact OD2-CZ 3.44Å; D127-R153 IonicContact OD2-NH1 3.89Å; D127-R153 PolarHBondContact OD2-NH1 3.01Å; D127-R153 IonicContact OD2-NH2 3.31Å; Y151-R153 PolarHBondContact O-N 3.3Å; R153-A224 WeakPolarHBondContact CB-O 3.32Å; R153-A224 WeakPolarHBondContact CD-O 3.44Å; R153-G251 PolarHBondContact N-O 2.94Å
154	T	90.4	Very high	95.3	Very high	24 Å²	24	66.1 Å²	66.1	15%	0.147	38%	0.376	C	S	.	.	S	Bend	trans	-97.4	130.4	176	54.3	0	0	0	0	111.4	A224	T154-A224 HydrophobicContact CG2-CB 3.78Å
155	S	90.8	Very high	95.4	Very high	103 Å²	103	65.2 Å²	65.2	72%	0.72	37%	0.368	S	S	*	.	S	Bend	trans	-82	144.8	168.6	56.9	0	0	0	0	112.1	K197	S155-K197 PolarHBondContact O-NZ 2.71Å
156	G	93.4	Very high	95.6	Very high	57 Å²	57	64.1 Å²	64.1	59%	0.588	36%	0.357	S	S	*	.	S	Bend	trans	71.7	56.8	-178.3	0	0	0	0	0	112.9
157	S	96.5	Very high	95.2	Very high	39 Å²	39	60 Å²	60	27%	0.273	35%	0.347	S	S	.	.			trans	-64.3	147.6	168.4	51.2	0	0	0	0	111.2	K197	S157-K197 CarbonylContact C-O 3.53Å; S157-K197 VanDerWaalsContact CA-O 3.25Å; S157-K197 WeakPolarHBondContact CA-O 3.39Å
158	V	98.3	Very high	94.2	Very high	23 Å²	23	57.6 Å²	57.6	14%	0.139	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	106	-177.1	-177.7	0	0	0	0	109.2	D162 I163 Y191 K197 L198 E199	V158-D162 HydrophobicContact CG1-CB 4.14Å; V158-I163 HydrophobicContact CG1-CD1 4.35Å; V158-I163 HydrophobicContact CG1-CG1 3.82Å; V158-Y191 HydrophobicContact CG1-CE2 4.29Å; V158-K197 PolarHBondContact N-O 3.28Å; V158-L198 HydrophobicContact CB-CD2 4.17Å; V158-E199 PolarHBondContact O-N 2.46Å
159	P	97.9	Very high	93.1	Very high	27 Å²	27	62.5 Å²	62.5	18%	0.175	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.1	151.5	171.1	-26.6	35.2	0	0	0	113.4	D161 D162	P159-D161 PolarHBondContact O-N 2.67Å; P159-D162 WeakPolarHBondContact CD-OD2 3.43Å; P159-D162 PolarHBondContact O-N 2.86Å; P159-D162 VanDerWaalsContact O-N 3.14Å
160	L	98.1	Very high	91.5	Very high	38 Å²	38	59.6 Å²	59.6	20%	0.199	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-55.3	-35.2	175	-177.9	59.1	0	0	0	113.3	D162 I163 I200 R334 I336	L160-D162 VanDerWaalsContact C-N 3.31Å; L160-D162 PolarHBondContact O-N 3.1Å; L160-I163 WeakPolarHBondContact O-CB 3.36Å; L160-I163 PolarHBondContact O-N 3.42Å; L160-I163 VanDerWaalsContact O-N 3.15Å; L160-I200 HydrophobicContact CB-CG2 4.22Å; L160-I200 HydrophobicContact CD1-CG2 4.06Å; L160-R334 HydrophobicContact CD1-CB 3.93Å; L160-R334 HydrophobicContact CD1-CG 4.16Å; L160-I336 HydrophobicContact CD1-CD1 3.95Å
161	D	97.3	Very high	89.6	Confident	148 Å²	148	60.3 Å²	60.3	79%	0.791	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-70.3	-27.1	-178	-57.8	-34.1	0	0	0	112.7	P159 I163	P159-D161 PolarHBondContact O-N 2.67Å; D161-I163 PolarHBondContact O-N 2.92Å
162	D	98	Very high	87.7	Confident	117 Å²	117	61.4 Å²	61.4	63%	0.626	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-79.5	-5.4	174.5	-69.4	-20.5	0	0	0	112.3	V158 P159 L160 P164	V158-D162 HydrophobicContact CG1-CB 4.14Å; P159-D162 WeakPolarHBondContact CD-OD2 3.43Å; P159-D162 PolarHBondContact O-N 2.86Å; P159-D162 VanDerWaalsContact O-N 3.14Å; L160-D162 VanDerWaalsContact C-N 3.31Å; L160-D162 PolarHBondContact O-N 3.1Å; D162-P164 WeakPolarHBondContact O-CD 3.35Å
163	I	98.3	Very high	85.9	Confident	2 Å²	2	65.7 Å²	65.7	1%	0.01	43%	0.428	C	S	.	.	S	Bend	trans	-96.1	108.3	179.7	-56.3	173.6	0	0	0	108.9	V158 L160 D161 V165 Y191 L198 I200 R334 I336	V158-I163 HydrophobicContact CG1-CD1 4.35Å; V158-I163 HydrophobicContact CG1-CG1 3.82Å; L160-I163 WeakPolarHBondContact O-CB 3.36Å; L160-I163 PolarHBondContact O-N 3.42Å; L160-I163 VanDerWaalsContact O-N 3.15Å; D161-I163 PolarHBondContact O-N 2.92Å; I163-V165 PolarHBondContact O-N 3.14Å; I163-Y191 HydrophobicContact CG1-CD2 4.37Å; I163-Y191 HydrophobicContact CG2-CD2 4.31Å; I163-L198 HydrophobicContact CD1-CD2 3.92Å; I163-I200 HydrophobicContact CD1-CG2 4.41Å; I163-R334 PolarHBondContact O-NH1 3.01Å; I163-I336 HydrophobicContact CD1-CD1 3.77Å; I163-I336 HydrophobicContact CG2-CD1 4.37Å; I163-I336 HydrophobicContact CG2-CG2 4.21Å
164	P	96.9	Very high	84.4	Confident	87 Å²	87	65.1 Å²	65.1	57%	0.565	44%	0.436	S	S	*	.			trans	-63.7	138.3	-174.2	25.6	-34.6	0	0	0	111.7	D162 S189	D162-P164 WeakPolarHBondContact O-CD 3.35Å; P164-S189 VanDerWaalsContact O-CB 3.27Å; P164-S189 WeakPolarHBondContact O-CB 3.34Å; P164-S189 PolarHBondContact O-OG 2.85Å
165	V	96.9	Very high	83.4	Confident	37 Å²	37	69.4 Å²	69.4	22%	0.224	46%	0.464	C	S	.	.			trans	-61.9	136.4	165	172.4	0	0	0	0	108.7	I163 T167	I163-V165 PolarHBondContact O-N 3.14Å; V165-T167 HydrophobicContact CG1-CG2 4.19Å; V165-T167 PolarHBondContact O-N 3.29Å
166	W	94.4	Very high	82.8	Confident	35 Å²	35	67 Å²	67	13%	0.133	45%	0.448	C	S	.	.			trans	-79.6	113.8	164.4	177.9	84.1	0	0	0	108.6	P168 I188 L352 P353 F356	W166-P168 HydrophobicContact CE3-CG 4.41Å; W166-P168 HydrophobicContact CH2-CB 3.94Å; W166-P168 HydrophobicContact CH2-CG 4.03Å; W166-P168 HydrophobicContact CZ3-CB 4.11Å; W166-P168 HydrophobicContact CZ3-CG 3.67Å; W166-I188 HydrophobicContact CB-CG2 4.39Å; W166-I188 PolarHBondContact N-O 2.76Å; W166-L352 HydrophobicContact CD2-CB 4.19Å; W166-L352 HydrophobicContact CD2-CD1 3.87Å; W166-L352 HydrophobicContact CD2-CD2 4.49Å; W166-L352 HydrophobicContact CD2-CG 4.42Å; W166-L352 HydrophobicContact CE3-CB 4.37Å; W166-L352 HydrophobicContact CE3-CD1 4.45Å; W166-L352 HydrophobicContact CE3-CD2 4.26Å; W166-L352 HydrophobicContact CG-CD1 3.9Å; W166-L352 HydrophobicContact CH2-CB 3.82Å; W166-L352 HydrophobicContact CZ2-CB 3.6Å; W166-L352 HydrophobicContact CZ3-CB 4.2Å; W166-L352 HydrophobicContact CZ3-CD2 4.46Å; W166-P353 HydrophobicContact CH2-CG 4.25Å; W166-P353 HydrophobicContact CZ2-CG 3.96Å; W166-F356 HydrophobicContact CH2-CB 4.46Å; W166-F356 VanDerWaalsContact CH2-O 3.29Å; W166-F356 WeakPolarHBondContact CH2-O 3.39Å; W166-F356 HydrophobicContact CZ3-CB 3.73Å; W166-F356 WeakPolarHBondContact CZ3-O 3.41Å
167	T	85.4	Confident	82.5	Confident	79 Å²	79	70.8 Å²	70.8	49%	0.485	44%	0.444	S	S	.	.			trans	-94.8	137.2	175.7	47.1	0	0	0	0	110.8	V165 T169	V165-T167 HydrophobicContact CG1-CG2 4.19Å; V165-T167 PolarHBondContact O-N 3.29Å; T167-T169 PolarHBondContact O-N 3.45Å; T167-T169 VanDerWaalsContact O-N 3.1Å
168	P	74.1	Confident	82.3	Confident	28 Å²	28	71.3 Å²	71.3	18%	0.182	44%	0.44	C	S	.	.			trans	-67.3	105.9	173.9	-18.9	30	0	0	0	112.3	W166 P358	W166-P168 HydrophobicContact CE3-CG 4.41Å; W166-P168 HydrophobicContact CH2-CB 3.94Å; W166-P168 HydrophobicContact CH2-CG 4.03Å; W166-P168 HydrophobicContact CZ3-CB 4.11Å; W166-P168 HydrophobicContact CZ3-CG 3.67Å; P168-P358 VanDerWaalsContact CB-CA 3.45Å; P168-P358 HydrophobicContact CB-CB 3.68Å; P168-P358 HydrophobicContact CB-CG 4.5Å
169	T	72.5	Confident	82	Confident	110 Å²	110	77.2 Å²	77.2	68%	0.675	47%	0.47	S	S	*	.			trans	-77.6	125.2	173.5	-53.4	0	0	0	0	110.9	T167 G171	T167-T169 PolarHBondContact O-N 3.45Å; T167-T169 VanDerWaalsContact O-N 3.1Å; T169-G171 PolarHBondContact O-N 3.2Å
170	A	60.9	Low	81.6	Confident	64 Å²	64	79.7 Å²	79.7	53%	0.529	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	127.1	172.3	0	0	0	0	0	110.9
171	G	55.3	Low	81.4	Confident	75 Å²	75	79.6 Å²	79.6	77%	0.773	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	158	-25.8	177.9	0	0	0	0	0	115.5	T169 S173	T169-G171 PolarHBondContact O-N 3.2Å; G171-S173 PolarHBondContact O-N 2.97Å
172	A	55.5	Low	81.1	Confident	59 Å²	59	78.9 Å²	78.9	49%	0.488	47%	0.468	S	S	.	.			trans	-71.1	122.1	175	0	0	0	0	0	111	T174	A172-T174 VanDerWaalsContact C-N 3.29Å
173	S	57.1	Low	80.9	Confident	125 Å²	125	81 Å²	81	87%	0.874	47%	0.467	S	S	*	.			trans	-85.3	1.5	176.6	54.5	0	0	0	0	114	G171	G171-S173 PolarHBondContact O-N 2.97Å
174	T	64.1	Low	80.8	Confident	90 Å²	90	81.2 Å²	81.2	55%	0.552	47%	0.468	S	S	*	.	S	Bend	trans	-72.8	132.3	-178.5	-39	0	0	0	0	110.8	A172 S176 L354	A172-T174 VanDerWaalsContact C-N 3.29Å; T174-S176 PolarHBondContact O-N 3.11Å; T174-L354 HydrophobicContact CG2-CD2 3.63Å
175	P	69.9	Low	80.4	Confident	115 Å²	115	78.6 Å²	78.6	75%	0.747	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-62.8	129.3	174.5	25.6	-33.7	0	0	0	110.6
176	S	79.2	Confident	80.2	Confident	53 Å²	53	82.3 Å²	82.3	37%	0.371	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-74.5	154.1	177	62.5	0	0	0	0	111.5	T174 Y178	T174-S176 PolarHBondContact O-N 3.11Å; S176-Y178 WeakPolarHBondContact CB-O 3.46Å; S176-Y178 PolarHBondContact OG-O 2.78Å
177	R	86.9	Confident	80.3	Confident	135 Å²	135	82.2 Å²	82.2	51%	0.509	47%	0.465	S	S	.	.	S	Bend	trans	-84.3	-19.4	175.8	-63.3	-179.5	-178.5	170.6	3.7	112.4	H315 L354 Y355	R177-H315 PolarHBondContact NH1-CD2 3.43Å; R177-H315 PolarHBondContact NH1-CE1 2.97Å; R177-H315 VanDerWaalsContact NH1-CE1 3.27Å; R177-H315 PolarHBondContact NH1-ND1 2.84Å; R177-H315 PolarHBondContact NH1-NE2 3.08Å; R177-H315 PolarHBondContact NH2-CE1 3.39Å; R177-H315 VanDerWaalsContact NH2-CE1 3.26Å; R177-H315 PolarHBondContact NH2-NE2 3.26Å; R177-L354 PolarHBondContact N-O 3.5Å; R177-Y355 PolarHBondContact NH1-OH 3.04Å
178	Y	91.6	Very high	80.9	Confident	50 Å²	50	78.5 Å²	78.5	20%	0.196	44%	0.442	C	S	.	.	S	Bend	trans	-131.6	159.1	180	-57.2	-108.1	0	0	0	109.3	S176 R322 E323 Y355 P357	S176-Y178 WeakPolarHBondContact CB-O 3.46Å; S176-Y178 PolarHBondContact OG-O 2.78Å; Y178-R322 HydrophobicContact CD1-CG 3.61Å; Y178-R322 HydrophobicContact CD2-CG 4.24Å; Y178-R322 HydrophobicContact CE1-CG 3.78Å; Y178-R322 HydrophobicContact CE2-CG 4.43Å; Y178-R322 HydrophobicContact CG-CG 3.87Å; Y178-E323 HydrophobicContact CE1-CG 3.96Å; Y178-E323 PolarHBondContact OH-OE1 3.03Å; Y178-Y355 AromaticContact CD2-CD1 3.81Å; Y178-Y355 HydrophobicContact CD2-CD1 3.81Å; Y178-Y355 HydrophobicContact CD2-CE1 4.43Å; Y178-Y355 HydrophobicContact CD2-CG 4.39Å; Y178-Y355 AromaticContact CE2-CD1 3.26Å; Y178-Y355 HydrophobicContact CE2-CD1 3.26Å; Y178-Y355 AromaticContact CE2-CE1 3.55Å; Y178-Y355 HydrophobicContact CE2-CE1 3.55Å; Y178-Y355 HydrophobicContact CE2-CG 4.23Å; Y178-P357 WeakPolarHBondContact O-CG 3.4Å
179	L	91.1	Very high	82.1	Confident	147 Å²	147	77.1 Å²	77.1	77%	0.77	43%	0.433	S	S	*	.			trans	-77.8	156.3	170	-61.2	176.5	0	0	0	110.7	R322	L179-R322 PolarHBondContact O-NH1 2.78Å; L179-R322 PolarHBondContact O-NH2 3.49Å
180	R	91	Very high	83.3	Confident	79 Å²	79	72.7 Å²	72.7	30%	0.298	41%	0.406	S	S	.	.			trans	-59.4	140.2	170.2	-177.6	-176.7	179.1	-161.1	22.1	109.5	E182 D185 P357 E359	R180-E182 HydrophobicContact CG-CG 4.44Å; R180-E182 IonicContact CZ-OE1 3.97Å; R180-E182 IonicContact NH1-OE1 2.75Å; R180-E182 PolarHBondContact NH1-OE1 3.36Å; R180-D185 IonicContact CZ-OD2 3.36Å; R180-D185 VanDerWaalsContact CZ-OD2 3.31Å; R180-D185 IonicContact NE-OD1 3.69Å; R180-D185 IonicContact NE-OD2 2.75Å; R180-D185 PolarHBondContact NE-OD2 3.18Å; R180-D185 VanDerWaalsContact NE-OD2 3.1Å; R180-D185 IonicContact NH2-OD2 3.61Å; R180-D185 PolarHBondContact NH2-OD2 2.91Å; R180-P357 HydrophobicContact CB-CG 4.22Å; R180-E359 IonicContact CZ-OE2 2.76Å; R180-E359 IonicContact NH1-OE2 3.84Å; R180-E359 PolarHBondContact NH1-OE2 2.96Å; R180-E359 IonicContact NH2-OE2 3.69Å
181	N	92.3	Very high	85.1	Confident	37 Å²	37	71.9 Å²	71.9	20%	0.198	39%	0.389	C	S	.	.			trans	-132.1	101.8	169.4	176.8	-1.9	0	0	0	107.2	R183 L184 D326	N181-R183 PolarHBondContact O-N 3.01Å; N181-R183 WeakPolarHBondContact OD1-CB 3.34Å; N181-R183 WeakPolarHBondContact OD1-CG 3.29Å; N181-R183 PolarHBondContact OD1-N 3.49Å; N181-L184 HydrophobicContact CB-CD1 4.01Å; N181-L184 HydrophobicContact CB-CG 3.94Å; N181-L184 VanDerWaalsContact O-CB 3.29Å; N181-L184 WeakPolarHBondContact O-CB 3.46Å; N181-L184 PolarHBondContact O-N 3.32Å; N181-D326 PolarHBondContact ND2-OD1 2.93Å
182	E	91.5	Very high	87.1	Confident	132 Å²	132	70.8 Å²	70.8	62%	0.617	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-57.2	-24.1	-172.4	-71.8	166.3	-176.3	0	0	113.6	R180 L184 D185	R180-E182 HydrophobicContact CG-CG 4.44Å; R180-E182 IonicContact CZ-OE1 3.97Å; R180-E182 IonicContact NH1-OE1 2.75Å; R180-E182 PolarHBondContact NH1-OE1 3.36Å; E182-L184 PolarHBondContact O-N 3.35Å; E182-L184 VanDerWaalsContact O-N 3.16Å; E182-D185 WeakPolarHBondContact CA-OD1 3.43Å; E182-D185 WeakPolarHBondContact O-CB 3.45Å; E182-D185 PolarHBondContact O-N 3.16Å
183	R	94.8	Very high	89.1	Confident	163 Å²	163	69.1 Å²	69.1	62%	0.615	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-66.6	-13.3	175	-50.1	-173.7	-169.9	-179.6	3.8	112.9	N181 K187 H329	N181-R183 PolarHBondContact O-N 3.01Å; N181-R183 WeakPolarHBondContact OD1-CB 3.34Å; N181-R183 WeakPolarHBondContact OD1-CG 3.29Å; N181-R183 PolarHBondContact OD1-N 3.49Å; R183-K187 WeakPolarHBondContact O-CE 3.42Å; R183-K187 VanDerWaalsContact O-CG 3.3Å; R183-K187 WeakPolarHBondContact O-CG 3.32Å; R183-H329 WeakPolarHBondContact CD-NE2 3.23Å; R183-H329 PolarHBondContact NH1-CE1 3.06Å; R183-H329 PolarHBondContact NH1-NE2 2.96Å
184	L	95.3	Very high	91.1	Very high	5 Å²	5	65.9 Å²	65.9	3%	0.026	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-101.1	-13.1	-179.8	-48.9	-169.5	0	0	0	113.1	N181 E182 Q186 K187 L325 H329 F356	N181-L184 HydrophobicContact CB-CD1 4.01Å; N181-L184 HydrophobicContact CB-CG 3.94Å; N181-L184 VanDerWaalsContact O-CB 3.29Å; N181-L184 WeakPolarHBondContact O-CB 3.46Å; N181-L184 PolarHBondContact O-N 3.32Å; E182-L184 PolarHBondContact O-N 3.35Å; E182-L184 VanDerWaalsContact O-N 3.16Å; L184-Q186 PolarHBondContact O-N 3.41Å; L184-K187 HydrophobicContact CD2-CG 4.4Å; L184-K187 WeakPolarHBondContact O-CB 3.47Å; L184-K187 PolarHBondContact O-N 3.28Å; L184-L325 HydrophobicContact CD1-CB 4.19Å; L184-L325 HydrophobicContact CD2-CB 3.79Å; L184-H329 HydrophobicContact CD2-CB 3.63Å; L184-F356 HydrophobicContact CB-CD1 4.14Å; L184-F356 HydrophobicContact CB-CE1 4.33Å; L184-F356 HydrophobicContact CD1-CD1 4.16Å; L184-F356 HydrophobicContact CD1-CE1 3.91Å
185	D	88.9	Confident	92.7	Very high	33 Å²	33	62 Å²	62	18%	0.176	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-14.7	-172.3	-73.9	17.9	0	0	0	114	R180 E182	R180-D185 IonicContact CZ-OD2 3.36Å; R180-D185 VanDerWaalsContact CZ-OD2 3.31Å; R180-D185 IonicContact NE-OD1 3.69Å; R180-D185 IonicContact NE-OD2 2.75Å; R180-D185 PolarHBondContact NE-OD2 3.18Å; R180-D185 VanDerWaalsContact NE-OD2 3.1Å; R180-D185 IonicContact NH2-OD2 3.61Å; R180-D185 PolarHBondContact NH2-OD2 2.91Å; E182-D185 WeakPolarHBondContact CA-OD1 3.43Å; E182-D185 WeakPolarHBondContact O-CB 3.45Å; E182-D185 PolarHBondContact O-N 3.16Å
186	Q	92.2	Very high	94.1	Very high	114 Å²	114	56.8 Å²	56.8	53%	0.533	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.8	5.7	175.8	-59.9	-64.8	-74.1	0	0	113.9	L184 R334	L184-Q186 PolarHBondContact O-N 3.41Å; Q186-R334 PolarHBondContact O-NE 3.44Å
187	K	97.1	Very high	95	Very high	33 Å²	33	57.1 Å²	57.1	14%	0.143	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-10.8	-172.6	-59.5	-64.4	-174.7	170.7	0	114	R183 L184 L325 H329 L332 D333 R334 V335	R183-K187 WeakPolarHBondContact O-CE 3.42Å; R183-K187 VanDerWaalsContact O-CG 3.3Å; R183-K187 WeakPolarHBondContact O-CG 3.32Å; L184-K187 HydrophobicContact CD2-CG 4.4Å; L184-K187 WeakPolarHBondContact O-CB 3.47Å; L184-K187 PolarHBondContact O-N 3.28Å; K187-L325 HydrophobicContact CB-CD1 4.27Å; K187-H329 VanDerWaalsContact CE-O 3.23Å; K187-H329 WeakPolarHBondContact CE-O 3.29Å; K187-H329 PolarHBondContact NZ-O 3.21Å; K187-L332 WeakPolarHBondContact CD-O 3.18Å; K187-L332 WeakPolarHBondContact CE-O 3.14Å; K187-L332 PolarHBondContact NZ-O 2.93Å; K187-D333 WeakPolarHBondContact CD-O 3.27Å; K187-D333 IonicContact NZ-OD1 2.69Å; K187-R334 CarbonylContact O-C 3.55Å; K187-R334 WeakPolarHBondContact O-CA 3.18Å; K187-V335 PolarHBondContact O-N 3.15Å
188	I	98.2	Very high	95.6	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.005	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	141.5	-175.2	-56.9	-59.8	0	0	0	111.5	W166 V321 L325 V335 F337 L352 F356	W166-I188 HydrophobicContact CB-CG2 4.39Å; W166-I188 PolarHBondContact N-O 2.76Å; I188-V321 HydrophobicContact CD1-CG1 3.93Å; I188-L325 HydrophobicContact CD1-CD1 3.63Å; I188-V335 WeakPolarHBondContact CA-O 3.26Å; I188-V335 HydrophobicContact CD1-CB 4.31Å; I188-F337 HydrophobicContact CD1-CE2 4.39Å; I188-F337 HydrophobicContact CG2-CD2 4.14Å; I188-F337 HydrophobicContact CG2-CE2 3.99Å; I188-L352 HydrophobicContact CG2-CD2 3.82Å; I188-F356 HydrophobicContact CD1-CD1 4.48Å; I188-F356 HydrophobicContact CD1-CE1 3.78Å; I188-F356 HydrophobicContact CD1-CE2 4.19Å; I188-F356 HydrophobicContact CD1-CZ 3.62Å; I188-F356 HydrophobicContact CG1-CD1 3.87Å; I188-F356 HydrophobicContact CG1-CD2 4.37Å; I188-F356 HydrophobicContact CG1-CE1 3.67Å; I188-F356 HydrophobicContact CG1-CE2 4.21Å; I188-F356 HydrophobicContact CG1-CG 4.22Å; I188-F356 HydrophobicContact CG1-CZ 3.86Å
189	S	98.6	Very high	95.9	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	148.9	167	-74.9	0	0	0	0	110.8	P164 R334 V335 I336 F337	P164-S189 VanDerWaalsContact O-CB 3.27Å; P164-S189 WeakPolarHBondContact O-CB 3.34Å; P164-S189 PolarHBondContact O-OG 2.85Å; S189-R334 WeakPolarHBondContact OG-CD 3.4Å; S189-R334 PolarHBondContact OG-NH1 3.41Å; S189-V335 PolarHBondContact N-O 3.23Å; S189-I336 WeakPolarHBondContact O-CA 3.49Å; S189-F337 PolarHBondContact O-N 2.96Å
190	V	98.4	Very high	96.3	Very high	16 Å²	16	42.6 Å²	42.6	10%	0.097	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	114	162.9	-177.8	0	0	0	0	107.9	V339 K345 L349 L352	V190-V339 HydrophobicContact CG1-CG2 4.17Å; V190-K345 HydrophobicContact CG1-CG 4.11Å; V190-L349 HydrophobicContact CB-CD2 4.4Å; V190-L349 HydrophobicContact CG2-CD2 4.21Å; V190-L352 HydrophobicContact CG2-CD1 3.33Å
191	Y	98.4	Very high	96.7	Very high	48 Å²	48	39.8 Å²	39.8	19%	0.188	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	140	178.4	179.7	-94.8	0	0	0	109.8	V158 I163 L198 F337 C338 V339	V158-Y191 HydrophobicContact CG1-CE2 4.29Å; I163-Y191 HydrophobicContact CG1-CD2 4.37Å; I163-Y191 HydrophobicContact CG2-CD2 4.31Å; Y191-L198 HydrophobicContact CD1-CD2 3.96Å; Y191-L198 HydrophobicContact CE1-CD2 3.78Å; Y191-L198 HydrophobicContact CG-CD2 4.42Å; Y191-F337 PolarHBondContact N-O 3.02Å; Y191-C338 CarbonylContact O-C 3.47Å; Y191-C338 WeakPolarHBondContact O-CA 3.42Å; Y191-V339 VanDerWaalsContact O-CG2 3.29Å; Y191-V339 WeakPolarHBondContact O-CG2 3.18Å; Y191-V339 PolarHBondContact O-N 3.05Å
192	S	98.1	Very high	97	Very high	51 Å²	51	38 Å²	38	36%	0.357	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	108	-179.6	-50.6	0	0	0	0	110	V339 K345	S192-V339 WeakPolarHBondContact CA-O 3.18Å; S192-K345 WeakPolarHBondContact OG-CD 3.43Å; S192-K345 VanDerWaalsContact OG-CE 3.22Å; S192-K345 WeakPolarHBondContact OG-CE 3.47Å; S192-K345 PolarHBondContact OG-NZ 3.31Å; S192-K345 VanDerWaalsContact OG-NZ 3.12Å
193	G	97.3	Very high	97.3	Very high	24 Å²	24	31.8 Å²	31.8	25%	0.247	16%	0.156	C	C	.	.	S	Bend	trans	160.3	-153.6	-177.9	0	0	0	0	0	114.8	V339	G193-V339 PolarHBondContact N-O 3.1Å; G193-V339 VanDerWaalsContact N-O 3.08Å
194	D	98.1	Very high	97.5	Very high	58 Å²	58	24 Å²	24	31%	0.31	13%	0.127	S	C	.	.			trans	-90.3	108.8	-175.3	-179.4	-2.5	0	0	0	111.1	T196 K197	D194-T196 PolarHBondContact O-N 3.32Å; D194-T196 VanDerWaalsContact O-N 3.11Å; D194-T196 WeakPolarHBondContact OD1-CB 3.28Å; D194-T196 WeakPolarHBondContact OD1-CG2 3.18Å; D194-T196 PolarHBondContact OD1-N 3.27Å; D194-T196 PolarHBondContact OD1-OG1 3.28Å; D194-T196 PolarHBondContact OD2-OG1 3.47Å; D194-K197 HydrophobicContact CB-CD 4.16Å; D194-K197 HydrophobicContact CB-CG 4.16Å; D194-K197 PolarHBondContact O-N 2.97Å; D194-K197 VanDerWaalsContact O-N 3.14Å; D194-K197 WeakPolarHBondContact OD2-CE 3.16Å
195	I	98.8	Very high	97.7	Very high	8 Å²	8	23.8 Å²	23.8	4%	0.041	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-58.6	-25	-179.4	-159.4	172.4	0	0	0	112.8	K197 L198 I203 V217 I221 A297 P299 C338	I195-K197 PolarHBondContact O-N 3.26Å; I195-K197 VanDerWaalsContact O-N 3.11Å; I195-L198 HydrophobicContact CG1-CD1 4.12Å; I195-L198 PolarHBondContact O-N 3.01Å; I195-I203 HydrophobicContact CD1-CB 4.16Å; I195-I203 HydrophobicContact CD1-CG2 4.48Å; I195-I203 HydrophobicContact CG1-CB 4.04Å; I195-I203 HydrophobicContact CG1-CG2 3.91Å; I195-V217 HydrophobicContact CG2-CG2 3.59Å; I195-I221 HydrophobicContact CG2-CD1 4.3Å; I195-I221 HydrophobicContact CG2-CG1 4.38Å; I195-A297 HydrophobicContact CD1-CB 4.16Å; I195-A297 HydrophobicContact CG1-CB 4.21Å; I195-P299 HydrophobicContact CD1-CB 4.24Å; I195-P299 HydrophobicContact CD1-CG 4.35Å; I195-C338 HydrophobicContact CB-CB 4.31Å; I195-C338 VanDerWaalsContact CB-SG 3.54Å; I195-C338 HydrophobicContact CD1-CB 4.02Å; I195-C338 HydrophobicContact CG1-CB 3.98Å
196	T	98.8	Very high	98.2	Very high	6 Å²	6	23.4 Å²	23.4	4%	0.037	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-69.8	-7.8	-178.9	70.4	0	0	0	0	113.5	D194 A220 I221 A224 L252 P253	D194-T196 PolarHBondContact O-N 3.32Å; D194-T196 VanDerWaalsContact O-N 3.11Å; D194-T196 WeakPolarHBondContact OD1-CB 3.28Å; D194-T196 WeakPolarHBondContact OD1-CG2 3.18Å; D194-T196 PolarHBondContact OD1-N 3.27Å; D194-T196 PolarHBondContact OD1-OG1 3.28Å; D194-T196 PolarHBondContact OD2-OG1 3.47Å; T196-A220 HydrophobicContact CG2-CB 4.06Å; T196-I221 HydrophobicContact CG2-CG1 3.93Å; T196-A224 HydrophobicContact CG2-CB 3.97Å; T196-L252 HydrophobicContact CG2-CD2 4.27Å; T196-L252 WeakPolarHBondContact O-CD2 3.42Å; T196-P253 WeakPolarHBondContact O-CD 3.29Å
197	K	98.6	Very high	98.4	Very high	59 Å²	59	18 Å²	18	26%	0.257	10%	0.102	S	C	.	.	G	3₁₀ helix	trans	-100.3	-8.5	-178.3	-58.7	-170.5	175.1	-142.4	0	114.4	S155 S157 V158 D194 I195 E199	S155-K197 PolarHBondContact O-NZ 2.71Å; S157-K197 CarbonylContact C-O 3.53Å; S157-K197 VanDerWaalsContact CA-O 3.25Å; S157-K197 WeakPolarHBondContact CA-O 3.39Å; V158-K197 PolarHBondContact N-O 3.28Å; D194-K197 HydrophobicContact CB-CD 4.16Å; D194-K197 HydrophobicContact CB-CG 4.16Å; D194-K197 PolarHBondContact O-N 2.97Å; D194-K197 VanDerWaalsContact O-N 3.14Å; D194-K197 WeakPolarHBondContact OD2-CE 3.16Å; I195-K197 PolarHBondContact O-N 3.26Å; I195-K197 VanDerWaalsContact O-N 3.11Å; K197-E199 PolarHBondContact O-N 2.98Å
198	L	98.8	Very high	98.4	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	118	-173	-54.5	-174.9	0	0	0	111.2	V158 I163 Y191 I195 I200 I203 A254 A297 C338	V158-L198 HydrophobicContact CB-CD2 4.17Å; I163-L198 HydrophobicContact CD1-CD2 3.92Å; Y191-L198 HydrophobicContact CD1-CD2 3.96Å; Y191-L198 HydrophobicContact CE1-CD2 3.78Å; Y191-L198 HydrophobicContact CG-CD2 4.42Å; I195-L198 HydrophobicContact CG1-CD1 4.12Å; I195-L198 PolarHBondContact O-N 3.01Å; L198-I200 VanDerWaalsContact C-N 3.33Å; L198-I200 HydrophobicContact CB-CD1 4.06Å; L198-I200 HydrophobicContact CB-CG1 4.07Å; L198-I200 HydrophobicContact CB-CG2 4.31Å; L198-I200 HydrophobicContact CD1-CD1 4.36Å; L198-I200 PolarHBondContact O-N 2.67Å; L198-I200 VanDerWaalsContact O-N 3.12Å; L198-I203 HydrophobicContact CB-CG2 4.4Å; L198-A254 PolarHBondContact O-N 3.02Å; L198-A297 HydrophobicContact CD1-CB 3.54Å; L198-C338 HydrophobicContact CD1-CB 4.29Å
199	E	98.7	Very high	98.4	Very high	21 Å²	21	22.8 Å²	22.8	10%	0.098	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	78	176.4	-171.2	-174.3	-104.2	0	0	109.3	V145 R149 Y152 V158 K197 P253	V145-E199 HydrophobicContact CG1-CG 4.12Å; R149-E199 WeakPolarHBondContact CG-OE1 3.39Å; R149-E199 IonicContact CZ-OE1 2.87Å; R149-E199 IonicContact CZ-OE2 3.31Å; R149-E199 IonicContact NE-OE1 2.97Å; R149-E199 PolarHBondContact NE-OE1 2.91Å; R149-E199 IonicContact NE-OE2 3.75Å; R149-E199 IonicContact NH2-OE1 2.72Å; R149-E199 PolarHBondContact NH2-OE1 2.75Å; R149-E199 IonicContact NH2-OE2 3.27Å; R149-E199 PolarHBondContact NH2-OE2 3.09Å; Y152-E199 HydrophobicContact CE2-CG 4.36Å; Y152-E199 WeakPolarHBondContact CE2-OE1 3.31Å; Y152-E199 PolarHBondContact OH-OE1 3.15Å; V158-E199 PolarHBondContact O-N 2.46Å; K197-E199 PolarHBondContact O-N 2.98Å; E199-P253 HydrophobicContact CB-CB 3.85Å; E199-P253 HydrophobicContact CG-CB 4.29Å
200	I	98.7	Very high	98.3	Very high	6 Å²	6	25.1 Å²	25.1	3%	0.031	14%	0.14	C	C	.	.	S	Bend	trans	-132.4	-175.8	-176.3	63.5	175.3	0	0	0	110.5	L160 I163 L198 A202 I203 A254 K255 A297 I336	L160-I200 HydrophobicContact CB-CG2 4.22Å; L160-I200 HydrophobicContact CD1-CG2 4.06Å; I163-I200 HydrophobicContact CD1-CG2 4.41Å; L198-I200 VanDerWaalsContact C-N 3.33Å; L198-I200 HydrophobicContact CB-CD1 4.06Å; L198-I200 HydrophobicContact CB-CG1 4.07Å; L198-I200 HydrophobicContact CB-CG2 4.31Å; L198-I200 HydrophobicContact CD1-CD1 4.36Å; L198-I200 PolarHBondContact O-N 2.67Å; L198-I200 VanDerWaalsContact O-N 3.12Å; I200-A202 VanDerWaalsContact CD1-O 3.25Å; I200-A202 WeakPolarHBondContact CD1-O 3.27Å; I200-I203 HydrophobicContact CD1-CG2 3.9Å; I200-I203 HydrophobicContact CG1-CG2 4.14Å; I200-A254 VanDerWaalsContact O-CA 3.29Å; I200-A254 WeakPolarHBondContact O-CA 3.33Å; I200-K255 PolarHBondContact O-N 3.14Å; I200-K255 VanDerWaalsContact O-N 3.16Å; I200-A297 HydrophobicContact CD1-CB 3.44Å; I200-A297 VanDerWaalsContact CD1-CB 3.44Å; I200-I336 HydrophobicContact CD1-CD1 4.2Å; I200-I336 HydrophobicContact CG2-CD1 4.12Å
201	D	98.8	Very high	98.2	Very high	21 Å²	21	24.3 Å²	24.3	11%	0.112	14%	0.136	C	C	.	.	S	Bend	trans	-73	-53.5	177	-58.2	-60.2	0	0	0	111.9	K255 Y256 A293 R294 S295	D201-K255 CarbonylContact O-C 3.47Å; D201-K255 WeakPolarHBondContact O-CA 3.42Å; D201-K255 WeakPolarHBondContact O-CB 3.31Å; D201-K255 PolarHBondContact O-N 2.76Å; D201-K255 WeakPolarHBondContact OD1-CD 3.43Å; D201-K255 VanDerWaalsContact OD1-CE 3.3Å; D201-K255 WeakPolarHBondContact OD1-CE 3.43Å; D201-K255 IonicContact OD1-NZ 2.96Å; D201-K255 PolarHBondContact OD1-NZ 3.44Å; D201-Y256 PolarHBondContact O-N 2.88Å; D201-A293 HydrophobicContact CB-CB 3.53Å; D201-R294 WeakPolarHBondContact OD2-CA 3.33Å; D201-R294 PolarHBondContact OD2-N 2.84Å; D201-S295 WeakPolarHBondContact CB-O 3.47Å; D201-S295 VanDerWaalsContact CG-OG 3.27Å; D201-S295 PolarHBondContact N-O 2.84Å; D201-S295 PolarHBondContact N-OG 3.11Å; D201-S295 PolarHBondContact OD2-N 2.72Å; D201-S295 PolarHBondContact OD2-OG 2.9Å
202	A	98.9	Very high	98.1	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	133.5	-176.2	0	0	0	0	0	113.2	I200 Y256 I258 A293 S295 V296 A297	I200-A202 VanDerWaalsContact CD1-O 3.25Å; I200-A202 WeakPolarHBondContact CD1-O 3.27Å; A202-Y256 WeakPolarHBondContact CA-O 3.49Å; A202-I258 HydrophobicContact CB-CD1 3.73Å; A202-I258 HydrophobicContact CB-CG1 4.18Å; A202-A293 HydrophobicContact CB-CB 4.2Å; A202-S295 PolarHBondContact N-O 3.34Å; A202-V296 VanDerWaalsContact O-CA 3.31Å; A202-V296 WeakPolarHBondContact O-CA 3.39Å; A202-A297 PolarHBondContact O-N 3.22Å
203	I	98.9	Very high	97.9	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	144.1	161.3	63.2	169.9	0	0	0	109.7	I195 L198 I200 I221 L252 A254 Y256 V257 I258 A297	I195-I203 HydrophobicContact CD1-CB 4.16Å; I195-I203 HydrophobicContact CD1-CG2 4.48Å; I195-I203 HydrophobicContact CG1-CB 4.04Å; I195-I203 HydrophobicContact CG1-CG2 3.91Å; L198-I203 HydrophobicContact CB-CG2 4.4Å; I200-I203 HydrophobicContact CD1-CG2 3.9Å; I200-I203 HydrophobicContact CG1-CG2 4.14Å; I203-I221 HydrophobicContact CD1-CD1 4.03Å; I203-I221 HydrophobicContact CD1-CG1 3.94Å; I203-L252 HydrophobicContact CD1-CD1 3.82Å; I203-L252 HydrophobicContact CD1-CD2 4.16Å; I203-L252 HydrophobicContact CG1-CD1 4.47Å; I203-A254 HydrophobicContact CB-CB 4.43Å; I203-A254 HydrophobicContact CG1-CB 4.06Å; I203-A254 HydrophobicContact CG2-CB 3.86Å; I203-Y256 PolarHBondContact N-O 3.12Å; I203-Y256 VanDerWaalsContact N-O 3.15Å; I203-V257 HydrophobicContact CD1-CG2 4.37Å; I203-V257 HydrophobicContact CG1-CG2 4.02Å; I203-V257 WeakPolarHBondContact O-CA 3.38Å; I203-I258 PolarHBondContact O-N 2.85Å; I203-A297 HydrophobicContact CG2-CB 4.35Å
204	V	98.9	Very high	97.8	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	132	177.5	179.3	0	0	0	0	109.7	I258 T260 V296 A297 F298 P299 I301	V204-I258 CarbonylContact C-O 3.57Å; V204-I258 VanDerWaalsContact CA-O 3.26Å; V204-I258 WeakPolarHBondContact CA-O 3.3Å; V204-I258 HydrophobicContact CG2-CB 4.31Å; V204-T260 HydrophobicContact CG1-CG2 3.61Å; V204-V296 HydrophobicContact CG2-CG1 3.84Å; V204-A297 WeakPolarHBondContact CB-O 3.25Å; V204-A297 WeakPolarHBondContact CG2-O 3.39Å; V204-A297 PolarHBondContact N-O 3.15Å; V204-F298 HydrophobicContact CB-CD1 3.93Å; V204-F298 HydrophobicContact CB-CE1 4.14Å; V204-F298 HydrophobicContact CB-CG 4.44Å; V204-F298 HydrophobicContact CG1-CD1 3.93Å; V204-F298 HydrophobicContact CG1-CE1 3.99Å; V204-F298 HydrophobicContact CG2-CD1 3.81Å; V204-F298 HydrophobicContact CG2-CD2 4.44Å; V204-F298 HydrophobicContact CG2-CE1 3.62Å; V204-F298 HydrophobicContact CG2-CE2 4.26Å; V204-F298 HydrophobicContact CG2-CG 4.23Å; V204-F298 HydrophobicContact CG2-CZ 3.85Å; V204-P299 WeakPolarHBondContact O-CD 3.32Å; V204-P299 WeakPolarHBondContact O-CG 3.45Å; V204-I301 HydrophobicContact CG1-CD1 4.21Å
205	N	98.9	Very high	97.6	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	123.2	172.7	-176.8	10.1	0	0	0	109.5	A207 D218 I221 V257 I258 H259 T260	N205-A207 PolarHBondContact O-N 3.47Å; N205-D218 PolarHBondContact ND2-OD1 3.47Å; N205-D218 WeakPolarHBondContact OD1-CA 3.49Å; N205-D218 WeakPolarHBondContact OD1-CB 3.45Å; N205-I221 HydrophobicContact CB-CD1 3.71Å; N205-V257 HydrophobicContact CB-CG1 3.7Å; N205-I258 PolarHBondContact N-O 3.33Å; N205-H259 HydrophobicContact CB-CB 4.46Å; N205-H259 PolarHBondContact ND2-ND1 2.75Å; N205-T260 PolarHBondContact O-N 2.94Å; N205-T260 VanDerWaalsContact O-O 3.14Å
206	A	98.3	Very high	97.5	Very high	25 Å²	25	27.3 Å²	27.3	21%	0.207	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	74.4	167.4	0	0	0	0	0	109.2	V217 P299 I301	A206-V217 HydrophobicContact CB-CG1 3.93Å; A206-P299 HydrophobicContact CB-CG 4.16Å; A206-I301 HydrophobicContact CB-CG1 4.19Å
207	A	97.6	Very high	97.4	Very high	1 Å²	1	29 Å²	29	1%	0.008	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	168.5	-168.8	0	0	0	0	0	112.7	N205 L211 H259 T260	N205-A207 PolarHBondContact O-N 3.47Å; A207-L211 HydrophobicContact CB-CD2 3.85Å; A207-H259 HydrophobicContact CB-CB 4.01Å; A207-T260 PolarHBondContact N-O 3.15Å
208	N	97.1	Very high	97.4	Very high	37 Å²	37	26.6 Å²	26.6	20%	0.198	19%	0.188	C	C	.	.			trans	-98.7	162.3	168.6	73.2	88.4	0	0	0	111.3	S210 L211 G213 D218 Y306	N208-S210 PolarHBondContact O-N 2.86Å; N208-S210 WeakPolarHBondContact OD1-CB 3.45Å; N208-S210 PolarHBondContact OD1-N 2.66Å; N208-S210 VanDerWaalsContact OD1-N 3.14Å; N208-S210 PolarHBondContact OD1-OG 2.97Å; N208-L211 PolarHBondContact O-N 3.43Å; N208-G213 PolarHBondContact ND2-O 2.86Å; N208-D218 PolarHBondContact ND2-OD2 3.02Å; N208-Y306 WeakPolarHBondContact CA-OH 3.44Å; N208-Y306 WeakPolarHBondContact CB-OH 3.48Å
209	K	97.3	Very high	97.4	Very high	98 Å²	98	26.8 Å²	26.8	43%	0.426	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.6	-26.7	-176.1	-78.8	-157	166.4	-156.6	0	116.2	G238 C239 E240 T241 V261	K209-G238 CarbonylContact O-C 3.54Å; K209-G238 WeakPolarHBondContact O-CA 3.24Å; K209-C239 WeakPolarHBondContact CA-O 3.41Å; K209-C239 WeakPolarHBondContact CG-O 3.3Å; K209-C239 PolarHBondContact O-N 3.34Å; K209-E240 WeakPolarHBondContact CE-OE2 3.48Å; K209-E240 IonicContact NZ-OE1 2.68Å; K209-E240 PolarHBondContact NZ-OE1 3Å; K209-E240 IonicContact NZ-OE2 2.85Å; K209-E240 PolarHBondContact NZ-OE2 3.36Å; K209-T241 WeakPolarHBondContact CE-OG1 3.4Å; K209-V261 HydrophobicContact CG-CG1 3.93Å
210	S	96.9	Very high	97.4	Very high	48 Å²	48	27 Å²	27	34%	0.336	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-23.6	179.7	74	0	0	0	0	114.2	N208 L212	N208-S210 PolarHBondContact O-N 2.86Å; N208-S210 WeakPolarHBondContact OD1-CB 3.45Å; N208-S210 PolarHBondContact OD1-N 2.66Å; N208-S210 VanDerWaalsContact OD1-N 3.14Å; N208-S210 PolarHBondContact OD1-OG 2.97Å; S210-L212 WeakPolarHBondContact O-CG 3.27Å; S210-L212 PolarHBondContact O-N 2.97Å; S210-L212 PolarHBondContact OG-N 2.88Å; S210-L212 VanDerWaalsContact OG-N 3.08Å
211	L	97.2	Very high	97.4	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	19%	0.193	C	C	.	.			trans	58	7.2	-164.2	-54.4	-174.6	0	0	0	115.6	A207 N208 G213 C233 L236 C239 K245 H259 V261	A207-L211 HydrophobicContact CB-CD2 3.85Å; N208-L211 PolarHBondContact O-N 3.43Å; L211-G213 PolarHBondContact O-N 2.85Å; L211-C233 HydrophobicContact CB-CB 3.93Å; L211-C233 WeakPolarHBondContact O-CB 3.35Å; L211-C233 PolarHBondContact O-SG 3.21Å; L211-C233 VanDerWaalsContact O-SG 3.32Å; L211-L236 HydrophobicContact CD1-CB 3.96Å; L211-L236 HydrophobicContact CD1-CD1 3.83Å; L211-C239 HydrophobicContact CD1-CB 4.05Å; L211-C239 HydrophobicContact CD2-CB 3.77Å; L211-C239 HydrophobicContact CG-CB 4Å; L211-K245 HydrophobicContact CD1-CD 4.32Å; L211-H259 HydrophobicContact CD2-CB 3.59Å; L211-V261 HydrophobicContact CD2-CG2 4.47Å
212	L	96.1	Very high	97.4	Very high	72 Å²	72	26.8 Å²	26.8	38%	0.377	19%	0.193	S	C	.	.	S	Bend	trans	-87.3	19.2	-173.6	-60.5	-174.7	0	0	0	114.5	S210 K230 A234	S210-L212 WeakPolarHBondContact O-CG 3.27Å; S210-L212 PolarHBondContact O-N 2.97Å; S210-L212 PolarHBondContact OG-N 2.88Å; S210-L212 VanDerWaalsContact OG-N 3.08Å; L212-K230 HydrophobicContact CD2-CG 4.48Å; L212-K230 VanDerWaalsContact O-CE 3.3Å; L212-K230 WeakPolarHBondContact O-CE 3.27Å; L212-K230 PolarHBondContact O-NZ 2.66Å; L212-A234 HydrophobicContact CD2-CB 4.04Å
213	G	93.6	Very high	97.3	Very high	17 Å²	17	35.2 Å²	35.2	18%	0.175	23%	0.225	C	C	.	.			trans	82.3	176.3	-173.5	0	0	0	0	0	114.2	N208 L211 D218 H222	N208-G213 PolarHBondContact ND2-O 2.86Å; L211-G213 PolarHBondContact O-N 2.85Å; G213-D218 VanDerWaalsContact C-OD2 3.25Å; G213-D218 WeakPolarHBondContact CA-OD1 3.48Å; G213-H222 VanDerWaalsContact CA-CD2 3.46Å; G213-H222 WeakPolarHBondContact CA-CD2 3.46Å
214	G	94.1	Very high	97.3	Very high	44 Å²	44	35.8 Å²	35.8	45%	0.454	23%	0.229	S	C	.	.			trans	-172	-149.8	-175.9	0	0	0	0	0	113.8	D218 G219	G214-D218 PolarHBondContact N-OD2 3.46Å; G214-G219 WeakPolarHBondContact O-CA 3.36Å; G214-G219 PolarHBondContact O-N 2.87Å
215	G	94.2	Very high	97.3	Very high	51 Å²	51	35.8 Å²	35.8	53%	0.526	23%	0.23	S	C	.	.	S	Bend	trans	-86.1	-171.8	170.9	0	0	0	0	0	112.9	D218 G219	G215-D218 PolarHBondContact O-N 2.84Å; G215-G219 PolarHBondContact O-N 2.91Å
216	G	96.8	Very high	97.1	Very high	67 Å²	67	36.1 Å²	36.1	69%	0.691	23%	0.233	S	C	*	.	H	α-helix	trans	55.1	-137.6	171.7	0	0	0	0	0	114.4	G219 A220	G216-G219 PolarHBondContact O-N 2.65Å; G216-A220 PolarHBondContact O-N 2.73Å; G216-A220 VanDerWaalsContact O-N 3.1Å
217	V	98.3	Very high	96.9	Very high	43 Å²	43	37.1 Å²	37.1	26%	0.261	24%	0.237	S	C	.	.	H	α-helix	trans	-66.8	-37.2	179.7	68.8	0	0	0	0	112.7	I195 A206 G219 A220 I221 P299	I195-V217 HydrophobicContact CG2-CG2 3.59Å; A206-V217 HydrophobicContact CB-CG1 3.93Å; V217-G219 PolarHBondContact O-N 3.32Å; V217-A220 WeakPolarHBondContact O-CB 3.47Å; V217-A220 PolarHBondContact O-N 2.74Å; V217-I221 HydrophobicContact CG2-CD1 3.95Å; V217-I221 HydrophobicContact CG2-CG1 4.32Å; V217-I221 WeakPolarHBondContact O-CB 3.5Å; V217-I221 WeakPolarHBondContact O-CG1 3.17Å; V217-I221 PolarHBondContact O-N 2.71Å; V217-P299 HydrophobicContact CG1-CB 4.42Å; V217-P299 HydrophobicContact CG1-CG 4.45Å; V217-P299 HydrophobicContact CG2-CB 4.29Å
218	D	98.5	Very high	96.9	Very high	8 Å²	8	37.1 Å²	37.1	4%	0.043	24%	0.237	C	C	.	.	H	α-helix	trans	-57.4	-49.4	175.3	-175.1	16.6	0	0	0	110.8	N205 N208 G213 G214 G215 A220 I221 H222	N205-D218 PolarHBondContact ND2-OD1 3.47Å; N205-D218 WeakPolarHBondContact OD1-CA 3.49Å; N205-D218 WeakPolarHBondContact OD1-CB 3.45Å; N208-D218 PolarHBondContact ND2-OD2 3.02Å; G213-D218 VanDerWaalsContact C-OD2 3.25Å; G213-D218 WeakPolarHBondContact CA-OD1 3.48Å; G214-D218 PolarHBondContact N-OD2 3.46Å; G215-D218 PolarHBondContact O-N 2.84Å; D218-A220 VanDerWaalsContact C-N 3.34Å; D218-A220 PolarHBondContact O-N 3.38Å; D218-I221 PolarHBondContact O-N 3.01Å; D218-H222 PolarHBondContact O-CD2 3.11Å; D218-H222 PolarHBondContact O-N 3.38Å; D218-H222 IonicContact OD1-CD2 3.49Å; D218-H222 PolarHBondContact OD1-CD2 3.44Å; D218-H222 IonicContact OD1-NE2 3.92Å
219	G	98.3	Very high	96.9	Very high	4 Å²	4	35.3 Å²	35.3	4%	0.041	23%	0.228	C	C	.	.	H	α-helix	trans	-63.4	-34	172.8	0	0	0	0	0	114.3	G214 G215 G216 V217 R223	G214-G219 WeakPolarHBondContact O-CA 3.36Å; G214-G219 PolarHBondContact O-N 2.87Å; G215-G219 PolarHBondContact O-N 2.91Å; G216-G219 PolarHBondContact O-N 2.65Å; V217-G219 PolarHBondContact O-N 3.32Å; G219-R223 VanDerWaalsContact C-CZ 3.49Å; G219-R223 VanDerWaalsContact C-NH1 3.3Å; G219-R223 WeakPolarHBondContact O-CB 3.23Å; G219-R223 VanDerWaalsContact O-CG 3.3Å; G219-R223 WeakPolarHBondContact O-CG 3.42Å; G219-R223 PolarHBondContact O-N 3.06Å; G219-R223 VanDerWaalsContact O-N 3.15Å; G219-R223 PolarHBondContact O-NE 2.92Å; G219-R223 PolarHBondContact O-NH1 3.32Å
220	A	98.4	Very high	96.8	Very high	25 Å²	25	35.6 Å²	35.6	21%	0.207	23%	0.229	C	C	.	.	H	α-helix	trans	-68.1	-48.3	176.7	0	0	0	0	0	111.4	T196 G216 V217 D218 H222 R223 A224	T196-A220 HydrophobicContact CG2-CB 4.06Å; G216-A220 PolarHBondContact O-N 2.73Å; G216-A220 VanDerWaalsContact O-N 3.1Å; V217-A220 WeakPolarHBondContact O-CB 3.47Å; V217-A220 PolarHBondContact O-N 2.74Å; D218-A220 VanDerWaalsContact C-N 3.34Å; D218-A220 PolarHBondContact O-N 3.38Å; A220-H222 PolarHBondContact O-N 3.44Å; A220-R223 PolarHBondContact O-N 3.18Å; A220-A224 WeakPolarHBondContact O-CB 3.36Å; A220-A224 PolarHBondContact O-N 3.01Å
221	I	98.8	Very high	96.7	Very high	0 Å²	0	36 Å²	36	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-57.3	-49.1	176.7	-72.8	173.5	0	0	0	110.6	I195 T196 I203 N205 V217 D218 R223 A224 A225 L229 L252 V257	I195-I221 HydrophobicContact CG2-CD1 4.3Å; I195-I221 HydrophobicContact CG2-CG1 4.38Å; T196-I221 HydrophobicContact CG2-CG1 3.93Å; I203-I221 HydrophobicContact CD1-CD1 4.03Å; I203-I221 HydrophobicContact CD1-CG1 3.94Å; N205-I221 HydrophobicContact CB-CD1 3.71Å; V217-I221 HydrophobicContact CG2-CD1 3.95Å; V217-I221 HydrophobicContact CG2-CG1 4.32Å; V217-I221 WeakPolarHBondContact O-CB 3.5Å; V217-I221 WeakPolarHBondContact O-CG1 3.17Å; V217-I221 PolarHBondContact O-N 2.71Å; D218-I221 PolarHBondContact O-N 3.01Å; I221-R223 PolarHBondContact O-N 3.47Å; I221-A224 PolarHBondContact O-N 2.98Å; I221-A225 WeakPolarHBondContact O-CB 3.43Å; I221-A225 PolarHBondContact O-N 3.24Å; I221-L229 HydrophobicContact CG2-CD2 3.86Å; I221-L252 HydrophobicContact CG2-CD1 4.29Å; I221-V257 HydrophobicContact CG2-CG1 3.92Å; I221-V257 HydrophobicContact CG2-CG2 4Å
222	H	98.4	Very high	96.8	Very high	23 Å²	23	36.1 Å²	36.1	11%	0.106	23%	0.228	C	C	.	.	H	α-helix	trans	-64.4	-34.9	178.1	-85.8	-86.8	0	0	0	114	G213 D218 A220 G226 H259	G213-H222 VanDerWaalsContact CA-CD2 3.46Å; G213-H222 WeakPolarHBondContact CA-CD2 3.46Å; D218-H222 PolarHBondContact O-CD2 3.11Å; D218-H222 PolarHBondContact O-N 3.38Å; D218-H222 IonicContact OD1-CD2 3.49Å; D218-H222 PolarHBondContact OD1-CD2 3.44Å; D218-H222 IonicContact OD1-NE2 3.92Å; A220-H222 PolarHBondContact O-N 3.44Å; H222-G226 PolarHBondContact O-N 3.32Å; H222-H259 AromaticContact CD2-CE1 3.86Å; H222-H259 AromaticContact CE1-CE1 3.58Å; H222-H259 AromaticContact NE2-CE1 3.05Å; H222-H259 PolarHBondContact NE2-CE1 3.46Å
223	R	97.8	Very high	96.9	Very high	176 Å²	176	32.7 Å²	32.7	66%	0.664	21%	0.21	S	C	*	.	H	α-helix	trans	-70.3	-38.5	174.2	-74	-175.3	-56.8	-89.5	0.8	112.7	G219 A220 I221	G219-R223 VanDerWaalsContact C-CZ 3.49Å; G219-R223 VanDerWaalsContact C-NH1 3.3Å; G219-R223 WeakPolarHBondContact O-CB 3.23Å; G219-R223 VanDerWaalsContact O-CG 3.3Å; G219-R223 WeakPolarHBondContact O-CG 3.42Å; G219-R223 PolarHBondContact O-N 3.06Å; G219-R223 VanDerWaalsContact O-N 3.15Å; G219-R223 PolarHBondContact O-NE 2.92Å; G219-R223 PolarHBondContact O-NH1 3.32Å; A220-R223 PolarHBondContact O-N 3.18Å; I221-R223 PolarHBondContact O-N 3.47Å
224	A	98.1	Very high	97	Very high	12 Å²	12	34.5 Å²	34.5	10%	0.099	22%	0.223	C	C	.	.	H	α-helix	trans	-76.6	-34.9	-178.5	0	0	0	0	0	113	R153 T154 T196 A220 I221 G251 L252	R153-A224 WeakPolarHBondContact CB-O 3.32Å; R153-A224 WeakPolarHBondContact CD-O 3.44Å; T154-A224 HydrophobicContact CG2-CB 3.78Å; T196-A224 HydrophobicContact CG2-CB 3.97Å; A220-A224 WeakPolarHBondContact O-CB 3.36Å; A220-A224 PolarHBondContact O-N 3.01Å; I221-A224 PolarHBondContact O-N 2.98Å; A224-G251 CarbonylContact O-C 3.5Å; A224-L252 HydrophobicContact CB-CD2 3.6Å
225	A	97.9	Very high	97.1	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.008	22%	0.218	C	C	.	.	H	α-helix	trans	-74.1	-36.3	176.1	0	0	0	0	0	113.2	I221 L229 G249 Y250 G251 L252	I221-A225 WeakPolarHBondContact O-CB 3.43Å; I221-A225 PolarHBondContact O-N 3.24Å; A225-L229 HydrophobicContact CB-CB 3.72Å; A225-L229 HydrophobicContact CB-CD2 3.46Å; A225-L229 VanDerWaalsContact CB-CD2 3.46Å; A225-L229 HydrophobicContact CB-CG 4.17Å; A225-G249 WeakPolarHBondContact CB-O 3.26Å; A225-Y250 WeakPolarHBondContact O-CB 3.45Å; A225-G251 PolarHBondContact O-N 2.86Å; A225-L252 HydrophobicContact CB-CD1 3.87Å; A225-L252 HydrophobicContact CB-CG 3.96Å
226	G	95.9	Very high	97.3	Very high	7 Å²	7	34.2 Å²	34.2	7%	0.072	20%	0.203	C	C	.	.			trans	94.9	-178.4	-175.5	0	0	0	0	0	113.8	H222 L228 L229	H222-G226 PolarHBondContact O-N 3.32Å; G226-L228 VanDerWaalsContact C-N 3.32Å; G226-L228 PolarHBondContact O-N 2.8Å; G226-L229 PolarHBondContact O-N 2.93Å
227	P	94.9	Very high	97.3	Very high	45 Å²	45	39.2 Å²	39.2	29%	0.292	21%	0.208	S	C	.	.	H	α-helix	trans	-63.1	-33.6	-168.4	24.2	-34.1	0	0	0	113.7	L126 L229 K230 N231	L126-P227 WeakPolarHBondContact O-CD 3.49Å; L126-P227 WeakPolarHBondContact O-CG 3.49Å; P227-L229 VanDerWaalsContact C-N 3.25Å; P227-L229 PolarHBondContact O-N 2.98Å; P227-K230 WeakPolarHBondContact O-CB 3.34Å; P227-K230 PolarHBondContact O-N 3.06Å; P227-N231 PolarHBondContact O-N 3.41Å
228	L	95.9	Very high	97.2	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-62	-29.2	-176.5	-61.8	179.2	0	0	0	113.5	L126 W133 A136 G226 K230 N231 E232 Y250	L126-L228 HydrophobicContact CD2-CD1 3.84Å; W133-L228 HydrophobicContact CB-CB 4.37Å; W133-L228 HydrophobicContact CB-CD2 4.42Å; A136-L228 HydrophobicContact CB-CD1 3.6Å; G226-L228 VanDerWaalsContact C-N 3.32Å; G226-L228 PolarHBondContact O-N 2.8Å; L228-K230 VanDerWaalsContact C-N 3.29Å; L228-K230 PolarHBondContact O-N 3.19Å; L228-N231 PolarHBondContact O-N 3.32Å; L228-E232 PolarHBondContact O-N 3.44Å; L228-Y250 HydrophobicContact CB-CD1 3.54Å; L228-Y250 HydrophobicContact CB-CD2 4.38Å; L228-Y250 HydrophobicContact CB-CE1 3.6Å; L228-Y250 HydrophobicContact CB-CE2 4.42Å; L228-Y250 HydrophobicContact CB-CG 3.96Å; L228-Y250 HydrophobicContact CD1-CD1 4.01Å; L228-Y250 HydrophobicContact CD1-CE1 4.21Å; L228-Y250 HydrophobicContact CG-CD1 4.43Å
229	L	97.5	Very high	97.2	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-60.7	-40.5	172.2	179.9	60.7	0	0	0	111.5	I221 A225 G226 P227 N231 E232 C233 T247 Y250 V257 H259	I221-L229 HydrophobicContact CG2-CD2 3.86Å; A225-L229 HydrophobicContact CB-CB 3.72Å; A225-L229 HydrophobicContact CB-CD2 3.46Å; A225-L229 VanDerWaalsContact CB-CD2 3.46Å; A225-L229 HydrophobicContact CB-CG 4.17Å; G226-L229 PolarHBondContact O-N 2.93Å; P227-L229 VanDerWaalsContact C-N 3.25Å; P227-L229 PolarHBondContact O-N 2.98Å; L229-N231 VanDerWaalsContact C-N 3.34Å; L229-E232 PolarHBondContact O-N 3.25Å; L229-C233 WeakPolarHBondContact O-CB 3.22Å; L229-C233 PolarHBondContact O-N 3.41Å; L229-C233 PolarHBondContact O-SG 3.14Å; L229-T247 HydrophobicContact CD1-CG2 4.2Å; L229-T247 VanDerWaalsContact CD1-OG1 3.23Å; L229-T247 WeakPolarHBondContact CD1-OG1 3.43Å; L229-Y250 HydrophobicContact CB-CD2 3.82Å; L229-Y250 HydrophobicContact CB-CE2 4.3Å; L229-Y250 HydrophobicContact CD1-CD2 4.28Å; L229-Y250 HydrophobicContact CD1-CE2 4.35Å; L229-V257 HydrophobicContact CD2-CG2 4.41Å; L229-H259 WeakPolarHBondContact CD1-NE2 3.3Å; L229-H259 WeakPolarHBondContact CD2-CE1 3.25Å
230	K	95.8	Very high	97.2	Very high	103 Å²	103	42.7 Å²	42.7	45%	0.448	22%	0.224	S	C	.	.	H	α-helix	trans	-69.8	-34.2	177.6	-169.7	171.8	-179.6	164.7	0	111.7	L212 P227 L228 A234	L212-K230 HydrophobicContact CD2-CG 4.48Å; L212-K230 VanDerWaalsContact O-CE 3.3Å; L212-K230 WeakPolarHBondContact O-CE 3.27Å; L212-K230 PolarHBondContact O-NZ 2.66Å; P227-K230 WeakPolarHBondContact O-CB 3.34Å; P227-K230 PolarHBondContact O-N 3.06Å; L228-K230 VanDerWaalsContact C-N 3.29Å; L228-K230 PolarHBondContact O-N 3.19Å; K230-A234 WeakPolarHBondContact O-CB 3.43Å; K230-A234 PolarHBondContact O-N 2.93Å
231	N	95.3	Very high	97.3	Very high	56 Å²	56	44 Å²	44	30%	0.299	23%	0.23	S	C	.	.	H	α-helix	trans	-66.5	-41.6	175.4	-66.7	3.3	0	0	0	111.6	W133 P227 L228 L229	W133-N231 HydrophobicContact CB-CB 4.3Å; W133-N231 HydrophobicContact CG-CB 4.36Å; P227-N231 PolarHBondContact O-N 3.41Å; L228-N231 PolarHBondContact O-N 3.32Å; L229-N231 VanDerWaalsContact C-N 3.34Å
232	E	97.8	Very high	97.2	Very high	3 Å²	3	44.1 Å²	44.1	1%	0.014	23%	0.231	C	C	.	.	H	α-helix	trans	-65.6	-49	172.9	-173.2	172.7	-161.5	0	0	111.1	W133 K137 L228 L229 A234 S235 L236 T247 C248 Y250	W133-E232 HydrophobicContact CD2-CB 3.76Å; W133-E232 HydrophobicContact CD2-CG 3.96Å; W133-E232 HydrophobicContact CE3-CB 3.78Å; W133-E232 HydrophobicContact CE3-CG 3.57Å; W133-E232 HydrophobicContact CG-CB 4.08Å; W133-E232 HydrophobicContact CH2-CG 3.95Å; W133-E232 HydrophobicContact CZ2-CG 4.3Å; W133-E232 HydrophobicContact CZ3-CB 4.3Å; W133-E232 HydrophobicContact CZ3-CG 3.57Å; W133-E232 WeakPolarHBondContact CZ3-OE1 3.46Å; K137-E232 WeakPolarHBondContact CD-OE1 3.41Å; K137-E232 IonicContact NZ-OE1 3.47Å; K137-E232 PolarHBondContact NZ-OE1 2.91Å; L228-E232 PolarHBondContact O-N 3.44Å; L229-E232 PolarHBondContact O-N 3.25Å; E232-A234 PolarHBondContact O-N 2.93Å; E232-S235 WeakPolarHBondContact O-CB 3.34Å; E232-S235 PolarHBondContact O-N 3.27Å; E232-S235 PolarHBondContact O-OG 2.85Å; E232-L236 PolarHBondContact O-N 3.1Å; E232-T247 HydrophobicContact CB-CG2 4.39Å; E232-T247 HydrophobicContact CG-CG2 3.86Å; E232-T247 VanDerWaalsContact OE2-CA 3.24Å; E232-T247 WeakPolarHBondContact OE2-CA 3.37Å; E232-T247 WeakPolarHBondContact OE2-CB 3.5Å; E232-C248 PolarHBondContact OE2-N 2.69Å; E232-Y250 HydrophobicContact CB-CE2 4.31Å; E232-Y250 WeakPolarHBondContact OE2-CE2 3.19Å; E232-Y250 PolarHBondContact OE2-OH 3.43Å; E232-Y250 VanDerWaalsContact OE2-OH 3.04Å
233	C	98.1	Very high	97.3	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-54.5	-37.3	177	-75.3	0	0	0	0	113.7	L211 L229 S235 L236 H259	L211-C233 HydrophobicContact CB-CB 3.93Å; L211-C233 WeakPolarHBondContact O-CB 3.35Å; L211-C233 PolarHBondContact O-SG 3.21Å; L211-C233 VanDerWaalsContact O-SG 3.32Å; L229-C233 WeakPolarHBondContact O-CB 3.22Å; L229-C233 PolarHBondContact O-N 3.41Å; L229-C233 PolarHBondContact O-SG 3.14Å; C233-S235 PolarHBondContact O-N 2.97Å; C233-L236 WeakPolarHBondContact O-CB 3.32Å; C233-L236 PolarHBondContact O-N 2.77Å; C233-L236 VanDerWaalsContact O-N 3.1Å; C233-H259 PolarHBondContact SG-CE1 2.94Å
234	A	96.6	Very high	97.3	Very high	55 Å²	55	39.7 Å²	39.7	46%	0.455	22%	0.22	S	C	.	.	H	α-helix	trans	-62.6	-30.5	177.2	0	0	0	0	0	112.9	L212 K230 E232 L236	L212-A234 HydrophobicContact CD2-CB 4.04Å; K230-A234 WeakPolarHBondContact O-CB 3.43Å; K230-A234 PolarHBondContact O-N 2.93Å; E232-A234 PolarHBondContact O-N 2.93Å; A234-L236 VanDerWaalsContact C-N 3.32Å
235	S	96.9	Very high	97.3	Very high	50 Å²	50	42.6 Å²	42.6	35%	0.35	23%	0.23	S	C	.	.	H	α-helix	trans	-76.3	-16.3	175.4	77.2	0	0	0	0	114	W133 E232 C233 H237	W133-S235 VanDerWaalsContact CZ2-OG 3.3Å; W133-S235 WeakPolarHBondContact CZ2-OG 3.29Å; E232-S235 WeakPolarHBondContact O-CB 3.34Å; E232-S235 PolarHBondContact O-N 3.27Å; E232-S235 PolarHBondContact O-OG 2.85Å; C233-S235 PolarHBondContact O-N 2.97Å; S235-H237 VanDerWaalsContact C-N 3.31Å; S235-H237 PolarHBondContact O-N 2.82Å
236	L	97.4	Very high	97.4	Very high	39 Å²	39	43.9 Å²	43.9	20%	0.204	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-9.1	-179.2	-63.9	-178.6	0	0	0	113.8	L211 E232 C233 A234 G238 K245 T247	L211-L236 HydrophobicContact CD1-CB 3.96Å; L211-L236 HydrophobicContact CD1-CD1 3.83Å; E232-L236 PolarHBondContact O-N 3.1Å; C233-L236 WeakPolarHBondContact O-CB 3.32Å; C233-L236 PolarHBondContact O-N 2.77Å; C233-L236 VanDerWaalsContact O-N 3.1Å; A234-L236 VanDerWaalsContact C-N 3.32Å; L236-G238 PolarHBondContact O-N 2.55Å; L236-K245 HydrophobicContact CB-CD 4.06Å; L236-K245 HydrophobicContact CD1-CB 3.98Å; L236-K245 HydrophobicContact CD1-CD 4.4Å; L236-K245 PolarHBondContact O-NZ 3.48Å; L236-T247 HydrophobicContact CD1-CG2 3.62Å
237	H	96.1	Very high	97.5	Very high	172 Å²	172	43.6 Å²	43.6	80%	0.796	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.5	44.4	-178.4	-54.2	-56	0	0	0	114	S235	S235-H237 VanDerWaalsContact C-N 3.31Å; S235-H237 PolarHBondContact O-N 2.82Å
238	G	97.5	Very high	97.7	Very high	11 Å²	11	41.4 Å²	41.4	11%	0.113	22%	0.219	C	C	.	.			trans	75.1	-170	178.2	0	0	0	0	0	114.2	K209 L236 K245	K209-G238 CarbonylContact O-C 3.54Å; K209-G238 WeakPolarHBondContact O-CA 3.24Å; L236-G238 PolarHBondContact O-N 2.55Å; G238-K245 WeakPolarHBondContact O-CD 3.27Å; G238-K245 WeakPolarHBondContact O-CE 3.43Å; G238-K245 PolarHBondContact O-NZ 3.26Å
239	C	98.4	Very high	97.8	Very high	8 Å²	8	41.4 Å²	41.4	5%	0.054	22%	0.219	C	C	.	.			trans	-150.2	150.7	176.2	-164.6	0	0	0	0	111.2	K209 L211 K245 V261	K209-C239 WeakPolarHBondContact CA-O 3.41Å; K209-C239 WeakPolarHBondContact CG-O 3.3Å; K209-C239 PolarHBondContact O-N 3.34Å; L211-C239 HydrophobicContact CD1-CB 4.05Å; L211-C239 HydrophobicContact CD2-CB 3.77Å; L211-C239 HydrophobicContact CG-CB 4Å; C239-K245 HydrophobicContact CB-CD 4.49Å; C239-V261 HydrophobicContact CB-CG2 3.77Å
240	E	98.6	Very high	97.8	Very high	110 Å²	110	41.4 Å²	41.4	51%	0.514	22%	0.219	S	C	.	.			trans	-92	159.3	-179.5	-85.1	-58.5	131.2	0	0	112.9	K209 G242 E243	K209-E240 WeakPolarHBondContact CE-OE2 3.48Å; K209-E240 IonicContact NZ-OE1 2.68Å; K209-E240 PolarHBondContact NZ-OE1 3Å; K209-E240 IonicContact NZ-OE2 2.85Å; K209-E240 PolarHBondContact NZ-OE2 3.36Å; E240-G242 PolarHBondContact O-N 3.37Å; E240-E243 HydrophobicContact CB-CB 4.44Å; E240-E243 HydrophobicContact CB-CG 4.09Å; E240-E243 WeakPolarHBondContact O-CB 3.36Å; E240-E243 PolarHBondContact O-N 2.69Å
241	T	98.6	Very high	97.9	Very high	53 Å²	53	36.5 Å²	36.5	33%	0.325	20%	0.198	S	C	.	.	B	Isolated β-bridge	trans	-70	121.8	-174.9	-63.3	0	0	0	0	110.9	K209 V261 P263 A276	K209-T241 WeakPolarHBondContact CE-OG1 3.4Å; T241-V261 CarbonylContact C-O 3.56Å; T241-V261 WeakPolarHBondContact CA-O 2.91Å; T241-P263 HydrophobicContact CG2-CB 4.18Å; T241-A276 HydrophobicContact CG2-CB 4.05Å
242	G	98.5	Very high	98	Very high	2 Å²	2	33.9 Å²	33.9	2%	0.021	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.9	-15.9	-170.6	0	0	0	0	0	114.4	E240 V261 A276 S279 C280	E240-G242 PolarHBondContact O-N 3.37Å; G242-V261 PolarHBondContact N-O 2.88Å; G242-A276 WeakPolarHBondContact CA-O 3.23Å; G242-S279 CarbonylContact O-C 3.56Å; G242-S279 VanDerWaalsContact O-CB 3.27Å; G242-S279 WeakPolarHBondContact O-CB 3.33Å; G242-C280 PolarHBondContact O-N 3.21Å
243	E	98.8	Very high	98.1	Very high	92 Å²	92	33.8 Å²	33.8	43%	0.43	18%	0.183	S	C	.	.			trans	-91.8	165.3	-177.8	-64.5	-56.5	153.1	0	0	113.1	E240 T260 V261 N283	E240-E243 HydrophobicContact CB-CB 4.44Å; E240-E243 HydrophobicContact CB-CG 4.09Å; E240-E243 WeakPolarHBondContact O-CB 3.36Å; E240-E243 PolarHBondContact O-N 2.69Å; E243-T260 WeakPolarHBondContact O-CA 3.48Å; E243-T260 WeakPolarHBondContact O-CB 3.46Å; E243-T260 PolarHBondContact O-OG1 3.03Å; E243-V261 PolarHBondContact O-N 3.42Å; E243-N283 PolarHBondContact OE2-ND2 2.92Å
244	A	98.8	Very high	98.1	Very high	14 Å²	14	33.8 Å²	33.8	12%	0.116	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	148.7	179.1	0	0	0	0	0	112.1	I258 H259 N283	A244-I258 HydrophobicContact CB-CG2 4.03Å; A244-H259 CarbonylContact C-O 3.5Å; A244-H259 VanDerWaalsContact CA-O 3.29Å; A244-H259 WeakPolarHBondContact CA-O 3.31Å; A244-N283 HydrophobicContact CB-CB 4.11Å
245	K	98.8	Very high	98.2	Very high	73 Å²	73	34.4 Å²	34.4	32%	0.317	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	146.2	171.8	-66.3	-174.9	177.7	172.6	0	111.1	L211 L236 G238 C239 I258 H259	L211-K245 HydrophobicContact CD1-CD 4.32Å; L236-K245 HydrophobicContact CB-CD 4.06Å; L236-K245 HydrophobicContact CD1-CB 3.98Å; L236-K245 HydrophobicContact CD1-CD 4.4Å; L236-K245 PolarHBondContact O-NZ 3.48Å; G238-K245 WeakPolarHBondContact O-CD 3.27Å; G238-K245 WeakPolarHBondContact O-CE 3.43Å; G238-K245 PolarHBondContact O-NZ 3.26Å; C239-K245 HydrophobicContact CB-CD 4.49Å; K245-I258 CarbonylContact O-C 3.51Å; K245-I258 WeakPolarHBondContact O-CA 3.23Å; K245-H259 PolarHBondContact N-O 3.44Å; K245-H259 PolarHBondContact O-N 3.14Å
246	I	98.8	Very high	98.3	Very high	28 Å²	28	34 Å²	34	14%	0.144	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	147.7	-175	-164.7	166	0	0	0	113.4	Y256 V257 I258 T287 N291	I246-Y256 HydrophobicContact CD1-CD1 3.93Å; I246-Y256 HydrophobicContact CD1-CD2 4.23Å; I246-Y256 HydrophobicContact CD1-CG 3.75Å; I246-Y256 HydrophobicContact CG1-CD1 4.13Å; I246-Y256 HydrophobicContact CG1-CG 4.19Å; I246-V257 WeakPolarHBondContact CA-O 3.41Å; I246-I258 HydrophobicContact CB-CG1 4.27Å; I246-I258 HydrophobicContact CD1-CD1 4.26Å; I246-I258 HydrophobicContact CD1-CG1 3.91Å; I246-I258 HydrophobicContact CG1-CG1 3.85Å; I246-T287 HydrophobicContact CB-CG2 3.71Å; I246-T287 HydrophobicContact CD1-CG2 4.36Å; I246-T287 HydrophobicContact CG2-CG2 4.14Å; I246-N291 HydrophobicContact CD1-CB 3.71Å
247	T	98.9	Very high	98.4	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	165.9	177.9	54.4	0	0	0	0	109.8	L229 E232 L236 Y256 V257 H259	L229-T247 HydrophobicContact CD1-CG2 4.2Å; L229-T247 VanDerWaalsContact CD1-OG1 3.23Å; L229-T247 WeakPolarHBondContact CD1-OG1 3.43Å; E232-T247 HydrophobicContact CB-CG2 4.39Å; E232-T247 HydrophobicContact CG-CG2 3.86Å; E232-T247 VanDerWaalsContact OE2-CA 3.24Å; E232-T247 WeakPolarHBondContact OE2-CA 3.37Å; E232-T247 WeakPolarHBondContact OE2-CB 3.5Å; L236-T247 HydrophobicContact CD1-CG2 3.62Å; T247-Y256 CarbonylContact O-C 3.56Å; T247-Y256 VanDerWaalsContact O-CA 3.23Å; T247-Y256 WeakPolarHBondContact O-CA 3.31Å; T247-Y256 WeakPolarHBondContact O-CB 3.22Å; T247-V257 PolarHBondContact N-O 2.95Å; T247-V257 PolarHBondContact O-N 3.3Å; T247-V257 WeakPolarHBondContact OG1-CB 3.46Å; T247-V257 PolarHBondContact OG1-O 3.4Å; T247-H259 WeakPolarHBondContact CB-NE2 3.42Å; T247-H259 WeakPolarHBondContact CG2-NE2 2.92Å; T247-H259 PolarHBondContact OG1-CD2 3.19Å; T247-H259 PolarHBondContact OG1-NE2 2.77Å
248	C	98.4	Very high	98.5	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	151.3	170.3	-168.8	0	0	0	0	111.5	K137 E232 Y250	K137-C248 HydrophobicContact CB-CB 4.06Å; K137-C248 HydrophobicContact CD-CB 4.14Å; K137-C248 HydrophobicContact CG-CB 3.86Å; E232-C248 PolarHBondContact OE2-N 2.69Å; C248-Y250 VanDerWaalsContact C-N 3.28Å; C248-Y250 HydrophobicContact CB-CD2 4.03Å; C248-Y250 HydrophobicContact CB-CE1 4.19Å; C248-Y250 HydrophobicContact CB-CE2 3.62Å; C248-Y250 HydrophobicContact CB-CG 4.47Å; C248-Y250 WeakPolarHBondContact O-CD2 3.46Å; C248-Y250 WeakPolarHBondContact O-CE2 3.27Å; C248-Y250 PolarHBondContact O-N 3.36Å
249	G	98.2	Very high	98.6	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	11%	0.114	C	C	.	.			trans	-72.1	-17.9	174.2	0	0	0	0	0	114.5	A225 G251 L252 K255	A225-G249 WeakPolarHBondContact CB-O 3.26Å; G249-G251 PolarHBondContact O-N 3.07Å; G249-L252 VanDerWaalsContact O-CB 3.25Å; G249-L252 WeakPolarHBondContact O-CB 3.19Å; G249-L252 WeakPolarHBondContact O-CD1 3.48Å; G249-L252 WeakPolarHBondContact O-CG 3.28Å; G249-L252 PolarHBondContact O-N 3.26Å; G249-K255 PolarHBondContact N-O 3.23Å
250	Y	97.7	Very high	98.6	Very high	1 Å²	1	23.1 Å²	23.1	0%	0.004	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	-110.8	-175.1	-62.6	-76.7	0	0	0	112.5	L126 W133 A136 L140 A225 L228 L229 E232 C248 L252	L126-Y250 HydrophobicContact CD2-CD1 4.49Å; W133-Y250 HydrophobicContact CB-CE1 4.43Å; W133-Y250 PolarHBondContact O-OH 3.43Å; W133-Y250 VanDerWaalsContact O-OH 3.11Å; A136-Y250 HydrophobicContact CB-CD1 4.39Å; A136-Y250 HydrophobicContact CB-CE1 4.05Å; L140-Y250 HydrophobicContact CD1-CD1 4.2Å; A225-Y250 WeakPolarHBondContact O-CB 3.45Å; L228-Y250 HydrophobicContact CB-CD1 3.54Å; L228-Y250 HydrophobicContact CB-CD2 4.38Å; L228-Y250 HydrophobicContact CB-CE1 3.6Å; L228-Y250 HydrophobicContact CB-CE2 4.42Å; L228-Y250 HydrophobicContact CB-CG 3.96Å; L228-Y250 HydrophobicContact CD1-CD1 4.01Å; L228-Y250 HydrophobicContact CD1-CE1 4.21Å; L228-Y250 HydrophobicContact CG-CD1 4.43Å; L229-Y250 HydrophobicContact CB-CD2 3.82Å; L229-Y250 HydrophobicContact CB-CE2 4.3Å; L229-Y250 HydrophobicContact CD1-CD2 4.28Å; L229-Y250 HydrophobicContact CD1-CE2 4.35Å; E232-Y250 HydrophobicContact CB-CE2 4.31Å; E232-Y250 WeakPolarHBondContact OE2-CE2 3.19Å; E232-Y250 PolarHBondContact OE2-OH 3.43Å; E232-Y250 VanDerWaalsContact OE2-OH 3.04Å; C248-Y250 VanDerWaalsContact C-N 3.28Å; C248-Y250 HydrophobicContact CB-CD2 4.03Å; C248-Y250 HydrophobicContact CB-CE1 4.19Å; C248-Y250 HydrophobicContact CB-CE2 3.62Å; C248-Y250 HydrophobicContact CB-CG 4.47Å; C248-Y250 WeakPolarHBondContact O-CD2 3.46Å; C248-Y250 WeakPolarHBondContact O-CE2 3.27Å; C248-Y250 PolarHBondContact O-N 3.36Å; Y250-L252 VanDerWaalsContact C-N 3.27Å; Y250-L252 PolarHBondContact O-N 2.94Å
251	G	97.3	Very high	98.6	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	0.1	177.7	0	0	0	0	0	116.2	Y152 R153 A224 A225 G249	Y152-G251 WeakPolarHBondContact CA-O 3.42Å; R153-G251 PolarHBondContact N-O 2.94Å; A224-G251 CarbonylContact O-C 3.5Å; A225-G251 PolarHBondContact O-N 2.86Å; G249-G251 PolarHBondContact O-N 3.07Å
252	L	98.6	Very high	98.6	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	7%	0.073	C	C	.	.	S	Bend	trans	-78.2	151.3	174	-68.8	162.2	0	0	0	112	R148 T196 I203 I221 A224 A225 G249 Y250 A254 V257	R148-L252 PolarHBondContact NH2-O 3.33Å; R148-L252 VanDerWaalsContact NH2-O 3.14Å; T196-L252 HydrophobicContact CG2-CD2 4.27Å; T196-L252 WeakPolarHBondContact O-CD2 3.42Å; I203-L252 HydrophobicContact CD1-CD1 3.82Å; I203-L252 HydrophobicContact CD1-CD2 4.16Å; I203-L252 HydrophobicContact CG1-CD1 4.47Å; I221-L252 HydrophobicContact CG2-CD1 4.29Å; A224-L252 HydrophobicContact CB-CD2 3.6Å; A225-L252 HydrophobicContact CB-CD1 3.87Å; A225-L252 HydrophobicContact CB-CG 3.96Å; G249-L252 VanDerWaalsContact O-CB 3.25Å; G249-L252 WeakPolarHBondContact O-CB 3.19Å; G249-L252 WeakPolarHBondContact O-CD1 3.48Å; G249-L252 WeakPolarHBondContact O-CG 3.28Å; G249-L252 PolarHBondContact O-N 3.26Å; Y250-L252 VanDerWaalsContact C-N 3.27Å; Y250-L252 PolarHBondContact O-N 2.94Å; L252-A254 VanDerWaalsContact C-N 3.27Å; L252-A254 HydrophobicContact CB-CB 4.39Å; L252-A254 PolarHBondContact O-N 3.16Å; L252-V257 HydrophobicContact CD1-CG2 3.34Å
253	P	98.4	Very high	98.6	Very high	1 Å²	1	15.6 Å²	15.6	1%	0.006	7%	0.074	C	C	.	.	S	Bend	trans	-59.2	-37.9	166.3	-24	36.9	0	0	0	112.9	R148 Y152 T196 E199	R148-P253 PolarHBondContact NH1-O 3.42Å; Y152-P253 HydrophobicContact CD2-CB 3.99Å; Y152-P253 HydrophobicContact CD2-CG 3.9Å; Y152-P253 HydrophobicContact CE1-CB 4.45Å; Y152-P253 HydrophobicContact CE2-CB 3.71Å; Y152-P253 HydrophobicContact CE2-CG 4.16Å; Y152-P253 HydrophobicContact CG-CB 4.48Å; Y152-P253 HydrophobicContact CG-CG 4.2Å; Y152-P253 VanDerWaalsContact CZ-CA 3.46Å; Y152-P253 PolarHBondContact OH-O 2.95Å; T196-P253 WeakPolarHBondContact O-CD 3.29Å; E199-P253 HydrophobicContact CB-CB 3.85Å; E199-P253 HydrophobicContact CG-CB 4.29Å
254	A	98.8	Very high	98.5	Very high	1 Å²	1	15.8 Å²	15.8	1%	0.008	8%	0.076	C	C	.	.	S	Bend	trans	-56.9	144.7	172.8	0	0	0	0	0	112.4	R148 L198 I200 I203 L252	R148-A254 PolarHBondContact NH2-O 2.85Å; L198-A254 PolarHBondContact O-N 3.02Å; I200-A254 VanDerWaalsContact O-CA 3.29Å; I200-A254 WeakPolarHBondContact O-CA 3.33Å; I203-A254 HydrophobicContact CB-CB 4.43Å; I203-A254 HydrophobicContact CG1-CB 4.06Å; I203-A254 HydrophobicContact CG2-CB 3.86Å; L252-A254 VanDerWaalsContact C-N 3.27Å; L252-A254 HydrophobicContact CB-CB 4.39Å; L252-A254 PolarHBondContact O-N 3.16Å
255	K	98.5	Very high	98.3	Very high	68 Å²	68	15.3 Å²	15.3	30%	0.296	7%	0.073	S	C	.	.	S	Bend	trans	-72.3	-35.7	174.9	-58.4	173.5	-174.3	163.7	0	111.8	L141 I200 D201 G249	L141-K255 HydrophobicContact CD2-CB 4.3Å; I200-K255 PolarHBondContact O-N 3.14Å; I200-K255 VanDerWaalsContact O-N 3.16Å; D201-K255 CarbonylContact O-C 3.47Å; D201-K255 WeakPolarHBondContact O-CA 3.42Å; D201-K255 WeakPolarHBondContact O-CB 3.31Å; D201-K255 PolarHBondContact O-N 2.76Å; D201-K255 WeakPolarHBondContact OD1-CD 3.43Å; D201-K255 VanDerWaalsContact OD1-CE 3.3Å; D201-K255 WeakPolarHBondContact OD1-CE 3.43Å; D201-K255 IonicContact OD1-NZ 2.96Å; D201-K255 PolarHBondContact OD1-NZ 3.44Å; G249-K255 PolarHBondContact N-O 3.23Å
256	Y	98.9	Very high	97.5	Very high	42 Å²	42	19.1 Å²	19.1	17%	0.165	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	156.1	-175	-56.8	-70.1	0	0	0	112.8	L141 D201 A202 I203 I246 T247 A293	L141-Y256 HydrophobicContact CD1-CE1 3.76Å; L141-Y256 HydrophobicContact CD2-CD1 4.29Å; L141-Y256 HydrophobicContact CD2-CE1 3.61Å; L141-Y256 HydrophobicContact CG-CE1 4.37Å; D201-Y256 PolarHBondContact O-N 2.88Å; A202-Y256 WeakPolarHBondContact CA-O 3.49Å; I203-Y256 PolarHBondContact N-O 3.12Å; I203-Y256 VanDerWaalsContact N-O 3.15Å; I246-Y256 HydrophobicContact CD1-CD1 3.93Å; I246-Y256 HydrophobicContact CD1-CD2 4.23Å; I246-Y256 HydrophobicContact CD1-CG 3.75Å; I246-Y256 HydrophobicContact CG1-CD1 4.13Å; I246-Y256 HydrophobicContact CG1-CG 4.19Å; T247-Y256 CarbonylContact O-C 3.56Å; T247-Y256 VanDerWaalsContact O-CA 3.23Å; T247-Y256 WeakPolarHBondContact O-CA 3.31Å; T247-Y256 WeakPolarHBondContact O-CB 3.22Å; Y256-A293 HydrophobicContact CD2-CB 4.36Å
257	V	98.9	Very high	96.6	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	128.1	160.4	-177.6	0	0	0	0	108.8	I203 N205 I221 L229 I246 T247 L252	I203-V257 HydrophobicContact CD1-CG2 4.37Å; I203-V257 HydrophobicContact CG1-CG2 4.02Å; I203-V257 WeakPolarHBondContact O-CA 3.38Å; N205-V257 HydrophobicContact CB-CG1 3.7Å; I221-V257 HydrophobicContact CG2-CG1 3.92Å; I221-V257 HydrophobicContact CG2-CG2 4Å; L229-V257 HydrophobicContact CD2-CG2 4.41Å; I246-V257 WeakPolarHBondContact CA-O 3.41Å; T247-V257 PolarHBondContact N-O 2.95Å; T247-V257 PolarHBondContact O-N 3.3Å; T247-V257 WeakPolarHBondContact OG1-CB 3.46Å; T247-V257 PolarHBondContact OG1-O 3.4Å; L252-V257 HydrophobicContact CD1-CG2 3.34Å
258	I	98.9	Very high	96.2	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	107.9	174	-62.8	174	0	0	0	107.7	A202 I203 V204 N205 A244 K245 I246 T287 A288	A202-I258 HydrophobicContact CB-CD1 3.73Å; A202-I258 HydrophobicContact CB-CG1 4.18Å; I203-I258 PolarHBondContact O-N 2.85Å; V204-I258 CarbonylContact C-O 3.57Å; V204-I258 VanDerWaalsContact CA-O 3.26Å; V204-I258 WeakPolarHBondContact CA-O 3.3Å; V204-I258 HydrophobicContact CG2-CB 4.31Å; N205-I258 PolarHBondContact N-O 3.33Å; A244-I258 HydrophobicContact CB-CG2 4.03Å; K245-I258 CarbonylContact O-C 3.51Å; K245-I258 WeakPolarHBondContact O-CA 3.23Å; I246-I258 HydrophobicContact CB-CG1 4.27Å; I246-I258 HydrophobicContact CD1-CD1 4.26Å; I246-I258 HydrophobicContact CD1-CG1 3.91Å; I246-I258 HydrophobicContact CG1-CG1 3.85Å; I258-T287 HydrophobicContact CD1-CG2 4.26Å; I258-T287 HydrophobicContact CG1-CG2 4.28Å; I258-T287 HydrophobicContact CG2-CG2 4.19Å; I258-A288 HydrophobicContact CD1-CB 3.6Å
259	H	98.9	Very high	96.1	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	121.3	-177.8	-54.1	-106.3	0	0	0	109.9	N205 A207 L211 H222 L229 C233 A244 K245 T247	N205-H259 HydrophobicContact CB-CB 4.46Å; N205-H259 PolarHBondContact ND2-ND1 2.75Å; A207-H259 HydrophobicContact CB-CB 4.01Å; L211-H259 HydrophobicContact CD2-CB 3.59Å; H222-H259 AromaticContact CD2-CE1 3.86Å; H222-H259 AromaticContact CE1-CE1 3.58Å; H222-H259 AromaticContact NE2-CE1 3.05Å; H222-H259 PolarHBondContact NE2-CE1 3.46Å; L229-H259 WeakPolarHBondContact CD1-NE2 3.3Å; L229-H259 WeakPolarHBondContact CD2-CE1 3.25Å; C233-H259 PolarHBondContact SG-CE1 2.94Å; A244-H259 CarbonylContact C-O 3.5Å; A244-H259 VanDerWaalsContact CA-O 3.29Å; A244-H259 WeakPolarHBondContact CA-O 3.31Å; K245-H259 PolarHBondContact N-O 3.44Å; K245-H259 PolarHBondContact O-N 3.14Å; T247-H259 WeakPolarHBondContact CB-NE2 3.42Å; T247-H259 WeakPolarHBondContact CG2-NE2 2.92Å; T247-H259 PolarHBondContact OG1-CD2 3.19Å; T247-H259 PolarHBondContact OG1-NE2 2.77Å
260	T	98.9	Very high	96	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	143.2	176.2	-173.1	0	0	0	0	111	V204 N205 A207 E243 C280 I301	V204-T260 HydrophobicContact CG1-CG2 3.61Å; N205-T260 PolarHBondContact O-N 2.94Å; N205-T260 VanDerWaalsContact O-O 3.14Å; A207-T260 PolarHBondContact N-O 3.15Å; E243-T260 WeakPolarHBondContact O-CA 3.48Å; E243-T260 WeakPolarHBondContact O-CB 3.46Å; E243-T260 PolarHBondContact O-OG1 3.03Å; T260-C280 HydrophobicContact CG2-CB 3.94Å; T260-C280 WeakPolarHBondContact OG1-CA 3.44Å; T260-C280 WeakPolarHBondContact OG1-CB 3.29Å; T260-I301 HydrophobicContact CG2-CD1 3.68Å
261	V	98.8	Very high	96	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.012	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	102.6	-173.2	-177.8	0	0	0	0	110.1	K209 L211 C239 T241 G242 E243 C280	K209-V261 HydrophobicContact CG-CG1 3.93Å; L211-V261 HydrophobicContact CD2-CG2 4.47Å; C239-V261 HydrophobicContact CB-CG2 3.77Å; T241-V261 CarbonylContact C-O 3.56Å; T241-V261 WeakPolarHBondContact CA-O 2.91Å; G242-V261 PolarHBondContact N-O 2.88Å; E243-V261 PolarHBondContact O-N 3.42Å; V261-C280 PolarHBondContact O-SG 3.28Å
262	G	98.5	Very high	95.9	Very high	2 Å²	2	40.1 Å²	40.1	2%	0.021	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-64.1	154.9	178.1	0	0	0	0	0	113.8	S302 Y306	G262-S302 VanDerWaalsContact C-OG 3.3Å; G262-S302 VanDerWaalsContact CA-OG 3.25Å; G262-S302 WeakPolarHBondContact CA-OG 3.35Å; G262-Y306 WeakPolarHBondContact O-CD2 2.92Å; G262-Y306 WeakPolarHBondContact O-CE2 3.23Å
263	P	98.2	Very high	95.9	Very high	4 Å²	4	41.4 Å²	41.4	3%	0.026	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-68.9	153.3	171.8	29.5	-35.5	0	0	0	112.1	T241 E273 A276 L277 S302 Y308	T241-P263 HydrophobicContact CG2-CB 4.18Å; P263-E273 HydrophobicContact CB-CB 4.26Å; P263-E273 HydrophobicContact CB-CG 4.31Å; P263-E273 WeakPolarHBondContact CG-O 3.16Å; P263-A276 HydrophobicContact CB-CB 3.88Å; P263-A276 HydrophobicContact CG-CB 4.01Å; P263-L277 HydrophobicContact CG-CB 3.99Å; P263-S302 WeakPolarHBondContact CD-OG 3.36Å; P263-S302 WeakPolarHBondContact O-CB 3.49Å; P263-S302 PolarHBondContact O-OG 2.97Å; P263-Y308 HydrophobicContact CG-CD2 4.12Å; P263-Y308 HydrophobicContact CG-CE2 4.19Å
264	I	97.5	Very high	95.9	Very high	95 Å²	95	45.6 Å²	45.6	49%	0.487	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-98.6	122.2	171.7	-59.1	167.4	0	0	0	108.3	Q266 Y306	I264-Q266 HydrophobicContact CG2-CB 4.16Å; I264-Q266 HydrophobicContact CG2-CG 3.79Å; I264-Y306 HydrophobicContact CD1-CD1 4.37Å; I264-Y306 HydrophobicContact CD1-CE1 4.21Å; I264-Y306 HydrophobicContact CG1-CD1 3.78Å; I264-Y306 HydrophobicContact CG1-CD2 3.95Å; I264-Y306 HydrophobicContact CG1-CE1 4.02Å; I264-Y306 HydrophobicContact CG1-CE2 4.18Å; I264-Y306 HydrophobicContact CG1-CG 3.74Å
265	A	94.1	Very high	95.9	Very high	5 Å²	5	52.6 Å²	52.6	4%	0.041	27%	0.274	C	S	.	.			trans	-111.8	22.2	-172.5	0	0	0	0	0	113.5	G267 G268 V269 Y306 Y308	A265-G267 PolarHBondContact O-N 2.84Å; A265-G268 PolarHBondContact O-N 3Å; A265-V269 HydrophobicContact CB-CG2 4.09Å; A265-Y306 PolarHBondContact N-O 3.01Å; A265-Y308 HydrophobicContact CB-CD2 3.95Å; A265-Y308 HydrophobicContact CB-CG 4.24Å
266	Q	81.5	Confident	95.9	Very high	153 Å²	153	50 Å²	50	72%	0.715	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	6.8	-176.9	-67	177.8	-2.3	0	0	115.2	I264 I305	I264-Q266 HydrophobicContact CG2-CB 4.16Å; I264-Q266 HydrophobicContact CG2-CG 3.79Å; Q266-I305 PolarHBondContact NE2-O 2.95Å
267	G	80.7	Confident	95.9	Very high	87 Å²	87	48 Å²	48	90%	0.897	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.8	12.5	169.7	0	0	0	0	0	113.9	A265	A265-G267 PolarHBondContact O-N 2.84Å
268	G	89.4	Confident	95.9	Very high	47 Å²	47	51.2 Å²	51.2	49%	0.485	27%	0.269	S	S	.	.			trans	104.6	175.5	-170.3	0	0	0	0	0	113.2	A265	A265-G268 PolarHBondContact O-N 3Å
269	V	96.6	Very high	95.9	Very high	23 Å²	23	53 Å²	53	14%	0.139	28%	0.282	C	S	.	.			trans	-108.8	100.2	-176.2	177.6	0	0	0	0	110.8	A265 E273 R274 Y308 P309	A265-V269 HydrophobicContact CB-CG2 4.09Å; V269-E273 HydrophobicContact CG1-CB 4.44Å; V269-R274 HydrophobicContact CG1-CG 3.66Å; V269-R274 PolarHBondContact O-NH2 2.87Å; V269-Y308 HydrophobicContact CG1-CE1 4.18Å; V269-Y308 HydrophobicContact CG1-CE2 4.04Å; V269-Y308 WeakPolarHBondContact CG1-OH 3.46Å; V269-Y308 HydrophobicContact CG2-CD1 4.2Å; V269-Y308 HydrophobicContact CG2-CD2 4.36Å; V269-Y308 HydrophobicContact CG2-CE1 4.04Å; V269-Y308 HydrophobicContact CG2-CE2 4.2Å; V269-Y308 HydrophobicContact CG2-CG 4.38Å; V269-P309 HydrophobicContact CG2-CG 4.19Å
270	G	96.6	Very high	95.9	Very high	28 Å²	28	53 Å²	53	29%	0.289	28%	0.282	S	S	.	.			trans	-83.6	177.8	169.8	0	0	0	0	0	113.1	R272 E273 R274	G270-R272 VanDerWaalsContact C-N 3.26Å; G270-R272 PolarHBondContact O-N 3.19Å; G270-E273 VanDerWaalsContact CA-OE2 3.26Å; G270-E273 WeakPolarHBondContact CA-OE2 3.24Å; G270-E273 PolarHBondContact N-OE2 1.96Å; G270-E273 PolarHBondContact O-N 3.49Å; G270-R274 WeakPolarHBondContact O-CG 3.35Å; G270-R274 PolarHBondContact O-N 3.35Å; G270-R274 VanDerWaalsContact O-N 3.1Å
271	E	97.1	Very high	95.9	Very high	99 Å²	99	53 Å²	53	46%	0.463	28%	0.282	S	S	.	.	H	α-helix	trans	-61.1	-34.7	174.3	169.8	53.4	-156.4	0	0	112.5	R274 R275	E271-R274 IonicContact OE2-NH1 3.75Å; E271-R275 WeakPolarHBondContact O-CB 3.43Å; E271-R275 PolarHBondContact O-N 2.66Å; E271-R275 IonicContact OE1-CZ 3.26Å; E271-R275 IonicContact OE1-NE 2.74Å; E271-R275 PolarHBondContact OE1-NE 2.83Å; E271-R275 IonicContact OE1-NH2 3.35Å; E271-R275 PolarHBondContact OE1-NH2 2.94Å
272	R	97.1	Very high	95.9	Very high	185 Å²	185	56.8 Å²	56.8	70%	0.698	30%	0.296	S	S	*	.	H	α-helix	trans	-63.1	-43.1	176.2	174.3	177.2	176.3	-105.9	7.6	111.4	G270 A276	G270-R272 VanDerWaalsContact C-N 3.26Å; G270-R272 PolarHBondContact O-N 3.19Å; R272-A276 VanDerWaalsContact O-CB 3.27Å; R272-A276 WeakPolarHBondContact O-CB 3.47Å; R272-A276 PolarHBondContact O-N 3.26Å
273	E	98.3	Very high	95.9	Very high	27 Å²	27	58 Å²	58	13%	0.126	30%	0.302	C	S	.	.	H	α-helix	trans	-72.1	-39.9	-177.5	-67.5	60.9	-129.8	0	0	110.5	P263 V269 G270 L277 Y308	P263-E273 HydrophobicContact CB-CB 4.26Å; P263-E273 HydrophobicContact CB-CG 4.31Å; P263-E273 WeakPolarHBondContact CG-O 3.16Å; V269-E273 HydrophobicContact CG1-CB 4.44Å; G270-E273 VanDerWaalsContact CA-OE2 3.26Å; G270-E273 WeakPolarHBondContact CA-OE2 3.24Å; G270-E273 PolarHBondContact N-OE2 1.96Å; G270-E273 PolarHBondContact O-N 3.49Å; E273-L277 WeakPolarHBondContact O-CB 3.31Å; E273-L277 PolarHBondContact O-N 2.8Å; E273-Y308 HydrophobicContact CB-CE2 4.17Å
274	R	98.3	Very high	96	Very high	90 Å²	90	57.9 Å²	57.9	34%	0.34	30%	0.301	S	S	.	.	H	α-helix	trans	-57.9	-53.6	170.7	-67.4	176.6	-149.2	131.6	10.8	111.6	V269 G270 E271 A276 L277 R278 Y308 E316	V269-R274 HydrophobicContact CG1-CG 3.66Å; V269-R274 PolarHBondContact O-NH2 2.87Å; G270-R274 WeakPolarHBondContact O-CG 3.35Å; G270-R274 PolarHBondContact O-N 3.35Å; G270-R274 VanDerWaalsContact O-N 3.1Å; E271-R274 IonicContact OE2-NH1 3.75Å; R274-A276 PolarHBondContact O-N 2.95Å; R274-L277 PolarHBondContact O-N 3.3Å; R274-L277 VanDerWaalsContact O-N 3.14Å; R274-R278 WeakPolarHBondContact O-CG 3.49Å; R274-R278 PolarHBondContact O-N 3.49Å; R274-Y308 WeakPolarHBondContact CA-OH 3.22Å; R274-Y308 WeakPolarHBondContact CG-OH 3.23Å; R274-E316 WeakPolarHBondContact CB-OE1 3.5Å; R274-E316 WeakPolarHBondContact CD-OE1 3.25Å; R274-E316 VanDerWaalsContact CG-OE1 3.31Å; R274-E316 WeakPolarHBondContact CG-OE1 3.26Å
275	R	98.4	Very high	96	Very high	148 Å²	148	53.3 Å²	53.3	56%	0.558	28%	0.278	S	S	*	.	H	α-helix	trans	-58.8	-46.3	-179	-167.6	-179.9	-54.2	165.9	3.6	112	E271 L277 R278 S279	E271-R275 WeakPolarHBondContact O-CB 3.43Å; E271-R275 PolarHBondContact O-N 2.66Å; E271-R275 IonicContact OE1-CZ 3.26Å; E271-R275 IonicContact OE1-NE 2.74Å; E271-R275 PolarHBondContact OE1-NE 2.83Å; E271-R275 IonicContact OE1-NH2 3.35Å; E271-R275 PolarHBondContact OE1-NH2 2.94Å; R275-L277 VanDerWaalsContact C-N 3.34Å; R275-L277 PolarHBondContact O-N 2.91Å; R275-R278 PolarHBondContact O-N 2.84Å; R275-S279 PolarHBondContact O-N 2.78Å; R275-S279 PolarHBondContact O-OG 2.91Å
276	A	98.6	Very high	96.3	Very high	13 Å²	13	56.7 Å²	56.7	11%	0.107	29%	0.293	C	S	.	.	H	α-helix	trans	-60.4	-41.6	176.2	0	0	0	0	0	112.3	T241 G242 P263 R272 R274 S279 C280	T241-A276 HydrophobicContact CG2-CB 4.05Å; G242-A276 WeakPolarHBondContact CA-O 3.23Å; P263-A276 HydrophobicContact CB-CB 3.88Å; P263-A276 HydrophobicContact CG-CB 4.01Å; R272-A276 VanDerWaalsContact O-CB 3.27Å; R272-A276 WeakPolarHBondContact O-CB 3.47Å; R272-A276 PolarHBondContact O-N 3.26Å; R274-A276 PolarHBondContact O-N 2.95Å; A276-S279 PolarHBondContact O-N 2.81Å; A276-C280 PolarHBondContact O-N 2.93Å; A276-C280 PolarHBondContact O-SG 2.88Å
277	L	98.8	Very high	97.1	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-65	-43.9	176.5	-174.5	60.4	0	0	0	111.5	P263 E273 R274 R275 S279 C280 Y281 I301 Y308 A313 E316	P263-L277 HydrophobicContact CG-CB 3.99Å; E273-L277 WeakPolarHBondContact O-CB 3.31Å; E273-L277 PolarHBondContact O-N 2.8Å; R274-L277 PolarHBondContact O-N 3.3Å; R274-L277 VanDerWaalsContact O-N 3.14Å; R275-L277 VanDerWaalsContact C-N 3.34Å; R275-L277 PolarHBondContact O-N 2.91Å; L277-S279 PolarHBondContact O-N 2.92Å; L277-C280 WeakPolarHBondContact O-CB 3.38Å; L277-C280 PolarHBondContact O-N 3.41Å; L277-Y281 HydrophobicContact CD1-CD2 4.5Å; L277-Y281 HydrophobicContact CD1-CE2 3.81Å; L277-Y281 HydrophobicContact CG-CD2 4.49Å; L277-Y281 HydrophobicContact CG-CE2 4Å; L277-Y281 VanDerWaalsContact O-CD2 3.24Å; L277-Y281 WeakPolarHBondContact O-CD2 3.32Å; L277-Y281 PolarHBondContact O-N 2.94Å; L277-I301 HydrophobicContact CD1-CB 3.9Å; L277-I301 HydrophobicContact CD1-CG2 3.69Å; L277-Y308 HydrophobicContact CB-CE2 4.04Å; L277-Y308 HydrophobicContact CD2-CD1 4Å; L277-Y308 HydrophobicContact CD2-CD2 4.01Å; L277-Y308 HydrophobicContact CD2-CE1 3.68Å; L277-Y308 HydrophobicContact CD2-CE2 3.69Å; L277-Y308 HydrophobicContact CD2-CG 4.15Å; L277-Y308 HydrophobicContact CG-CE2 4.47Å; L277-A313 HydrophobicContact CD2-CB 3.93Å; L277-E316 HydrophobicContact CD2-CB 4.04Å; L277-E316 HydrophobicContact CD2-CG 4.32Å; L277-E316 HydrophobicContact CG-CB 4.26Å
278	R	98.8	Very high	97.9	Very high	67 Å²	67	46 Å²	46	25%	0.253	22%	0.221	S	C	.	.	H	α-helix	trans	-58.3	-45.8	174	-65.5	177.1	80.1	91.2	-1.2	112.1	R274 R275 C280 Y281 W282 E316 A320 E323	R274-R278 WeakPolarHBondContact O-CG 3.49Å; R274-R278 PolarHBondContact O-N 3.49Å; R275-R278 PolarHBondContact O-N 2.84Å; R278-C280 VanDerWaalsContact C-N 3.28Å; R278-C280 PolarHBondContact O-N 3.1Å; R278-Y281 PolarHBondContact O-N 2.97Å; R278-Y281 VanDerWaalsContact O-N 3.16Å; R278-W282 PolarHBondContact O-N 3.32Å; R278-E316 WeakPolarHBondContact CD-OE2 3.48Å; R278-E316 HydrophobicContact CG-CB 3.91Å; R278-E316 HydrophobicContact CG-CG 4.31Å; R278-E316 WeakPolarHBondContact CG-OE2 3.39Å; R278-E316 IonicContact CZ-OE2 2.72Å; R278-E316 IonicContact NE-OE2 3.72Å; R278-E316 IonicContact NH1-OE2 3.76Å; R278-E316 PolarHBondContact NH1-OE2 3.35Å; R278-A320 HydrophobicContact CB-CB 4.41Å; R278-E323 IonicContact CZ-OE1 2.62Å; R278-E323 IonicContact CZ-OE2 3.46Å; R278-E323 IonicContact NH2-OE1 3.23Å; R278-E323 PolarHBondContact NH2-OE1 3.48Å; R278-E323 IonicContact NH2-OE2 2.69Å; R278-E323 PolarHBondContact NH2-OE2 3.21Å
279	S	98.9	Very high	98.4	Very high	37 Å²	37	44.9 Å²	44.9	26%	0.259	20%	0.204	S	C	.	.	H	α-helix	trans	-59	-36.8	176.1	-66.1	0	0	0	0	112.2	G242 R275 A276 L277 Y281 W282 N283	G242-S279 CarbonylContact O-C 3.56Å; G242-S279 VanDerWaalsContact O-CB 3.27Å; G242-S279 WeakPolarHBondContact O-CB 3.33Å; R275-S279 PolarHBondContact O-N 2.78Å; R275-S279 PolarHBondContact O-OG 2.91Å; A276-S279 PolarHBondContact O-N 2.81Å; L277-S279 PolarHBondContact O-N 2.92Å; S279-Y281 VanDerWaalsContact C-N 3.32Å; S279-Y281 PolarHBondContact O-N 2.95Å; S279-W282 PolarHBondContact O-N 2.76Å; S279-N283 VanDerWaalsContact O-CB 3.26Å; S279-N283 WeakPolarHBondContact O-CB 3.33Å; S279-N283 PolarHBondContact O-N 2.92Å; S279-N283 PolarHBondContact O-OD1 3.03Å
280	C	98.9	Very high	98.5	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-58.4	-43.5	175.5	-62.6	0	0	0	0	112.2	G242 T260 V261 A276 L277 R278 S284 I301	G242-C280 PolarHBondContact O-N 3.21Å; T260-C280 HydrophobicContact CG2-CB 3.94Å; T260-C280 WeakPolarHBondContact OG1-CA 3.44Å; T260-C280 WeakPolarHBondContact OG1-CB 3.29Å; V261-C280 PolarHBondContact O-SG 3.28Å; A276-C280 PolarHBondContact O-N 2.93Å; A276-C280 PolarHBondContact O-SG 2.88Å; L277-C280 WeakPolarHBondContact O-CB 3.38Å; L277-C280 PolarHBondContact O-N 3.41Å; R278-C280 VanDerWaalsContact C-N 3.28Å; R278-C280 PolarHBondContact O-N 3.1Å; C280-S284 WeakPolarHBondContact O-CB 3.46Å; C280-S284 PolarHBondContact O-N 3.48Å; C280-S284 PolarHBondContact O-OG 3.44Å; C280-I301 HydrophobicContact CB-CD1 4.05Å; C280-I301 HydrophobicContact CB-CG2 4.33Å
281	Y	98.9	Very high	98.6	Very high	1 Å²	1	51.5 Å²	51.5	0%	0.004	23%	0.228	C	C	.	.	H	α-helix	trans	-70.5	-48.5	176.1	-69.2	-82.3	0	0	0	111.5	L277 R278 S279 S284 L285 F298 I301 A317 V321	L277-Y281 HydrophobicContact CD1-CD2 4.5Å; L277-Y281 HydrophobicContact CD1-CE2 3.81Å; L277-Y281 HydrophobicContact CG-CD2 4.49Å; L277-Y281 HydrophobicContact CG-CE2 4Å; L277-Y281 VanDerWaalsContact O-CD2 3.24Å; L277-Y281 WeakPolarHBondContact O-CD2 3.32Å; L277-Y281 PolarHBondContact O-N 2.94Å; R278-Y281 PolarHBondContact O-N 2.97Å; R278-Y281 VanDerWaalsContact O-N 3.16Å; S279-Y281 VanDerWaalsContact C-N 3.32Å; S279-Y281 PolarHBondContact O-N 2.95Å; Y281-S284 PolarHBondContact O-N 3.27Å; Y281-L285 VanDerWaalsContact O-CG 3.32Å; Y281-L285 WeakPolarHBondContact O-CG 3.15Å; Y281-L285 PolarHBondContact O-N 2.97Å; Y281-F298 HydrophobicContact CD1-CB 4.43Å; Y281-F298 AromaticContact CD1-CD1 3.28Å; Y281-F298 HydrophobicContact CD1-CD1 3.28Å; Y281-F298 HydrophobicContact CD1-CD2 4.44Å; Y281-F298 AromaticContact CD1-CE1 3.49Å; Y281-F298 HydrophobicContact CD1-CE1 3.49Å; Y281-F298 VanDerWaalsContact CD1-CE1 3.49Å; Y281-F298 AromaticContact CD1-CG 3.81Å; Y281-F298 HydrophobicContact CD1-CG 3.81Å; Y281-F298 HydrophobicContact CD1-CZ 4.18Å; Y281-F298 HydrophobicContact CE1-CB 3.95Å; Y281-F298 AromaticContact CE1-CD1 3.46Å; Y281-F298 HydrophobicContact CE1-CD1 3.46Å; Y281-F298 VanDerWaalsContact CE1-CD1 3.46Å; Y281-F298 HydrophobicContact CE1-CE1 4.15Å; Y281-F298 AromaticContact CE1-CG 3.83Å; Y281-F298 HydrophobicContact CE1-CG 3.83Å; Y281-F298 HydrophobicContact CG-CD1 4.36Å; Y281-F298 HydrophobicContact CG-CE1 4.23Å; Y281-I301 HydrophobicContact CD1-CD1 4.37Å; Y281-I301 HydrophobicContact CE1-CD1 4.01Å; Y281-I301 HydrophobicContact CE2-CB 4.42Å; Y281-I301 HydrophobicContact CE2-CD1 4.24Å; Y281-I301 PolarHBondContact OH-N 3.11Å; Y281-A317 HydrophobicContact CD1-CB 4.29Å; Y281-A317 HydrophobicContact CD2-CB 4.18Å; Y281-A317 HydrophobicContact CE1-CB 3.72Å; Y281-A317 HydrophobicContact CE2-CB 3.59Å; Y281-V321 HydrophobicContact CD1-CG2 4.35Å
282	W	98.9	Very high	98.6	Very high	81 Å²	81	50.6 Å²	50.6	31%	0.307	24%	0.238	S	C	.	.	H	α-helix	trans	-61.7	-54.4	-178.4	-176.2	-80.3	0	0	0	112.6	R278 S279 S284 L285 Q286 E323 F324	R278-W282 PolarHBondContact O-N 3.32Å; S279-W282 PolarHBondContact O-N 2.76Å; W282-S284 PolarHBondContact O-N 3.42Å; W282-L285 PolarHBondContact O-N 3.39Å; W282-L285 VanDerWaalsContact O-N 3.14Å; W282-Q286 WeakPolarHBondContact O-CB 3.09Å; W282-Q286 PolarHBondContact O-N 3.02Å; W282-E323 HydrophobicContact CZ3-CB 4.24Å; W282-F324 AromaticContact CD2-CD2 3.91Å; W282-F324 HydrophobicContact CD2-CD2 3.91Å; W282-F324 AromaticContact CE2-CD2 3.95Å; W282-F324 HydrophobicContact CE3-CB 3.93Å; W282-F324 AromaticContact CE3-CD2 3.99Å; W282-F324 HydrophobicContact CE3-CD2 3.99Å; W282-F324 HydrophobicContact CE3-CG 4.49Å; W282-F324 HydrophobicContact CG-CD2 4.48Å; W282-F324 HydrophobicContact CH2-CB 4.48Å; W282-F324 HydrophobicContact CH2-CD2 4.17Å; W282-F324 HydrophobicContact CZ2-CD2 4.08Å; W282-F324 HydrophobicContact CZ3-CB 3.84Å; W282-F324 HydrophobicContact CZ3-CD2 4.13Å; W282-F324 HydrophobicContact CZ3-CG 4.47Å
283	N	98.9	Very high	98.7	Very high	29 Å²	29	41.8 Å²	41.8	16%	0.155	21%	0.205	C	C	.	.	H	α-helix	trans	-66.6	-29	-176.6	-61.9	24.1	0	0	0	110.6	E243 A244 S279 T287	E243-N283 PolarHBondContact OE2-ND2 2.92Å; A244-N283 HydrophobicContact CB-CB 4.11Å; S279-N283 VanDerWaalsContact O-CB 3.26Å; S279-N283 WeakPolarHBondContact O-CB 3.33Å; S279-N283 PolarHBondContact O-N 2.92Å; S279-N283 PolarHBondContact O-OD1 3.03Å; N283-T287 VanDerWaalsContact O-CB 3.23Å; N283-T287 WeakPolarHBondContact O-CB 3.42Å; N283-T287 PolarHBondContact O-N 2.68Å; N283-T287 PolarHBondContact O-OG1 2.89Å
284	S	98.9	Very high	98.7	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-69.7	-42.6	171.8	-63.1	0	0	0	0	113	C280 Y281 W282 A288	C280-S284 WeakPolarHBondContact O-CB 3.46Å; C280-S284 PolarHBondContact O-N 3.48Å; C280-S284 PolarHBondContact O-OG 3.44Å; Y281-S284 PolarHBondContact O-N 3.27Å; W282-S284 PolarHBondContact O-N 3.42Å; S284-A288 WeakPolarHBondContact O-CB 3.49Å; S284-A288 PolarHBondContact O-N 3.26Å
285	L	98.9	Very high	98.7	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-64.8	-43	174.4	-70.1	168.3	0	0	0	111.3	Y281 W282 A288 T289 F298 V321 F324 L332 V335	Y281-L285 VanDerWaalsContact O-CG 3.32Å; Y281-L285 WeakPolarHBondContact O-CG 3.15Å; Y281-L285 PolarHBondContact O-N 2.97Å; W282-L285 PolarHBondContact O-N 3.39Å; W282-L285 VanDerWaalsContact O-N 3.14Å; L285-A288 WeakPolarHBondContact O-CB 3.38Å; L285-A288 PolarHBondContact O-N 2.99Å; L285-T289 WeakPolarHBondContact O-CG2 3.27Å; L285-T289 PolarHBondContact O-N 2.83Å; L285-T289 PolarHBondContact O-OG1 2.8Å; L285-F298 HydrophobicContact CD2-CE2 3.71Å; L285-F298 HydrophobicContact CD2-CZ 4.02Å; L285-F298 HydrophobicContact CG-CE2 4.06Å; L285-F298 HydrophobicContact CG-CZ 3.88Å; L285-V321 HydrophobicContact CD1-CB 4.49Å; L285-V321 HydrophobicContact CD1-CG2 4.1Å; L285-F324 VanDerWaalsContact C-CZ 3.47Å; L285-F324 HydrophobicContact CB-CD1 3.74Å; L285-F324 HydrophobicContact CB-CD2 3.72Å; L285-F324 HydrophobicContact CB-CE1 3.7Å; L285-F324 HydrophobicContact CB-CE2 3.66Å; L285-F324 HydrophobicContact CB-CG 3.76Å; L285-F324 HydrophobicContact CB-CZ 3.65Å; L285-F324 HydrophobicContact CD1-CB 3.6Å; L285-F324 HydrophobicContact CD1-CD1 3.84Å; L285-F324 HydrophobicContact CD1-CD2 4.2Å; L285-F324 HydrophobicContact CD1-CG 3.61Å; L285-F324 HydrophobicContact CG-CD1 4.26Å; L285-F324 HydrophobicContact CG-CG 4.3Å; L285-L332 HydrophobicContact CD2-CD1 3.76Å; L285-V335 HydrophobicContact CD2-CG1 4.36Å; L285-V335 HydrophobicContact CD2-CG2 3.86Å
286	Q	98.9	Very high	98.7	Very high	75 Å²	75	34 Å²	34	35%	0.35	18%	0.175	S	C	.	.	H	α-helix	trans	-57	-56.1	174.2	179	171.7	-14.9	0	0	110.4	W282 A288 T289 E290 F324	W282-Q286 WeakPolarHBondContact O-CB 3.09Å; W282-Q286 PolarHBondContact O-N 3.02Å; Q286-A288 VanDerWaalsContact C-N 3.26Å; Q286-A288 PolarHBondContact O-N 3.18Å; Q286-T289 PolarHBondContact O-N 2.69Å; Q286-T289 PolarHBondContact O-OG1 3.06Å; Q286-E290 HydrophobicContact CG-CG 4.31Å; Q286-E290 WeakPolarHBondContact CG-OE1 3.46Å; Q286-E290 PolarHBondContact NE2-OE1 3.3Å; Q286-E290 WeakPolarHBondContact O-CG 3.49Å; Q286-E290 PolarHBondContact O-N 3.07Å; Q286-F324 HydrophobicContact CB-CE2 4.05Å
287	T	98.9	Very high	98.8	Very high	17 Å²	17	33.3 Å²	33.3	10%	0.104	17%	0.17	C	C	.	.	H	α-helix	trans	-52.4	-42.3	177	-61.2	0	0	0	0	112	I246 I258 N283 N291	I246-T287 HydrophobicContact CB-CG2 3.71Å; I246-T287 HydrophobicContact CD1-CG2 4.36Å; I246-T287 HydrophobicContact CG2-CG2 4.14Å; I258-T287 HydrophobicContact CD1-CG2 4.26Å; I258-T287 HydrophobicContact CG1-CG2 4.28Å; I258-T287 HydrophobicContact CG2-CG2 4.19Å; N283-T287 VanDerWaalsContact O-CB 3.23Å; N283-T287 WeakPolarHBondContact O-CB 3.42Å; N283-T287 PolarHBondContact O-N 2.68Å; N283-T287 PolarHBondContact O-OG1 2.89Å; T287-N291 PolarHBondContact O-N 3.23Å; T287-N291 PolarHBondContact O-ND2 2.9Å
288	A	98.8	Very high	98.8	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-60.8	-52	176.1	0	0	0	0	0	111.6	I258 S284 L285 Q286 E290 N291 A292 A293 V296	I258-A288 HydrophobicContact CD1-CB 3.6Å; S284-A288 WeakPolarHBondContact O-CB 3.49Å; S284-A288 PolarHBondContact O-N 3.26Å; L285-A288 WeakPolarHBondContact O-CB 3.38Å; L285-A288 PolarHBondContact O-N 2.99Å; Q286-A288 VanDerWaalsContact C-N 3.26Å; Q286-A288 PolarHBondContact O-N 3.18Å; A288-E290 VanDerWaalsContact C-N 3.34Å; A288-E290 PolarHBondContact O-N 3.3Å; A288-N291 CarbonylContact O-C 3.58Å; A288-N291 PolarHBondContact O-N 2.62Å; A288-N291 VanDerWaalsContact O-N 3.11Å; A288-A292 PolarHBondContact O-N 3.46Å; A288-A293 HydrophobicContact CB-CB 4.08Å; A288-A293 WeakPolarHBondContact O-CB 3.42Å; A288-A293 PolarHBondContact O-N 3.28Å; A288-V296 HydrophobicContact CB-CG2 3.49Å; A288-V296 VanDerWaalsContact CB-CG2 3.49Å
289	T	98.6	Very high	98.8	Very high	22 Å²	22	30.7 Å²	30.7	14%	0.135	16%	0.161	C	C	.	.	H	α-helix	trans	-67.5	-32	-177.8	62.9	0	0	0	0	113.6	L285 Q286 N291 A292 F324 K331 L332	L285-T289 WeakPolarHBondContact O-CG2 3.27Å; L285-T289 PolarHBondContact O-N 2.83Å; L285-T289 PolarHBondContact O-OG1 2.8Å; Q286-T289 PolarHBondContact O-N 2.69Å; Q286-T289 PolarHBondContact O-OG1 3.06Å; T289-N291 VanDerWaalsContact C-N 3.26Å; T289-N291 PolarHBondContact O-N 2.96Å; T289-A292 PolarHBondContact O-N 2.76Å; T289-F324 HydrophobicContact CG2-CE1 3.94Å; T289-F324 HydrophobicContact CG2-CZ 3.92Å; T289-K331 HydrophobicContact CG2-CB 3.58Å; T289-K331 HydrophobicContact CG2-CD 4.02Å; T289-K331 HydrophobicContact CG2-CG 4.47Å; T289-L332 HydrophobicContact CG2-CD1 4.21Å; T289-L332 HydrophobicContact CG2-CD2 3.77Å; T289-L332 HydrophobicContact CG2-CG 3.76Å
290	E	98.6	Very high	98.8	Very high	128 Å²	128	30 Å²	30	60%	0.598	16%	0.156	S	C	*	.	H	α-helix	trans	-67.1	-27.1	173.4	-72.4	172.7	173.8	0	0	112.3	Q286 A288	Q286-E290 HydrophobicContact CG-CG 4.31Å; Q286-E290 WeakPolarHBondContact CG-OE1 3.46Å; Q286-E290 PolarHBondContact NE2-OE1 3.3Å; Q286-E290 WeakPolarHBondContact O-CG 3.49Å; Q286-E290 PolarHBondContact O-N 3.07Å; A288-E290 VanDerWaalsContact C-N 3.34Å; A288-E290 PolarHBondContact O-N 3.3Å
291	N	98.3	Very high	98.7	Very high	62 Å²	62	30 Å²	30	33%	0.332	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	18.4	174.6	-69.7	-97.4	0	0	0	112.6	I246 T287 A288 T289 A293	I246-N291 HydrophobicContact CD1-CB 3.71Å; T287-N291 PolarHBondContact O-N 3.23Å; T287-N291 PolarHBondContact O-ND2 2.9Å; A288-N291 CarbonylContact O-C 3.58Å; A288-N291 PolarHBondContact O-N 2.62Å; A288-N291 VanDerWaalsContact O-N 3.11Å; T289-N291 VanDerWaalsContact C-N 3.26Å; T289-N291 PolarHBondContact O-N 2.96Å; N291-A293 PolarHBondContact O-N 3.46Å; N291-A293 VanDerWaalsContact O-N 3.07Å
292	A	98.1	Very high	98.7	Very high	80 Å²	80	30.3 Å²	30.3	66%	0.661	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.9	20.4	-179.5	0	0	0	0	0	115.7	A288 T289 R294	A288-A292 PolarHBondContact O-N 3.46Å; T289-A292 PolarHBondContact O-N 2.76Å; A292-R294 PolarHBondContact O-N 2.72Å
293	A	98.5	Very high	98.6	Very high	1 Å²	1	28 Å²	28	1%	0.008	15%	0.153	C	C	.	.			trans	-73.7	123.6	171.3	0	0	0	0	0	109.6	D201 A202 Y256 A288 N291 L332	D201-A293 HydrophobicContact CB-CB 3.53Å; A202-A293 HydrophobicContact CB-CB 4.2Å; Y256-A293 HydrophobicContact CD2-CB 4.36Å; A288-A293 HydrophobicContact CB-CB 4.08Å; A288-A293 WeakPolarHBondContact O-CB 3.42Å; A288-A293 PolarHBondContact O-N 3.28Å; N291-A293 PolarHBondContact O-N 3.46Å; N291-A293 VanDerWaalsContact O-N 3.07Å; A293-L332 WeakPolarHBondContact O-CD2 3.41Å
294	R	98.7	Very high	98.3	Very high	94 Å²	94	29.1 Å²	29.1	36%	0.355	17%	0.172	S	C	.	.			trans	-100.4	-20.1	-175.7	-58.3	-171.6	59.7	75.9	5.8	112.7	D201 A292 D330 K331 L332 D333 R334	D201-R294 WeakPolarHBondContact OD2-CA 3.33Å; D201-R294 PolarHBondContact OD2-N 2.84Å; A292-R294 PolarHBondContact O-N 2.72Å; R294-D330 PolarHBondContact NH1-O 3.4Å; R294-D330 PolarHBondContact NH2-O 3.07Å; R294-K331 PolarHBondContact NH1-O 2.93Å; R294-L332 CarbonylContact O-C 3.59Å; R294-L332 WeakPolarHBondContact O-CA 3.22Å; R294-D333 HydrophobicContact CB-CB 4.49Å; R294-D333 IonicContact CZ-OD1 3.56Å; R294-D333 IonicContact CZ-OD2 3.79Å; R294-D333 IonicContact NE-OD1 2.74Å; R294-D333 IonicContact NE-OD2 3.04Å; R294-D333 PolarHBondContact NE-OD2 3.27Å; R294-D333 IonicContact NH2-OD1 3.45Å; R294-D333 PolarHBondContact NH2-OD1 3.17Å; R294-D333 IonicContact NH2-OD2 3.64Å; R294-D333 PolarHBondContact NH2-OD2 2.95Å; R294-D333 PolarHBondContact O-N 2.66Å; R294-R334 PolarHBondContact O-N 3.21Å
295	S	98.9	Very high	98	Very high	6 Å²	6	35.8 Å²	35.8	4%	0.042	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	121.3	179.5	52.3	0	0	0	0	111.5	D201 A202 R334	D201-S295 WeakPolarHBondContact CB-O 3.47Å; D201-S295 VanDerWaalsContact CG-OG 3.27Å; D201-S295 PolarHBondContact N-O 2.84Å; D201-S295 PolarHBondContact N-OG 3.11Å; D201-S295 PolarHBondContact OD2-N 2.72Å; D201-S295 PolarHBondContact OD2-OG 2.9Å; A202-S295 PolarHBondContact N-O 3.34Å; S295-R334 WeakPolarHBondContact CA-O 3.41Å
296	V	98.9	Very high	97.8	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	129.1	-172.4	-171.9	0	0	0	0	110.9	A202 V204 A288 F298 L332 R334 V335 I336	A202-V296 VanDerWaalsContact O-CA 3.31Å; A202-V296 WeakPolarHBondContact O-CA 3.39Å; V204-V296 HydrophobicContact CG2-CG1 3.84Å; A288-V296 HydrophobicContact CB-CG2 3.49Å; A288-V296 VanDerWaalsContact CB-CG2 3.49Å; V296-F298 HydrophobicContact CB-CE2 4.37Å; V296-F298 HydrophobicContact CG1-CD2 4.12Å; V296-F298 HydrophobicContact CG1-CE2 3.54Å; V296-F298 HydrophobicContact CG1-CZ 4.09Å; V296-L332 HydrophobicContact CG2-CD2 3.9Å; V296-R334 PolarHBondContact N-O 2.95Å; V296-V335 CarbonylContact O-C 3.39Å; V296-V335 WeakPolarHBondContact O-CA 3.32Å; V296-I336 PolarHBondContact O-N 3.04Å
297	A	98.9	Very high	97.7	Very high	0 Å²	0	36 Å²	36	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	136.1	172	0	0	0	0	0	113.1	I195 L198 I200 A202 I203 V204 I336 C338	I195-A297 HydrophobicContact CD1-CB 4.16Å; I195-A297 HydrophobicContact CG1-CB 4.21Å; L198-A297 HydrophobicContact CD1-CB 3.54Å; I200-A297 HydrophobicContact CD1-CB 3.44Å; I200-A297 VanDerWaalsContact CD1-CB 3.44Å; A202-A297 PolarHBondContact O-N 3.22Å; I203-A297 HydrophobicContact CG2-CB 4.35Å; V204-A297 WeakPolarHBondContact CB-O 3.25Å; V204-A297 WeakPolarHBondContact CG2-O 3.39Å; V204-A297 PolarHBondContact N-O 3.15Å; A297-I336 CarbonylContact C-O 3.47Å; A297-I336 VanDerWaalsContact CA-O 3.31Å; A297-I336 WeakPolarHBondContact CA-O 3.4Å; A297-I336 HydrophobicContact CB-CB 3.95Å; A297-I336 HydrophobicContact CB-CD1 4.42Å; A297-I336 HydrophobicContact CB-CG2 4.46Å; A297-C338 HydrophobicContact CB-CB 4.39Å
298	F	98.9	Very high	97.7	Very high	1 Å²	1	35.2 Å²	35.2	0%	0.004	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	131.8	178.5	-75.7	-90.8	0	0	0	111.7	V204 Y281 L285 V296 I301 V335 I336 C338	V204-F298 HydrophobicContact CB-CD1 3.93Å; V204-F298 HydrophobicContact CB-CE1 4.14Å; V204-F298 HydrophobicContact CB-CG 4.44Å; V204-F298 HydrophobicContact CG1-CD1 3.93Å; V204-F298 HydrophobicContact CG1-CE1 3.99Å; V204-F298 HydrophobicContact CG2-CD1 3.81Å; V204-F298 HydrophobicContact CG2-CD2 4.44Å; V204-F298 HydrophobicContact CG2-CE1 3.62Å; V204-F298 HydrophobicContact CG2-CE2 4.26Å; V204-F298 HydrophobicContact CG2-CG 4.23Å; V204-F298 HydrophobicContact CG2-CZ 3.85Å; Y281-F298 HydrophobicContact CD1-CB 4.43Å; Y281-F298 AromaticContact CD1-CD1 3.28Å; Y281-F298 HydrophobicContact CD1-CD1 3.28Å; Y281-F298 HydrophobicContact CD1-CD2 4.44Å; Y281-F298 AromaticContact CD1-CE1 3.49Å; Y281-F298 HydrophobicContact CD1-CE1 3.49Å; Y281-F298 VanDerWaalsContact CD1-CE1 3.49Å; Y281-F298 AromaticContact CD1-CG 3.81Å; Y281-F298 HydrophobicContact CD1-CG 3.81Å; Y281-F298 HydrophobicContact CD1-CZ 4.18Å; Y281-F298 HydrophobicContact CE1-CB 3.95Å; Y281-F298 AromaticContact CE1-CD1 3.46Å; Y281-F298 HydrophobicContact CE1-CD1 3.46Å; Y281-F298 VanDerWaalsContact CE1-CD1 3.46Å; Y281-F298 HydrophobicContact CE1-CE1 4.15Å; Y281-F298 AromaticContact CE1-CG 3.83Å; Y281-F298 HydrophobicContact CE1-CG 3.83Å; Y281-F298 HydrophobicContact CG-CD1 4.36Å; Y281-F298 HydrophobicContact CG-CE1 4.23Å; L285-F298 HydrophobicContact CD2-CE2 3.71Å; L285-F298 HydrophobicContact CD2-CZ 4.02Å; L285-F298 HydrophobicContact CG-CE2 4.06Å; L285-F298 HydrophobicContact CG-CZ 3.88Å; V296-F298 HydrophobicContact CB-CE2 4.37Å; V296-F298 HydrophobicContact CG1-CD2 4.12Å; V296-F298 HydrophobicContact CG1-CE2 3.54Å; V296-F298 HydrophobicContact CG1-CZ 4.09Å; F298-I301 HydrophobicContact CD1-CD1 3.99Å; F298-I301 HydrophobicContact CE1-CD1 4.43Å; F298-V335 HydrophobicContact CD2-CG1 3.89Å; F298-V335 HydrophobicContact CE2-CG1 3.99Å; F298-I336 PolarHBondContact N-O 3.46Å; F298-C338 WeakPolarHBondContact O-CA 3.39Å; F298-C338 WeakPolarHBondContact O-CB 3.43Å; F298-C338 PolarHBondContact O-N 2.86Å
299	P	98.8	Very high	97.6	Very high	10 Å²	10	37.2 Å²	37.2	7%	0.065	22%	0.223	C	C	.	.			trans	-78.7	172.9	162.1	36.1	-34.4	0	0	0	110.1	I195 V204 A206 V217 I301	I195-P299 HydrophobicContact CD1-CB 4.24Å; I195-P299 HydrophobicContact CD1-CG 4.35Å; V204-P299 WeakPolarHBondContact O-CD 3.32Å; V204-P299 WeakPolarHBondContact O-CG 3.45Å; A206-P299 HydrophobicContact CB-CG 4.16Å; V217-P299 HydrophobicContact CG1-CB 4.42Å; V217-P299 HydrophobicContact CG1-CG 4.45Å; V217-P299 HydrophobicContact CG2-CB 4.29Å; P299-I301 HydrophobicContact CG-CG1 4.43Å; P299-I301 PolarHBondContact O-N 3.37Å
300	C	98.4	Very high	97.6	Very high	23 Å²	23	37.9 Å²	37.9	16%	0.155	23%	0.228	C	C	.	.			trans	-69.8	88.4	170.7	-53.2	0	0	0	0	110.7	S302 T303 D344	C300-S302 PolarHBondContact O-N 3.11Å; C300-T303 HydrophobicContact CB-CG2 4.12Å; C300-T303 WeakPolarHBondContact CB-OG1 3.25Å; C300-T303 PolarHBondContact O-OG1 3.22Å; C300-D344 PolarHBondContact SG-OD2 3.39Å
301	I	98.7	Very high	97.5	Very high	0 Å²	0	37 Å²	37	0%	0	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	136.1	-178.2	-61	170.8	0	0	0	110.1	V204 A206 T260 L277 C280 Y281 F298 P299 T303	V204-I301 HydrophobicContact CG1-CD1 4.21Å; A206-I301 HydrophobicContact CB-CG1 4.19Å; T260-I301 HydrophobicContact CG2-CD1 3.68Å; L277-I301 HydrophobicContact CD1-CB 3.9Å; L277-I301 HydrophobicContact CD1-CG2 3.69Å; C280-I301 HydrophobicContact CB-CD1 4.05Å; C280-I301 HydrophobicContact CB-CG2 4.33Å; Y281-I301 HydrophobicContact CD1-CD1 4.37Å; Y281-I301 HydrophobicContact CE1-CD1 4.01Å; Y281-I301 HydrophobicContact CE2-CB 4.42Å; Y281-I301 HydrophobicContact CE2-CD1 4.24Å; Y281-I301 PolarHBondContact OH-N 3.11Å; F298-I301 HydrophobicContact CD1-CD1 3.99Å; F298-I301 HydrophobicContact CE1-CD1 4.43Å; P299-I301 HydrophobicContact CG-CG1 4.43Å; P299-I301 PolarHBondContact O-N 3.37Å; I301-T303 PolarHBondContact O-N 3.14Å
302	S	97.9	Very high	97.5	Very high	7 Å²	7	38 Å²	38	5%	0.049	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.7	-6.6	-179.1	-70.2	0	0	0	0	119	G262 P263 C300 G304 Y306 G307 Y308	G262-S302 VanDerWaalsContact C-OG 3.3Å; G262-S302 VanDerWaalsContact CA-OG 3.25Å; G262-S302 WeakPolarHBondContact CA-OG 3.35Å; P263-S302 WeakPolarHBondContact CD-OG 3.36Å; P263-S302 WeakPolarHBondContact O-CB 3.49Å; P263-S302 PolarHBondContact O-OG 2.97Å; C300-S302 PolarHBondContact O-N 3.11Å; S302-G304 VanDerWaalsContact C-N 3.28Å; S302-G304 PolarHBondContact O-N 2.95Å; S302-Y306 CarbonylContact O-C 3.15Å; S302-G307 PolarHBondContact O-N 3.19Å; S302-Y308 PolarHBondContact O-N 3.27Å
303	T	96.7	Very high	97.5	Very high	33 Å²	33	34.3 Å²	34.3	20%	0.202	20%	0.196	C	C	.	.	S	Bend	trans	-74.3	-14.8	-177.8	65.9	0	0	0	0	114.7	C300 I301 Y308 P310 A313	C300-T303 HydrophobicContact CB-CG2 4.12Å; C300-T303 WeakPolarHBondContact CB-OG1 3.25Å; C300-T303 PolarHBondContact O-OG1 3.22Å; I301-T303 PolarHBondContact O-N 3.14Å; T303-Y308 WeakPolarHBondContact CA-O 3.48Å; T303-P310 HydrophobicContact CG2-CB 4.38Å; T303-P310 HydrophobicContact CG2-CG 4.34Å; T303-A313 HydrophobicContact CG2-CB 3.55Å
304	G	93.3	Very high	97.5	Very high	53 Å²	53	34.4 Å²	34.4	55%	0.546	20%	0.196	S	C	.	.	S	Bend	trans	-79.2	-130.5	173	0	0	0	0	0	112.9	S302 Y306 G307	S302-G304 VanDerWaalsContact C-N 3.28Å; S302-G304 PolarHBondContact O-N 2.95Å; G304-Y306 PolarHBondContact O-N 3.46Å; G304-G307 PolarHBondContact O-N 3.41Å
305	I	93.2	Very high	97.5	Very high	139 Å²	139	32 Å²	32	71%	0.713	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-16.9	-175.7	59.3	167.7	0	0	0	115.3	Q266 G307	Q266-I305 PolarHBondContact NE2-O 2.95Å; I305-G307 VanDerWaalsContact C-N 3.33Å
306	Y	94.9	Very high	97.4	Very high	43 Å²	43	33 Å²	33	17%	0.169	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-9.5	176.1	-74.2	4.4	0	0	0	113.2	N208 G262 I264 A265 S302 G304 Y308	N208-Y306 WeakPolarHBondContact CA-OH 3.44Å; N208-Y306 WeakPolarHBondContact CB-OH 3.48Å; G262-Y306 WeakPolarHBondContact O-CD2 2.92Å; G262-Y306 WeakPolarHBondContact O-CE2 3.23Å; I264-Y306 HydrophobicContact CD1-CD1 4.37Å; I264-Y306 HydrophobicContact CD1-CE1 4.21Å; I264-Y306 HydrophobicContact CG1-CD1 3.78Å; I264-Y306 HydrophobicContact CG1-CD2 3.95Å; I264-Y306 HydrophobicContact CG1-CE1 4.02Å; I264-Y306 HydrophobicContact CG1-CE2 4.18Å; I264-Y306 HydrophobicContact CG1-CG 3.74Å; A265-Y306 PolarHBondContact N-O 3.01Å; S302-Y306 CarbonylContact O-C 3.15Å; G304-Y306 PolarHBondContact O-N 3.46Å; Y306-Y308 PolarHBondContact O-N 3.37Å
307	G	96.3	Very high	97.4	Very high	36 Å²	36	33 Å²	33	37%	0.371	19%	0.193	S	C	.	.			trans	75.2	21.1	163.3	0	0	0	0	0	116.2	S302 G304 I305	S302-G307 PolarHBondContact O-N 3.19Å; G304-G307 PolarHBondContact O-N 3.41Å; I305-G307 VanDerWaalsContact C-N 3.33Å
308	Y	98	Very high	97.4	Very high	1 Å²	1	33 Å²	33	0%	0.004	19%	0.193	C	C	.	.			trans	-76.4	123.9	176.4	-154.7	-66.5	0	0	0	110.1	P263 A265 V269 E273 R274 L277 S302 T303 Y306 Q312 A313	P263-Y308 HydrophobicContact CG-CD2 4.12Å; P263-Y308 HydrophobicContact CG-CE2 4.19Å; A265-Y308 HydrophobicContact CB-CD2 3.95Å; A265-Y308 HydrophobicContact CB-CG 4.24Å; V269-Y308 HydrophobicContact CG1-CE1 4.18Å; V269-Y308 HydrophobicContact CG1-CE2 4.04Å; V269-Y308 WeakPolarHBondContact CG1-OH 3.46Å; V269-Y308 HydrophobicContact CG2-CD1 4.2Å; V269-Y308 HydrophobicContact CG2-CD2 4.36Å; V269-Y308 HydrophobicContact CG2-CE1 4.04Å; V269-Y308 HydrophobicContact CG2-CE2 4.2Å; V269-Y308 HydrophobicContact CG2-CG 4.38Å; E273-Y308 HydrophobicContact CB-CE2 4.17Å; R274-Y308 WeakPolarHBondContact CA-OH 3.22Å; R274-Y308 WeakPolarHBondContact CG-OH 3.23Å; L277-Y308 HydrophobicContact CB-CE2 4.04Å; L277-Y308 HydrophobicContact CD2-CD1 4Å; L277-Y308 HydrophobicContact CD2-CD2 4.01Å; L277-Y308 HydrophobicContact CD2-CE1 3.68Å; L277-Y308 HydrophobicContact CD2-CE2 3.69Å; L277-Y308 HydrophobicContact CD2-CG 4.15Å; L277-Y308 HydrophobicContact CG-CE2 4.47Å; S302-Y308 PolarHBondContact O-N 3.27Å; T303-Y308 WeakPolarHBondContact CA-O 3.48Å; Y306-Y308 PolarHBondContact O-N 3.37Å; Y308-Q312 HydrophobicContact CD1-CB 4.45Å; Y308-Q312 HydrophobicContact CE1-CB 3.82Å; Y308-A313 HydrophobicContact CD1-CB 3.72Å; Y308-A313 HydrophobicContact CE1-CB 4.11Å
309	P	97.5	Very high	97.4	Very high	42 Å²	42	33.1 Å²	33.1	27%	0.273	19%	0.194	S	C	.	.			trans	-56	122.5	-179.5	-26.4	35.3	0	0	0	112.2	V269 E311 Q312 A313	V269-P309 HydrophobicContact CG2-CG 4.19Å; P309-E311 PolarHBondContact O-N 3.05Å; P309-Q312 HydrophobicContact CB-CB 4.38Å; P309-Q312 HydrophobicContact CB-CG 4.25Å; P309-Q312 PolarHBondContact O-N 3.08Å; P309-A313 PolarHBondContact O-N 3.33Å
310	P	97.4	Very high	97.4	Very high	36 Å²	36	32.7 Å²	32.7	23%	0.234	19%	0.191	C	C	.	.	H	α-helix	trans	-54	-36.8	-177.5	-28.1	35.4	0	0	0	114	T303 Q312 A313 V314 L347	T303-P310 HydrophobicContact CG2-CB 4.38Å; T303-P310 HydrophobicContact CG2-CG 4.34Å; P310-Q312 PolarHBondContact O-N 2.9Å; P310-A313 PolarHBondContact O-N 3.32Å; P310-V314 WeakPolarHBondContact O-CB 3.37Å; P310-V314 WeakPolarHBondContact O-CG1 3.14Å; P310-V314 PolarHBondContact O-N 2.82Å; P310-L347 HydrophobicContact CB-CD1 3.59Å
311	E	97	Very high	97.4	Very high	111 Å²	111	31.6 Å²	31.6	52%	0.519	18%	0.184	S	C	.	.	H	α-helix	trans	-66.1	-24.3	-179.6	-49.9	76.3	-168.2	0	0	112.3	P309 L347	P309-E311 PolarHBondContact O-N 3.05Å; E311-L347 HydrophobicContact CG-CD1 4.25Å; E311-L347 HydrophobicContact CG-CD2 4.12Å
312	Q	97.7	Very high	97.4	Very high	81 Å²	81	32 Å²	32	38%	0.379	19%	0.186	S	C	.	.	H	α-helix	trans	-95.1	-37.3	173.3	-61	-178.1	37.9	0	0	111.1	Y308 P309 P310 V314 H315 E316	Y308-Q312 HydrophobicContact CD1-CB 4.45Å; Y308-Q312 HydrophobicContact CE1-CB 3.82Å; P309-Q312 HydrophobicContact CB-CB 4.38Å; P309-Q312 HydrophobicContact CB-CG 4.25Å; P309-Q312 PolarHBondContact O-N 3.08Å; P310-Q312 PolarHBondContact O-N 2.9Å; Q312-V314 VanDerWaalsContact C-N 3.35Å; Q312-V314 PolarHBondContact O-N 3.17Å; Q312-H315 PolarHBondContact O-N 3.12Å; Q312-E316 PolarHBondContact O-N 3.47Å
313	A	98.3	Very high	97.4	Very high	3 Å²	3	34.9 Å²	34.9	3%	0.025	20%	0.198	C	C	.	.	H	α-helix	trans	-62.2	-40.4	179.9	0	0	0	0	0	112.4	L277 T303 Y308 P309 P310 H315 E316 A317	L277-A313 HydrophobicContact CD2-CB 3.93Å; T303-A313 HydrophobicContact CG2-CB 3.55Å; Y308-A313 HydrophobicContact CD1-CB 3.72Å; Y308-A313 HydrophobicContact CE1-CB 4.11Å; P309-A313 PolarHBondContact O-N 3.33Å; P310-A313 PolarHBondContact O-N 3.32Å; A313-H315 PolarHBondContact O-N 3.23Å; A313-E316 PolarHBondContact O-N 3.04Å; A313-A317 WeakPolarHBondContact O-CB 3.43Å; A313-A317 PolarHBondContact O-N 3.17Å
314	V	98.5	Very high	97.5	Very high	3 Å²	3	33.4 Å²	33.4	2%	0.018	19%	0.189	C	C	.	.	H	α-helix	trans	-59.6	-35.2	178	68.7	0	0	0	0	112.2	P310 Q312 L318 L347 Y348 N351	P310-V314 WeakPolarHBondContact O-CB 3.37Å; P310-V314 WeakPolarHBondContact O-CG1 3.14Å; P310-V314 PolarHBondContact O-N 2.82Å; Q312-V314 VanDerWaalsContact C-N 3.35Å; Q312-V314 PolarHBondContact O-N 3.17Å; V314-L318 HydrophobicContact CG2-CD1 3.88Å; V314-L318 HydrophobicContact CG2-CG 4.31Å; V314-L318 WeakPolarHBondContact O-CB 3.4Å; V314-L318 VanDerWaalsContact O-CG 3.23Å; V314-L318 WeakPolarHBondContact O-CG 3.38Å; V314-L318 PolarHBondContact O-N 3.29Å; V314-L347 HydrophobicContact CG1-CB 4.49Å; V314-Y348 HydrophobicContact CG2-CD1 3.76Å; V314-Y348 HydrophobicContact CG2-CD2 4.03Å; V314-Y348 HydrophobicContact CG2-CE1 3.91Å; V314-Y348 HydrophobicContact CG2-CE2 4.2Å; V314-Y348 HydrophobicContact CG2-CG 3.82Å; V314-N351 HydrophobicContact CG2-CB 4.35Å
315	H	98.2	Very high	97.8	Very high	45 Å²	45	30.9 Å²	30.9	21%	0.208	16%	0.163	C	C	.	.	H	α-helix	trans	-69.5	-40	177.6	-80	-24.5	0	0	0	113	R177 Q312 A313 A319 N351 Y355	R177-H315 PolarHBondContact NH1-CD2 3.43Å; R177-H315 PolarHBondContact NH1-CE1 2.97Å; R177-H315 VanDerWaalsContact NH1-CE1 3.27Å; R177-H315 PolarHBondContact NH1-ND1 2.84Å; R177-H315 PolarHBondContact NH1-NE2 3.08Å; R177-H315 PolarHBondContact NH2-CE1 3.39Å; R177-H315 VanDerWaalsContact NH2-CE1 3.26Å; R177-H315 PolarHBondContact NH2-NE2 3.26Å; Q312-H315 PolarHBondContact O-N 3.12Å; A313-H315 PolarHBondContact O-N 3.23Å; H315-A319 WeakPolarHBondContact O-CB 3.15Å; H315-A319 PolarHBondContact O-N 3.13Å; H315-N351 PolarHBondContact CE1-OD1 3.06Å; H315-Y355 VanDerWaalsContact CA-OH 3.31Å; H315-Y355 WeakPolarHBondContact CA-OH 3.49Å; H315-Y355 WeakPolarHBondContact CB-OH 3.41Å; H315-Y355 AromaticContact ND1-CE2 3.83Å; H315-Y355 PolarHBondContact ND1-OH 3.05Å; H315-Y355 PolarHBondContact O-OH 3.2Å
316	E	98.6	Very high	98	Very high	27 Å²	27	27 Å²	27	13%	0.126	14%	0.144	C	C	.	.	H	α-helix	trans	-72.7	-38	177.7	-56.5	-58.3	174.8	0	0	111.7	R274 L277 R278 Q312 A313 A320	R274-E316 WeakPolarHBondContact CB-OE1 3.5Å; R274-E316 WeakPolarHBondContact CD-OE1 3.25Å; R274-E316 VanDerWaalsContact CG-OE1 3.31Å; R274-E316 WeakPolarHBondContact CG-OE1 3.26Å; L277-E316 HydrophobicContact CD2-CB 4.04Å; L277-E316 HydrophobicContact CD2-CG 4.32Å; L277-E316 HydrophobicContact CG-CB 4.26Å; R278-E316 WeakPolarHBondContact CD-OE2 3.48Å; R278-E316 HydrophobicContact CG-CB 3.91Å; R278-E316 HydrophobicContact CG-CG 4.31Å; R278-E316 WeakPolarHBondContact CG-OE2 3.39Å; R278-E316 IonicContact CZ-OE2 2.72Å; R278-E316 IonicContact NE-OE2 3.72Å; R278-E316 IonicContact NH1-OE2 3.76Å; R278-E316 PolarHBondContact NH1-OE2 3.35Å; Q312-E316 PolarHBondContact O-N 3.47Å; A313-E316 PolarHBondContact O-N 3.04Å; E316-A320 WeakPolarHBondContact O-CB 3.35Å; E316-A320 PolarHBondContact O-N 3.19Å
317	A	98.8	Very high	98.1	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-60.8	-52.5	174.9	0	0	0	0	0	111.9	Y281 A313 A319 V321 F337 Y348	Y281-A317 HydrophobicContact CD1-CB 4.29Å; Y281-A317 HydrophobicContact CD2-CB 4.18Å; Y281-A317 HydrophobicContact CE1-CB 3.72Å; Y281-A317 HydrophobicContact CE2-CB 3.59Å; A313-A317 WeakPolarHBondContact O-CB 3.43Å; A313-A317 PolarHBondContact O-N 3.17Å; A317-A319 PolarHBondContact O-N 3.33Å; A317-V321 WeakPolarHBondContact O-CB 3.47Å; A317-V321 VanDerWaalsContact O-CG2 3.27Å; A317-V321 WeakPolarHBondContact O-CG2 3.37Å; A317-V321 PolarHBondContact O-N 3.08Å; A317-V321 VanDerWaalsContact O-N 3.11Å; A317-F337 HydrophobicContact CB-CE1 4.3Å; A317-Y348 HydrophobicContact CB-CE1 4.27Å; A317-Y348 VanDerWaalsContact CB-OH 3.3Å; A317-Y348 WeakPolarHBondContact CB-OH 3.4Å
318	L	98.6	Very high	98.2	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-65.7	-37.6	179.7	-70.2	175.2	0	0	0	112.3	V314 R322 F337 Y348 N351 L352 Y355 F356	V314-L318 HydrophobicContact CG2-CD1 3.88Å; V314-L318 HydrophobicContact CG2-CG 4.31Å; V314-L318 WeakPolarHBondContact O-CB 3.4Å; V314-L318 VanDerWaalsContact O-CG 3.23Å; V314-L318 WeakPolarHBondContact O-CG 3.38Å; V314-L318 PolarHBondContact O-N 3.29Å; L318-R322 WeakPolarHBondContact O-CB 3.25Å; L318-R322 PolarHBondContact O-N 2.91Å; L318-F337 HydrophobicContact CD2-CD2 4.37Å; L318-F337 HydrophobicContact CD2-CE1 4.49Å; L318-F337 HydrophobicContact CD2-CE2 3.65Å; L318-F337 HydrophobicContact CD2-CZ 3.72Å; L318-Y348 HydrophobicContact CD2-CD1 4.02Å; L318-Y348 HydrophobicContact CD2-CE1 4.17Å; L318-Y348 HydrophobicContact CG-CD1 4.24Å; L318-Y348 HydrophobicContact CG-CE1 4.21Å; L318-N351 HydrophobicContact CD1-CB 3.67Å; L318-L352 HydrophobicContact CD1-CG 4.48Å; L318-L352 HydrophobicContact CD2-CD2 3.47Å; L318-L352 VanDerWaalsContact CD2-CD2 3.47Å; L318-L352 HydrophobicContact CD2-CG 3.9Å; L318-Y355 HydrophobicContact CB-CD1 3.85Å; L318-Y355 HydrophobicContact CB-CD2 3.56Å; L318-Y355 HydrophobicContact CB-CE1 4.05Å; L318-Y355 HydrophobicContact CB-CE2 3.78Å; L318-Y355 HydrophobicContact CB-CG 3.59Å; L318-Y355 HydrophobicContact CD1-CD2 3.68Å; L318-Y355 HydrophobicContact CD1-CE2 3.95Å; L318-Y355 HydrophobicContact CD1-CG 4.43Å; L318-Y355 HydrophobicContact CG-CD2 4.24Å; L318-F356 HydrophobicContact CD2-CE2 4.35Å
319	A	98.5	Very high	98.1	Very high	2 Å²	2	29.8 Å²	29.8	2%	0.017	16%	0.158	C	C	.	.	H	α-helix	trans	-63.9	-53.4	177	0	0	0	0	0	112.2	H315 A317 V321 R322 E323 Y355	H315-A319 WeakPolarHBondContact O-CB 3.15Å; H315-A319 PolarHBondContact O-N 3.13Å; A317-A319 PolarHBondContact O-N 3.33Å; A319-V321 PolarHBondContact O-N 2.95Å; A319-R322 PolarHBondContact O-N 3.14Å; A319-E323 WeakPolarHBondContact O-CB 3.44Å; A319-E323 WeakPolarHBondContact O-CG 3.37Å; A319-E323 PolarHBondContact O-N 3.31Å; A319-Y355 VanDerWaalsContact CA-CE1 3.48Å; A319-Y355 HydrophobicContact CB-CD1 4.4Å; A319-Y355 HydrophobicContact CB-CE1 3.66Å
320	A	98.8	Very high	98.1	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.008	17%	0.169	C	C	.	.	H	α-helix	trans	-63.9	-40.4	-176.9	0	0	0	0	0	112.1	R278 E316 F324	R278-A320 HydrophobicContact CB-CB 4.41Å; E316-A320 WeakPolarHBondContact O-CB 3.35Å; E316-A320 PolarHBondContact O-N 3.19Å; A320-F324 VanDerWaalsContact O-CB 3.31Å; A320-F324 WeakPolarHBondContact O-CB 3.46Å; A320-F324 PolarHBondContact O-N 2.9Å
321	V	98.8	Very high	98.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-66	-41.6	174.5	172.3	0	0	0	0	111.4	I188 Y281 L285 A317 A319 L325 V335 F337 F356	I188-V321 HydrophobicContact CD1-CG1 3.93Å; Y281-V321 HydrophobicContact CD1-CG2 4.35Å; L285-V321 HydrophobicContact CD1-CB 4.49Å; L285-V321 HydrophobicContact CD1-CG2 4.1Å; A317-V321 WeakPolarHBondContact O-CB 3.47Å; A317-V321 VanDerWaalsContact O-CG2 3.27Å; A317-V321 WeakPolarHBondContact O-CG2 3.37Å; A317-V321 PolarHBondContact O-N 3.08Å; A317-V321 VanDerWaalsContact O-N 3.11Å; A319-V321 PolarHBondContact O-N 2.95Å; V321-L325 HydrophobicContact CG1-CD1 3.79Å; V321-L325 HydrophobicContact CG1-CG 4.43Å; V321-L325 WeakPolarHBondContact O-CB 3.42Å; V321-L325 VanDerWaalsContact O-CG 3.28Å; V321-L325 WeakPolarHBondContact O-CG 3.39Å; V321-L325 PolarHBondContact O-N 3.33Å; V321-V335 HydrophobicContact CG1-CB 4.07Å; V321-V335 HydrophobicContact CG1-CG1 3.76Å; V321-V335 HydrophobicContact CG1-CG2 4.28Å; V321-V335 HydrophobicContact CG2-CG1 4.13Å; V321-F337 HydrophobicContact CB-CZ 3.91Å; V321-F337 HydrophobicContact CG1-CZ 3.92Å; V321-F337 HydrophobicContact CG2-CE1 3.88Å; V321-F337 HydrophobicContact CG2-CZ 3.74Å; V321-F356 HydrophobicContact CG1-CZ 4.32Å
322	R	98.3	Very high	98.2	Very high	10 Å²	10	29.3 Å²	29.3	4%	0.038	15%	0.15	C	C	.	.	H	α-helix	trans	-63.4	-48.6	178.4	173	57	-155.8	-112.2	6.5	112.1	Y178 L179 L318 A319 L325 D326 Y355 F356	Y178-R322 HydrophobicContact CD1-CG 3.61Å; Y178-R322 HydrophobicContact CD2-CG 4.24Å; Y178-R322 HydrophobicContact CE1-CG 3.78Å; Y178-R322 HydrophobicContact CE2-CG 4.43Å; Y178-R322 HydrophobicContact CG-CG 3.87Å; L179-R322 PolarHBondContact O-NH1 2.78Å; L179-R322 PolarHBondContact O-NH2 3.49Å; L318-R322 WeakPolarHBondContact O-CB 3.25Å; L318-R322 PolarHBondContact O-N 2.91Å; A319-R322 PolarHBondContact O-N 3.14Å; R322-L325 PolarHBondContact O-N 2.84Å; R322-D326 IonicContact CZ-OD1 3.88Å; R322-D326 IonicContact CZ-OD2 3.41Å; R322-D326 VanDerWaalsContact CZ-OD2 3.26Å; R322-D326 VanDerWaalsContact NE-CG 3.3Å; R322-D326 IonicContact NE-OD1 2.67Å; R322-D326 PolarHBondContact NE-OD1 3.42Å; R322-D326 IonicContact NE-OD2 3.28Å; R322-D326 PolarHBondContact NE-OD2 3.44Å; R322-D326 VanDerWaalsContact NH2-CG 3.33Å; R322-D326 IonicContact NH2-OD1 2.66Å; R322-D326 PolarHBondContact NH2-OD1 3.21Å; R322-D326 IonicContact NH2-OD2 2.71Å; R322-D326 PolarHBondContact NH2-OD2 3.36Å; R322-D326 PolarHBondContact O-N 2.88Å; R322-Y355 HydrophobicContact CB-CD1 4.45Å; R322-Y355 VanDerWaalsContact CD-O 3.31Å; R322-Y355 WeakPolarHBondContact CD-O 3.07Å; R322-Y355 PolarHBondContact NH1-O 3.47Å; R322-F356 HydrophobicContact CB-CE1 4.27Å; R322-F356 HydrophobicContact CB-CE2 4.01Å; R322-F356 HydrophobicContact CB-CZ 3.65Å; R322-F356 HydrophobicContact CG-CZ 4.34Å
323	E	98.6	Very high	98.2	Very high	67 Å²	67	28.8 Å²	28.8	31%	0.313	15%	0.15	S	C	.	.	H	α-helix	trans	-64.4	-41.5	-179.6	-72.9	157.5	-149.8	0	0	111.9	Y178 R278 W282 A319 A327	Y178-E323 HydrophobicContact CE1-CG 3.96Å; Y178-E323 PolarHBondContact OH-OE1 3.03Å; R278-E323 IonicContact CZ-OE1 2.62Å; R278-E323 IonicContact CZ-OE2 3.46Å; R278-E323 IonicContact NH2-OE1 3.23Å; R278-E323 PolarHBondContact NH2-OE1 3.48Å; R278-E323 IonicContact NH2-OE2 2.69Å; R278-E323 PolarHBondContact NH2-OE2 3.21Å; W282-E323 HydrophobicContact CZ3-CB 4.24Å; A319-E323 WeakPolarHBondContact O-CB 3.44Å; A319-E323 WeakPolarHBondContact O-CG 3.37Å; A319-E323 PolarHBondContact O-N 3.31Å; E323-A327 PolarHBondContact O-N 2.88Å
324	F	98.8	Very high	98.3	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.009	16%	0.155	C	C	.	.	H	α-helix	trans	-64.2	-41.9	175	-172.2	-81.3	0	0	0	111.7	W282 L285 Q286 T289 A320 A327 H328 L332	W282-F324 AromaticContact CD2-CD2 3.91Å; W282-F324 HydrophobicContact CD2-CD2 3.91Å; W282-F324 AromaticContact CE2-CD2 3.95Å; W282-F324 HydrophobicContact CE3-CB 3.93Å; W282-F324 AromaticContact CE3-CD2 3.99Å; W282-F324 HydrophobicContact CE3-CD2 3.99Å; W282-F324 HydrophobicContact CE3-CG 4.49Å; W282-F324 HydrophobicContact CG-CD2 4.48Å; W282-F324 HydrophobicContact CH2-CB 4.48Å; W282-F324 HydrophobicContact CH2-CD2 4.17Å; W282-F324 HydrophobicContact CZ2-CD2 4.08Å; W282-F324 HydrophobicContact CZ3-CB 3.84Å; W282-F324 HydrophobicContact CZ3-CD2 4.13Å; W282-F324 HydrophobicContact CZ3-CG 4.47Å; L285-F324 VanDerWaalsContact C-CZ 3.47Å; L285-F324 HydrophobicContact CB-CD1 3.74Å; L285-F324 HydrophobicContact CB-CD2 3.72Å; L285-F324 HydrophobicContact CB-CE1 3.7Å; L285-F324 HydrophobicContact CB-CE2 3.66Å; L285-F324 HydrophobicContact CB-CG 3.76Å; L285-F324 HydrophobicContact CB-CZ 3.65Å; L285-F324 HydrophobicContact CD1-CB 3.6Å; L285-F324 HydrophobicContact CD1-CD1 3.84Å; L285-F324 HydrophobicContact CD1-CD2 4.2Å; L285-F324 HydrophobicContact CD1-CG 3.61Å; L285-F324 HydrophobicContact CG-CD1 4.26Å; L285-F324 HydrophobicContact CG-CG 4.3Å; Q286-F324 HydrophobicContact CB-CE2 4.05Å; T289-F324 HydrophobicContact CG2-CE1 3.94Å; T289-F324 HydrophobicContact CG2-CZ 3.92Å; A320-F324 VanDerWaalsContact O-CB 3.31Å; A320-F324 WeakPolarHBondContact O-CB 3.46Å; A320-F324 PolarHBondContact O-N 2.9Å; F324-A327 PolarHBondContact O-N 3.49Å; F324-H328 HydrophobicContact CD1-CB 4.05Å; F324-H328 AromaticContact CD2-CD2 3.96Å; F324-H328 HydrophobicContact CE1-CB 3.67Å; F324-H328 AromaticContact CE1-CD2 3.84Å; F324-H328 AromaticContact CE2-CD2 3.64Å; F324-H328 HydrophobicContact CZ-CB 4.2Å; F324-H328 AromaticContact CZ-CD2 3.57Å; F324-H328 WeakPolarHBondContact O-CB 3.39Å; F324-H328 PolarHBondContact O-N 2.91Å; F324-L332 HydrophobicContact CD1-CD1 4.06Å; F324-L332 HydrophobicContact CE1-CD1 3.74Å
325	L	98.5	Very high	98.3	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-70.4	-36.9	-179.8	-76.7	173.9	0	0	0	113.2	L184 K187 I188 V321 R322 A327 H328 H329 L332 V335 F356	L184-L325 HydrophobicContact CD1-CB 4.19Å; L184-L325 HydrophobicContact CD2-CB 3.79Å; K187-L325 HydrophobicContact CB-CD1 4.27Å; I188-L325 HydrophobicContact CD1-CD1 3.63Å; V321-L325 HydrophobicContact CG1-CD1 3.79Å; V321-L325 HydrophobicContact CG1-CG 4.43Å; V321-L325 WeakPolarHBondContact O-CB 3.42Å; V321-L325 VanDerWaalsContact O-CG 3.28Å; V321-L325 WeakPolarHBondContact O-CG 3.39Å; V321-L325 PolarHBondContact O-N 3.33Å; R322-L325 PolarHBondContact O-N 2.84Å; L325-A327 PolarHBondContact O-N 2.92Å; L325-H328 PolarHBondContact O-N 3.35Å; L325-H329 WeakPolarHBondContact O-CA 3.48Å; L325-H329 WeakPolarHBondContact O-CB 3.36Å; L325-H329 PolarHBondContact O-N 3.28Å; L325-H329 PolarHBondContact O-ND1 3.25Å; L325-L332 HydrophobicContact CD2-CB 4.23Å; L325-L332 HydrophobicContact CD2-CD1 4.03Å; L325-V335 HydrophobicContact CD1-CG2 4.21Å; L325-V335 HydrophobicContact CD2-CG2 4.28Å; L325-V335 HydrophobicContact CG-CG2 4.5Å; L325-F356 HydrophobicContact CD1-CE1 4.2Å; L325-F356 HydrophobicContact CD1-CZ 4.4Å
326	D	97.7	Very high	98.3	Very high	57 Å²	57	27.9 Å²	27.9	31%	0.305	14%	0.144	S	C	.	.	H	α-helix	trans	-55.3	-38.4	171.7	-82.9	-36.3	0	0	0	111.1	N181 R322	N181-D326 PolarHBondContact ND2-OD1 2.93Å; R322-D326 IonicContact CZ-OD1 3.88Å; R322-D326 IonicContact CZ-OD2 3.41Å; R322-D326 VanDerWaalsContact CZ-OD2 3.26Å; R322-D326 VanDerWaalsContact NE-CG 3.3Å; R322-D326 IonicContact NE-OD1 2.67Å; R322-D326 PolarHBondContact NE-OD1 3.42Å; R322-D326 IonicContact NE-OD2 3.28Å; R322-D326 PolarHBondContact NE-OD2 3.44Å; R322-D326 VanDerWaalsContact NH2-CG 3.33Å; R322-D326 IonicContact NH2-OD1 2.66Å; R322-D326 PolarHBondContact NH2-OD1 3.21Å; R322-D326 IonicContact NH2-OD2 2.71Å; R322-D326 PolarHBondContact NH2-OD2 3.36Å; R322-D326 PolarHBondContact O-N 2.88Å
327	A	97.3	Very high	98.3	Very high	54 Å²	54	26.7 Å²	26.7	45%	0.446	14%	0.138	S	C	.	.	H	α-helix	trans	-80.3	-31.1	176.7	0	0	0	0	0	115.1	E323 F324 L325	E323-A327 PolarHBondContact O-N 2.88Å; F324-A327 PolarHBondContact O-N 3.49Å; L325-A327 PolarHBondContact O-N 2.92Å
328	H	97.9	Very high	98.3	Very high	52 Å²	52	27 Å²	27	24%	0.241	14%	0.14	C	C	.	.	H	α-helix	trans	-139.7	23.8	-162.4	-56.7	-36.3	0	0	0	115.7	F324 L325 D330 K331	F324-H328 HydrophobicContact CD1-CB 4.05Å; F324-H328 AromaticContact CD2-CD2 3.96Å; F324-H328 HydrophobicContact CE1-CB 3.67Å; F324-H328 AromaticContact CE1-CD2 3.84Å; F324-H328 AromaticContact CE2-CD2 3.64Å; F324-H328 HydrophobicContact CZ-CB 4.2Å; F324-H328 AromaticContact CZ-CD2 3.57Å; F324-H328 WeakPolarHBondContact O-CB 3.39Å; F324-H328 PolarHBondContact O-N 2.91Å; L325-H328 PolarHBondContact O-N 3.35Å; H328-D330 VanDerWaalsContact C-OD1 3.3Å; H328-D330 PolarHBondContact O-N 2.88Å; H328-D330 VanDerWaalsContact O-N 3.07Å; H328-K331 HydrophobicContact CB-CD 4.31Å; H328-K331 HydrophobicContact CB-CG 4.49Å; H328-K331 PolarHBondContact O-N 3.28Å
329	H	96.6	Very high	98.3	Very high	33 Å²	33	27 Å²	27	15%	0.153	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-18.4	178.4	56.5	-81.8	0	0	0	116.1	R183 L184 K187 L325 L332	R183-H329 WeakPolarHBondContact CD-NE2 3.23Å; R183-H329 PolarHBondContact NH1-CE1 3.06Å; R183-H329 PolarHBondContact NH1-NE2 2.96Å; L184-H329 HydrophobicContact CD2-CB 3.63Å; K187-H329 VanDerWaalsContact CE-O 3.23Å; K187-H329 WeakPolarHBondContact CE-O 3.29Å; K187-H329 PolarHBondContact NZ-O 3.21Å; L325-H329 WeakPolarHBondContact O-CA 3.48Å; L325-H329 WeakPolarHBondContact O-CB 3.36Å; L325-H329 PolarHBondContact O-N 3.28Å; L325-H329 PolarHBondContact O-ND1 3.25Å; H329-L332 VanDerWaalsContact O-O 3.06Å
330	D	97.6	Very high	98.1	Very high	94 Å²	94	34.6 Å²	34.6	50%	0.503	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-32.7	175.5	62.8	-57.8	0	0	0	112.5	R294 H328	R294-D330 PolarHBondContact NH1-O 3.4Å; R294-D330 PolarHBondContact NH2-O 3.07Å; H328-D330 VanDerWaalsContact C-OD1 3.3Å; H328-D330 PolarHBondContact O-N 2.88Å; H328-D330 VanDerWaalsContact O-N 3.07Å
331	K	98.2	Very high	98	Very high	83 Å²	83	38.7 Å²	38.7	36%	0.361	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-24.3	-176.5	-55.6	-171.3	-173.3	173.5	0	113.5	T289 R294 H328	T289-K331 HydrophobicContact CG2-CB 3.58Å; T289-K331 HydrophobicContact CG2-CD 4.02Å; T289-K331 HydrophobicContact CG2-CG 4.47Å; R294-K331 PolarHBondContact NH1-O 2.93Å; H328-K331 HydrophobicContact CB-CD 4.31Å; H328-K331 HydrophobicContact CB-CG 4.49Å; H328-K331 PolarHBondContact O-N 3.28Å
332	L	98.3	Very high	97.9	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.005	23%	0.229	C	C	.	.			trans	-119.1	136.6	-176.2	-65	173.1	0	0	0	111.1	K187 L285 T289 A293 R294 V296 F324 L325 H329 V335	K187-L332 WeakPolarHBondContact CD-O 3.18Å; K187-L332 WeakPolarHBondContact CE-O 3.14Å; K187-L332 PolarHBondContact NZ-O 2.93Å; L285-L332 HydrophobicContact CD2-CD1 3.76Å; T289-L332 HydrophobicContact CG2-CD1 4.21Å; T289-L332 HydrophobicContact CG2-CD2 3.77Å; T289-L332 HydrophobicContact CG2-CG 3.76Å; A293-L332 WeakPolarHBondContact O-CD2 3.41Å; R294-L332 CarbonylContact O-C 3.59Å; R294-L332 WeakPolarHBondContact O-CA 3.22Å; V296-L332 HydrophobicContact CG2-CD2 3.9Å; F324-L332 HydrophobicContact CD1-CD1 4.06Å; F324-L332 HydrophobicContact CE1-CD1 3.74Å; L325-L332 HydrophobicContact CD2-CB 4.23Å; L325-L332 HydrophobicContact CD2-CD1 4.03Å; H329-L332 VanDerWaalsContact O-O 3.06Å; L332-V335 HydrophobicContact CD1-CG2 3.96Å
333	D	98.3	Very high	97.8	Very high	70 Å²	70	47.7 Å²	47.7	37%	0.374	25%	0.253	S	S	.	.	S	Bend	trans	-94.4	-33.4	172.7	-64.7	-37	0	0	0	112.4	K187 R294	K187-D333 WeakPolarHBondContact CD-O 3.27Å; K187-D333 IonicContact NZ-OD1 2.69Å; R294-D333 HydrophobicContact CB-CB 4.49Å; R294-D333 IonicContact CZ-OD1 3.56Å; R294-D333 IonicContact CZ-OD2 3.79Å; R294-D333 IonicContact NE-OD1 2.74Å; R294-D333 IonicContact NE-OD2 3.04Å; R294-D333 PolarHBondContact NE-OD2 3.27Å; R294-D333 IonicContact NH2-OD1 3.45Å; R294-D333 PolarHBondContact NH2-OD1 3.17Å; R294-D333 IonicContact NH2-OD2 3.64Å; R294-D333 PolarHBondContact NH2-OD2 2.95Å; R294-D333 PolarHBondContact O-N 2.66Å
334	R	98.6	Very high	97.7	Very high	33 Å²	33	45 Å²	45	13%	0.125	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	134.4	176	-158.6	73.7	64.5	69.9	9.1	113	L160 I163 Q186 K187 S189 R294 S295 V296 I336	L160-R334 HydrophobicContact CD1-CB 3.93Å; L160-R334 HydrophobicContact CD1-CG 4.16Å; I163-R334 PolarHBondContact O-NH1 3.01Å; Q186-R334 PolarHBondContact O-NE 3.44Å; K187-R334 CarbonylContact O-C 3.55Å; K187-R334 WeakPolarHBondContact O-CA 3.18Å; S189-R334 WeakPolarHBondContact OG-CD 3.4Å; S189-R334 PolarHBondContact OG-NH1 3.41Å; R294-R334 PolarHBondContact O-N 3.21Å; S295-R334 WeakPolarHBondContact CA-O 3.41Å; V296-R334 PolarHBondContact N-O 2.95Å; R334-I336 HydrophobicContact CB-CG1 4.42Å; R334-I336 HydrophobicContact CG-CD1 4.37Å; R334-I336 HydrophobicContact CG-CG1 3.7Å
335	V	98.9	Very high	97.7	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	128.6	160.6	-174.5	0	0	0	0	108.4	K187 I188 S189 L285 V296 F298 V321 L325 L332	K187-V335 PolarHBondContact O-N 3.15Å; I188-V335 WeakPolarHBondContact CA-O 3.26Å; I188-V335 HydrophobicContact CD1-CB 4.31Å; S189-V335 PolarHBondContact N-O 3.23Å; L285-V335 HydrophobicContact CD2-CG1 4.36Å; L285-V335 HydrophobicContact CD2-CG2 3.86Å; V296-V335 CarbonylContact O-C 3.39Å; V296-V335 WeakPolarHBondContact O-CA 3.32Å; F298-V335 HydrophobicContact CD2-CG1 3.89Å; F298-V335 HydrophobicContact CE2-CG1 3.99Å; V321-V335 HydrophobicContact CG1-CB 4.07Å; V321-V335 HydrophobicContact CG1-CG1 3.76Å; V321-V335 HydrophobicContact CG1-CG2 4.28Å; V321-V335 HydrophobicContact CG2-CG1 4.13Å; L325-V335 HydrophobicContact CD1-CG2 4.21Å; L325-V335 HydrophobicContact CD2-CG2 4.28Å; L325-V335 HydrophobicContact CG-CG2 4.5Å; L332-V335 HydrophobicContact CD1-CG2 3.96Å
336	I	98.9	Very high	97.6	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	118.4	-171.1	-51.1	167.2	0	0	0	109	L160 I163 S189 I200 V296 A297 F298 R334 C338	L160-I336 HydrophobicContact CD1-CD1 3.95Å; I163-I336 HydrophobicContact CD1-CD1 3.77Å; I163-I336 HydrophobicContact CG2-CD1 4.37Å; I163-I336 HydrophobicContact CG2-CG2 4.21Å; S189-I336 WeakPolarHBondContact O-CA 3.49Å; I200-I336 HydrophobicContact CD1-CD1 4.2Å; I200-I336 HydrophobicContact CG2-CD1 4.12Å; V296-I336 PolarHBondContact O-N 3.04Å; A297-I336 CarbonylContact C-O 3.47Å; A297-I336 VanDerWaalsContact CA-O 3.31Å; A297-I336 WeakPolarHBondContact CA-O 3.4Å; A297-I336 HydrophobicContact CB-CB 3.95Å; A297-I336 HydrophobicContact CB-CD1 4.42Å; A297-I336 HydrophobicContact CB-CG2 4.46Å; F298-I336 PolarHBondContact N-O 3.46Å; R334-I336 HydrophobicContact CB-CG1 4.42Å; R334-I336 HydrophobicContact CG-CD1 4.37Å; R334-I336 HydrophobicContact CG-CG1 3.7Å; I336-C338 PolarHBondContact O-N 3.43Å
337	F	98.8	Very high	97.5	Very high	1 Å²	1	52.3 Å²	52.3	0%	0.004	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	99	168	-60.3	-72	0	0	0	108.4	I188 S189 Y191 A317 L318 V321 V339 Y348	I188-F337 HydrophobicContact CD1-CE2 4.39Å; I188-F337 HydrophobicContact CG2-CD2 4.14Å; I188-F337 HydrophobicContact CG2-CE2 3.99Å; S189-F337 PolarHBondContact O-N 2.96Å; Y191-F337 PolarHBondContact N-O 3.02Å; A317-F337 HydrophobicContact CB-CE1 4.3Å; L318-F337 HydrophobicContact CD2-CD2 4.37Å; L318-F337 HydrophobicContact CD2-CE1 4.49Å; L318-F337 HydrophobicContact CD2-CE2 3.65Å; L318-F337 HydrophobicContact CD2-CZ 3.72Å; V321-F337 HydrophobicContact CB-CZ 3.91Å; V321-F337 HydrophobicContact CG1-CZ 3.92Å; V321-F337 HydrophobicContact CG2-CE1 3.88Å; V321-F337 HydrophobicContact CG2-CZ 3.74Å; F337-V339 PolarHBondContact O-N 3.48Å; F337-Y348 HydrophobicContact CB-CD1 3.93Å; F337-Y348 HydrophobicContact CB-CE1 3.87Å; F337-Y348 HydrophobicContact CB-CG 4.38Å; F337-Y348 HydrophobicContact CD1-CD1 4.01Å; F337-Y348 AromaticContact CD1-CE1 3.23Å; F337-Y348 HydrophobicContact CD1-CE1 3.23Å; F337-Y348 AromaticContact CD1-CZ 3.71Å; F337-Y348 HydrophobicContact CD2-CD1 4.06Å; F337-Y348 HydrophobicContact CD2-CE1 4.07Å; F337-Y348 AromaticContact CE1-CE1 3.69Å; F337-Y348 HydrophobicContact CE1-CE1 3.69Å; F337-Y348 HydrophobicContact CE2-CE1 4.45Å; F337-Y348 AromaticContact CG-CD1 3.72Å; F337-Y348 HydrophobicContact CG-CD1 3.72Å; F337-Y348 AromaticContact CG-CE1 3.44Å; F337-Y348 HydrophobicContact CG-CE1 3.44Å; F337-Y348 VanDerWaalsContact CG-CE1 3.44Å; F337-Y348 HydrophobicContact CZ-CE1 4.27Å
338	C	98.8	Very high	97.5	Very high	6 Å²	6	50.1 Å²	50.1	4%	0.041	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	82.5	-178.6	-174.6	0	0	0	0	109.9	Y191 I195 L198 A297 F298 I336	Y191-C338 CarbonylContact O-C 3.47Å; Y191-C338 WeakPolarHBondContact O-CA 3.42Å; I195-C338 HydrophobicContact CB-CB 4.31Å; I195-C338 VanDerWaalsContact CB-SG 3.54Å; I195-C338 HydrophobicContact CD1-CB 4.02Å; I195-C338 HydrophobicContact CG1-CB 3.98Å; L198-C338 HydrophobicContact CD1-CB 4.29Å; A297-C338 HydrophobicContact CB-CB 4.39Å; F298-C338 WeakPolarHBondContact O-CA 3.39Å; F298-C338 WeakPolarHBondContact O-CB 3.43Å; F298-C338 PolarHBondContact O-N 2.86Å; I336-C338 PolarHBondContact O-N 3.43Å
339	V	98	Very high	97.4	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.006	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	146.2	-179.8	-63.5	0	0	0	0	111.5	V190 Y191 S192 G193 F337 D344 K345 Y348	V190-V339 HydrophobicContact CG1-CG2 4.17Å; Y191-V339 VanDerWaalsContact O-CG2 3.29Å; Y191-V339 WeakPolarHBondContact O-CG2 3.18Å; Y191-V339 PolarHBondContact O-N 3.05Å; S192-V339 WeakPolarHBondContact CA-O 3.18Å; G193-V339 PolarHBondContact N-O 3.1Å; G193-V339 VanDerWaalsContact N-O 3.08Å; F337-V339 PolarHBondContact O-N 3.48Å; V339-D344 HydrophobicContact CB-CB 3.93Å; V339-D344 HydrophobicContact CG1-CB 3.89Å; V339-K345 HydrophobicContact CG2-CB 3.75Å; V339-K345 HydrophobicContact CG2-CG 4.05Å; V339-Y348 HydrophobicContact CG1-CD2 3.45Å; V339-Y348 VanDerWaalsContact CG1-CD2 3.45Å; V339-Y348 HydrophobicContact CG1-CE2 3.79Å; V339-Y348 HydrophobicContact CG1-CG 4.29Å
340	F	94.9	Very high	97.3	Very high	161 Å²	161	54.2 Å²	54.2	71%	0.706	27%	0.274	S	S	*	.			trans	-104.4	-39.4	176.5	-170.1	-101	0	0	0	112.5
341	L	95.9	Very high	97.2	Very high	87 Å²	87	50.9 Å²	50.9	46%	0.455	26%	0.256	S	S	.	.	S	Bend	trans	-89.5	143.3	179.7	-57.6	178	0	0	0	111.4	T343 D344 K345	L341-T343 WeakPolarHBondContact CB-OG1 3.39Å; L341-T343 PolarHBondContact O-N 3.4Å; L341-D344 HydrophobicContact CB-CB 4.41Å; L341-D344 PolarHBondContact O-N 3.31Å; L341-K345 PolarHBondContact O-N 3.47Å
342	P	96.3	Very high	97	Very high	110 Å²	110	47 Å²	47	71%	0.714	24%	0.239	S	C	*	.	H	α-helix	trans	-59.1	-32.4	173	-25.3	35.1	0	0	0	113.4	K345 E346	P342-K345 WeakPolarHBondContact O-CB 3.42Å; P342-K345 PolarHBondContact O-N 3.49Å; P342-E346 PolarHBondContact O-N 3.4Å; P342-E346 VanDerWaalsContact O-N 3.13Å
343	T	96.9	Very high	96.8	Very high	90 Å²	90	48.2 Å²	48.2	55%	0.552	25%	0.247	S	C	*	.	H	α-helix	trans	-63.1	-43.2	174.9	47.6	0	0	0	0	112.2	L341 K345 E346 L347	L341-T343 WeakPolarHBondContact CB-OG1 3.39Å; L341-T343 PolarHBondContact O-N 3.4Å; T343-K345 VanDerWaalsContact C-N 3.32Å; T343-K345 PolarHBondContact O-N 2.98Å; T343-E346 PolarHBondContact O-N 2.65Å; T343-L347 WeakPolarHBondContact O-CG 3.44Å; T343-L347 PolarHBondContact O-N 2.93Å
344	D	97.1	Very high	96.5	Very high	9 Å²	9	45.8 Å²	45.8	5%	0.048	23%	0.234	C	C	.	.	H	α-helix	trans	-63.2	-42.2	176.7	-59.4	-13	0	0	0	110.1	C300 V339 L341 E346 L347 Y348	C300-D344 PolarHBondContact SG-OD2 3.39Å; V339-D344 HydrophobicContact CB-CB 3.93Å; V339-D344 HydrophobicContact CG1-CB 3.89Å; L341-D344 HydrophobicContact CB-CB 4.41Å; L341-D344 PolarHBondContact O-N 3.31Å; D344-E346 VanDerWaalsContact C-N 3.33Å; D344-E346 PolarHBondContact O-N 3.35Å; D344-L347 PolarHBondContact O-N 3.39Å; D344-Y348 WeakPolarHBondContact O-CD2 3.47Å; D344-Y348 PolarHBondContact O-N 3.24Å
345	K	97.3	Very high	96.4	Very high	84 Å²	84	44.5 Å²	44.5	37%	0.365	23%	0.229	S	C	.	.	H	α-helix	trans	-55.9	-48.7	176.6	-165.7	-168.4	-169.8	150.4	0	111.7	V190 S192 V339 L341 P342 T343 Y348 L349	V190-K345 HydrophobicContact CG1-CG 4.11Å; S192-K345 WeakPolarHBondContact OG-CD 3.43Å; S192-K345 VanDerWaalsContact OG-CE 3.22Å; S192-K345 WeakPolarHBondContact OG-CE 3.47Å; S192-K345 PolarHBondContact OG-NZ 3.31Å; S192-K345 VanDerWaalsContact OG-NZ 3.12Å; V339-K345 HydrophobicContact CG2-CB 3.75Å; V339-K345 HydrophobicContact CG2-CG 4.05Å; L341-K345 PolarHBondContact O-N 3.47Å; P342-K345 WeakPolarHBondContact O-CB 3.42Å; P342-K345 PolarHBondContact O-N 3.49Å; T343-K345 VanDerWaalsContact C-N 3.32Å; T343-K345 PolarHBondContact O-N 2.98Å; K345-Y348 PolarHBondContact O-N 3.39Å; K345-L349 HydrophobicContact CD-CD1 4.28Å; K345-L349 HydrophobicContact CG-CD1 3.99Å; K345-L349 HydrophobicContact CG-CG 4.46Å; K345-L349 WeakPolarHBondContact O-CG 3.32Å; K345-L349 PolarHBondContact O-N 2.99Å
346	E	96.6	Very high	96.1	Very high	100 Å²	100	45 Å²	45	47%	0.467	23%	0.231	S	C	.	.	H	α-helix	trans	-63.1	-45	-179.8	-173	58.8	-157	0	0	110.9	P342 T343 D344 Y348 L349 Q350	P342-E346 PolarHBondContact O-N 3.4Å; P342-E346 VanDerWaalsContact O-N 3.13Å; T343-E346 PolarHBondContact O-N 2.65Å; D344-E346 VanDerWaalsContact C-N 3.33Å; D344-E346 PolarHBondContact O-N 3.35Å; E346-Y348 PolarHBondContact O-N 2.88Å; E346-L349 PolarHBondContact O-N 2.68Å; E346-Q350 HydrophobicContact CG-CG 4.36Å; E346-Q350 WeakPolarHBondContact O-CB 3.37Å; E346-Q350 VanDerWaalsContact O-CG 3.27Å; E346-Q350 WeakPolarHBondContact O-CG 3.39Å; E346-Q350 PolarHBondContact O-N 2.85Å; E346-Q350 WeakPolarHBondContact OE1-CG 3.39Å; E346-Q350 PolarHBondContact OE1-NE2 2.94Å
347	L	96.9	Very high	95.8	Very high	30 Å²	30	45.6 Å²	45.6	16%	0.157	24%	0.235	C	C	.	.	H	α-helix	trans	-58.3	-43.6	174.8	-72.5	172.4	0	0	0	112.6	P310 E311 V314 T343 D344 N351	P310-L347 HydrophobicContact CB-CD1 3.59Å; E311-L347 HydrophobicContact CG-CD1 4.25Å; E311-L347 HydrophobicContact CG-CD2 4.12Å; V314-L347 HydrophobicContact CG1-CB 4.49Å; T343-L347 WeakPolarHBondContact O-CG 3.44Å; T343-L347 PolarHBondContact O-N 2.93Å; D344-L347 PolarHBondContact O-N 3.39Å; L347-N351 WeakPolarHBondContact O-CB 3.35Å; L347-N351 PolarHBondContact O-N 2.97Å; L347-N351 PolarHBondContact O-ND2 3.13Å
348	Y	97.5	Very high	95.1	Very high	8 Å²	8	46.9 Å²	46.9	3%	0.031	24%	0.243	C	C	.	.	H	α-helix	trans	-64.7	-46.7	175.9	-89.2	-81.6	0	0	0	111.9	V314 A317 L318 F337 V339 D344 K345 E346 N351 L352	V314-Y348 HydrophobicContact CG2-CD1 3.76Å; V314-Y348 HydrophobicContact CG2-CD2 4.03Å; V314-Y348 HydrophobicContact CG2-CE1 3.91Å; V314-Y348 HydrophobicContact CG2-CE2 4.2Å; V314-Y348 HydrophobicContact CG2-CG 3.82Å; A317-Y348 HydrophobicContact CB-CE1 4.27Å; A317-Y348 VanDerWaalsContact CB-OH 3.3Å; A317-Y348 WeakPolarHBondContact CB-OH 3.4Å; L318-Y348 HydrophobicContact CD2-CD1 4.02Å; L318-Y348 HydrophobicContact CD2-CE1 4.17Å; L318-Y348 HydrophobicContact CG-CD1 4.24Å; L318-Y348 HydrophobicContact CG-CE1 4.21Å; F337-Y348 HydrophobicContact CB-CD1 3.93Å; F337-Y348 HydrophobicContact CB-CE1 3.87Å; F337-Y348 HydrophobicContact CB-CG 4.38Å; F337-Y348 HydrophobicContact CD1-CD1 4.01Å; F337-Y348 AromaticContact CD1-CE1 3.23Å; F337-Y348 HydrophobicContact CD1-CE1 3.23Å; F337-Y348 AromaticContact CD1-CZ 3.71Å; F337-Y348 HydrophobicContact CD2-CD1 4.06Å; F337-Y348 HydrophobicContact CD2-CE1 4.07Å; F337-Y348 AromaticContact CE1-CE1 3.69Å; F337-Y348 HydrophobicContact CE1-CE1 3.69Å; F337-Y348 HydrophobicContact CE2-CE1 4.45Å; F337-Y348 AromaticContact CG-CD1 3.72Å; F337-Y348 HydrophobicContact CG-CD1 3.72Å; F337-Y348 AromaticContact CG-CE1 3.44Å; F337-Y348 HydrophobicContact CG-CE1 3.44Å; F337-Y348 VanDerWaalsContact CG-CE1 3.44Å; F337-Y348 HydrophobicContact CZ-CE1 4.27Å; V339-Y348 HydrophobicContact CG1-CD2 3.45Å; V339-Y348 VanDerWaalsContact CG1-CD2 3.45Å; V339-Y348 HydrophobicContact CG1-CE2 3.79Å; V339-Y348 HydrophobicContact CG1-CG 4.29Å; D344-Y348 WeakPolarHBondContact O-CD2 3.47Å; D344-Y348 PolarHBondContact O-N 3.24Å; K345-Y348 PolarHBondContact O-N 3.39Å; E346-Y348 PolarHBondContact O-N 2.88Å; Y348-N351 PolarHBondContact O-N 2.95Å; Y348-L352 WeakPolarHBondContact O-CB 3.37Å; Y348-L352 WeakPolarHBondContact O-CD1 3.43Å; Y348-L352 VanDerWaalsContact O-CG 3.23Å; Y348-L352 WeakPolarHBondContact O-CG 3.42Å; Y348-L352 PolarHBondContact O-N 3.48Å
349	L	95.3	Very high	94.1	Very high	59 Å²	59	52.5 Å²	52.5	31%	0.309	27%	0.269	S	S	.	.	H	α-helix	trans	-65.2	-39.6	-179.1	-70	174.2	0	0	0	112.9	V190 K345 E346 P353	V190-L349 HydrophobicContact CB-CD2 4.4Å; V190-L349 HydrophobicContact CG2-CD2 4.21Å; K345-L349 HydrophobicContact CD-CD1 4.28Å; K345-L349 HydrophobicContact CG-CD1 3.99Å; K345-L349 HydrophobicContact CG-CG 4.46Å; K345-L349 WeakPolarHBondContact O-CG 3.32Å; K345-L349 PolarHBondContact O-N 2.99Å; E346-L349 PolarHBondContact O-N 2.68Å; L349-P353 WeakPolarHBondContact O-CD 3.46Å
350	Q	93.9	Very high	92.7	Very high	112 Å²	112	56.4 Å²	56.4	52%	0.523	30%	0.301	S	S	.	.	H	α-helix	trans	-65.6	-36.5	175.9	-72.7	179.3	3.4	0	0	112.7	E346	E346-Q350 HydrophobicContact CG-CG 4.36Å; E346-Q350 WeakPolarHBondContact O-CB 3.37Å; E346-Q350 VanDerWaalsContact O-CG 3.27Å; E346-Q350 WeakPolarHBondContact O-CG 3.39Å; E346-Q350 PolarHBondContact O-N 2.85Å; E346-Q350 WeakPolarHBondContact OE1-CG 3.39Å; E346-Q350 PolarHBondContact OE1-NE2 2.94Å
351	N	95.3	Very high	90.9	Very high	24 Å²	24	54.1 Å²	54.1	13%	0.128	30%	0.301	C	S	.	.	H	α-helix	trans	-93	-23.1	-173.4	-73.9	-79.2	0	0	0	114.2	V314 H315 L318 L347 Y348 L354 Y355	V314-N351 HydrophobicContact CG2-CB 4.35Å; H315-N351 PolarHBondContact CE1-OD1 3.06Å; L318-N351 HydrophobicContact CD1-CB 3.67Å; L347-N351 WeakPolarHBondContact O-CB 3.35Å; L347-N351 PolarHBondContact O-N 2.97Å; L347-N351 PolarHBondContact O-ND2 3.13Å; Y348-N351 PolarHBondContact O-N 2.95Å; N351-L354 VanDerWaalsContact O-CB 3.28Å; N351-L354 WeakPolarHBondContact O-CB 3.3Å; N351-L354 WeakPolarHBondContact O-CG 3.46Å; N351-L354 PolarHBondContact O-N 3.41Å; N351-Y355 WeakPolarHBondContact O-CD2 3.48Å
352	L	94.9	Very high	88.8	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-50.5	-44.8	-179.8	-92.1	162.8	0	0	0	114.7	W166 I188 V190 L318 Y348 L354 Y355 F356	W166-L352 HydrophobicContact CD2-CB 4.19Å; W166-L352 HydrophobicContact CD2-CD1 3.87Å; W166-L352 HydrophobicContact CD2-CD2 4.49Å; W166-L352 HydrophobicContact CD2-CG 4.42Å; W166-L352 HydrophobicContact CE3-CB 4.37Å; W166-L352 HydrophobicContact CE3-CD1 4.45Å; W166-L352 HydrophobicContact CE3-CD2 4.26Å; W166-L352 HydrophobicContact CG-CD1 3.9Å; W166-L352 HydrophobicContact CH2-CB 3.82Å; W166-L352 HydrophobicContact CZ2-CB 3.6Å; W166-L352 HydrophobicContact CZ3-CB 4.2Å; W166-L352 HydrophobicContact CZ3-CD2 4.46Å; I188-L352 HydrophobicContact CG2-CD2 3.82Å; V190-L352 HydrophobicContact CG2-CD1 3.33Å; L318-L352 HydrophobicContact CD1-CG 4.48Å; L318-L352 HydrophobicContact CD2-CD2 3.47Å; L318-L352 VanDerWaalsContact CD2-CD2 3.47Å; L318-L352 HydrophobicContact CD2-CG 3.9Å; Y348-L352 WeakPolarHBondContact O-CB 3.37Å; Y348-L352 WeakPolarHBondContact O-CD1 3.43Å; Y348-L352 VanDerWaalsContact O-CG 3.23Å; Y348-L352 WeakPolarHBondContact O-CG 3.42Å; Y348-L352 PolarHBondContact O-N 3.48Å; L352-L354 PolarHBondContact O-N 3.18Å; L352-L354 VanDerWaalsContact O-N 3.08Å; L352-Y355 PolarHBondContact O-N 3.28Å; L352-F356 HydrophobicContact CD2-CD2 3.73Å; L352-F356 HydrophobicContact CD2-CE2 4.22Å; L352-F356 PolarHBondContact O-N 2.92Å
353	P	93.1	Very high	86.7	Confident	27 Å²	27	61.9 Å²	61.9	18%	0.175	32%	0.324	C	S	.	.	H	α-helix	trans	-58.5	-20.9	175.9	-26.3	35.1	0	0	0	115.3	W166 L349 Y355 P357	W166-P353 HydrophobicContact CH2-CG 4.25Å; W166-P353 HydrophobicContact CZ2-CG 3.96Å; L349-P353 WeakPolarHBondContact O-CD 3.46Å; P353-Y355 VanDerWaalsContact C-N 3.29Å; P353-P357 WeakPolarHBondContact O-CA 3.3Å; P353-P357 WeakPolarHBondContact O-CB 3.5Å
354	L	93	Very high	84	Confident	20 Å²	20	62 Å²	62	11%	0.105	33%	0.328	C	S	.	.	H	α-helix	trans	-73.6	-24.3	176.2	-53.4	178.7	0	0	0	112.3	T174 R177 N351 L352	T174-L354 HydrophobicContact CG2-CD2 3.63Å; R177-L354 PolarHBondContact N-O 3.5Å; N351-L354 VanDerWaalsContact O-CB 3.28Å; N351-L354 WeakPolarHBondContact O-CB 3.3Å; N351-L354 WeakPolarHBondContact O-CG 3.46Å; N351-L354 PolarHBondContact O-N 3.41Å; L352-L354 PolarHBondContact O-N 3.18Å; L352-L354 VanDerWaalsContact O-N 3.08Å
355	Y	95.3	Very high	81.5	Confident	5 Å²	5	71.4 Å²	71.4	2%	0.02	37%	0.369	C	S	.	.	H	α-helix	trans	-110.8	-34.1	-174	-67.5	-92.9	0	0	0	112.5	R177 Y178 H315 L318 A319 R322 N351 L352 P353	R177-Y355 PolarHBondContact NH1-OH 3.04Å; Y178-Y355 AromaticContact CD2-CD1 3.81Å; Y178-Y355 HydrophobicContact CD2-CD1 3.81Å; Y178-Y355 HydrophobicContact CD2-CE1 4.43Å; Y178-Y355 HydrophobicContact CD2-CG 4.39Å; Y178-Y355 AromaticContact CE2-CD1 3.26Å; Y178-Y355 HydrophobicContact CE2-CD1 3.26Å; Y178-Y355 AromaticContact CE2-CE1 3.55Å; Y178-Y355 HydrophobicContact CE2-CE1 3.55Å; Y178-Y355 HydrophobicContact CE2-CG 4.23Å; H315-Y355 VanDerWaalsContact CA-OH 3.31Å; H315-Y355 WeakPolarHBondContact CA-OH 3.49Å; H315-Y355 WeakPolarHBondContact CB-OH 3.41Å; H315-Y355 AromaticContact ND1-CE2 3.83Å; H315-Y355 PolarHBondContact ND1-OH 3.05Å; H315-Y355 PolarHBondContact O-OH 3.2Å; L318-Y355 HydrophobicContact CB-CD1 3.85Å; L318-Y355 HydrophobicContact CB-CD2 3.56Å; L318-Y355 HydrophobicContact CB-CE1 4.05Å; L318-Y355 HydrophobicContact CB-CE2 3.78Å; L318-Y355 HydrophobicContact CB-CG 3.59Å; L318-Y355 HydrophobicContact CD1-CD2 3.68Å; L318-Y355 HydrophobicContact CD1-CE2 3.95Å; L318-Y355 HydrophobicContact CD1-CG 4.43Å; L318-Y355 HydrophobicContact CG-CD2 4.24Å; A319-Y355 VanDerWaalsContact CA-CE1 3.48Å; A319-Y355 HydrophobicContact CB-CD1 4.4Å; A319-Y355 HydrophobicContact CB-CE1 3.66Å; R322-Y355 HydrophobicContact CB-CD1 4.45Å; R322-Y355 VanDerWaalsContact CD-O 3.31Å; R322-Y355 WeakPolarHBondContact CD-O 3.07Å; R322-Y355 PolarHBondContact NH1-O 3.47Å; N351-Y355 WeakPolarHBondContact O-CD2 3.48Å; L352-Y355 PolarHBondContact O-N 3.28Å; P353-Y355 VanDerWaalsContact C-N 3.29Å
356	F	93.9	Very high	78.9	Confident	12 Å²	12	78.3 Å²	78.3	5%	0.053	41%	0.408	C	S	.	.	S	Bend	trans	-128	70.2	179.5	-58.1	-92.5	0	0	0	108	W166 L184 I188 L318 V321 R322 L325 L352	W166-F356 HydrophobicContact CH2-CB 4.46Å; W166-F356 VanDerWaalsContact CH2-O 3.29Å; W166-F356 WeakPolarHBondContact CH2-O 3.39Å; W166-F356 HydrophobicContact CZ3-CB 3.73Å; W166-F356 WeakPolarHBondContact CZ3-O 3.41Å; L184-F356 HydrophobicContact CB-CD1 4.14Å; L184-F356 HydrophobicContact CB-CE1 4.33Å; L184-F356 HydrophobicContact CD1-CD1 4.16Å; L184-F356 HydrophobicContact CD1-CE1 3.91Å; I188-F356 HydrophobicContact CD1-CD1 4.48Å; I188-F356 HydrophobicContact CD1-CE1 3.78Å; I188-F356 HydrophobicContact CD1-CE2 4.19Å; I188-F356 HydrophobicContact CD1-CZ 3.62Å; I188-F356 HydrophobicContact CG1-CD1 3.87Å; I188-F356 HydrophobicContact CG1-CD2 4.37Å; I188-F356 HydrophobicContact CG1-CE1 3.67Å; I188-F356 HydrophobicContact CG1-CE2 4.21Å; I188-F356 HydrophobicContact CG1-CG 4.22Å; I188-F356 HydrophobicContact CG1-CZ 3.86Å; L318-F356 HydrophobicContact CD2-CE2 4.35Å; V321-F356 HydrophobicContact CG1-CZ 4.32Å; R322-F356 HydrophobicContact CB-CE1 4.27Å; R322-F356 HydrophobicContact CB-CE2 4.01Å; R322-F356 HydrophobicContact CB-CZ 3.65Å; R322-F356 HydrophobicContact CG-CZ 4.34Å; L325-F356 HydrophobicContact CD1-CE1 4.2Å; L325-F356 HydrophobicContact CD1-CZ 4.4Å; L352-F356 HydrophobicContact CD2-CD2 3.73Å; L352-F356 HydrophobicContact CD2-CE2 4.22Å; L352-F356 PolarHBondContact O-N 2.92Å
357	P	91.7	Very high	78	Confident	12 Å²	12	77.3 Å²	77.3	8%	0.078	41%	0.406	C	S	.	.			trans	-70.1	153.8	-172.2	29.9	-37.4	0	0	0	112.5	Y178 R180 P353	Y178-P357 WeakPolarHBondContact O-CG 3.4Å; R180-P357 HydrophobicContact CB-CG 4.22Å; P353-P357 WeakPolarHBondContact O-CA 3.3Å; P353-P357 WeakPolarHBondContact O-CB 3.5Å
358	P	85.4	Confident	77.1	Confident	27 Å²	27	79.7 Å²	79.7	18%	0.175	42%	0.419	C	S	.	.			trans	-66.4	174.8	169.6	31.2	-36.4	0	0	0	112	P168 A360	P168-P358 VanDerWaalsContact CB-CA 3.45Å; P168-P358 HydrophobicContact CB-CB 3.68Å; P168-P358 HydrophobicContact CB-CG 4.5Å; P358-A360 PolarHBondContact O-N 3.09Å
359	E	76.9	Confident	75.9	Confident	125 Å²	125	83.7 Å²	83.7	58%	0.584	44%	0.44	S	S	*	.			trans	-56.4	129.9	168.2	-161.6	165.6	135	0	0	110.3	R180 T361	R180-E359 IonicContact CZ-OE2 2.76Å; R180-E359 IonicContact NH1-OE2 3.84Å; R180-E359 PolarHBondContact NH1-OE2 2.96Å; R180-E359 IonicContact NH2-OE2 3.69Å; E359-T361 PolarHBondContact O-N 3.3Å
360	A	68.6	Low	74.8	Confident	82 Å²	82	85.2 Å²	85.2	68%	0.678	45%	0.448	S	S	*	.			trans	-65	111.2	177.8	0	0	0	0	0	108.5	P358 V362	P358-A360 PolarHBondContact O-N 3.09Å; A360-V362 PolarHBondContact O-N 2.84Å
361	T	57.2	Low	73.6	Confident	113 Å²	113	83.5 Å²	83.5	69%	0.693	44%	0.443	S	S	*	.			trans	-63.7	100.1	-179.8	-39.2	0	0	0	0	109.1	E359 R363	E359-T361 PolarHBondContact O-N 3.3Å; T361-R363 VanDerWaalsContact C-N 3.35Å; T361-R363 PolarHBondContact O-N 3.06Å
362	V	50.9	Low	72.1	Confident	131 Å²	131	87.5 Å²	87.5	79%	0.794	46%	0.464	S	S	*	.			trans	-65	96.5	-179.6	-178.8	0	0	0	0	108.1	A360 S364	A360-V362 PolarHBondContact O-N 2.84Å; V362-S364 VanDerWaalsContact C-N 3.31Å; V362-S364 PolarHBondContact O-N 3.12Å
363	R	52.2	Low	70.5	Confident	230 Å²	230	93.7 Å²	93.7	87%	0.868	50%	0.497	S	S	*	.			trans	-65.8	96.3	167.4	-70.7	-173.5	178.3	-171.2	-0.2	107.4	T361 K365	T361-R363 VanDerWaalsContact C-N 3.35Å; T361-R363 PolarHBondContact O-N 3.06Å; R363-K365 PolarHBondContact O-N 3.5Å; R363-K365 VanDerWaalsContact O-N 3.13Å
364	S	41.2	Very low	68.8	Low	91 Å²	91	98.8 Å²	98.8	64%	0.636	52%	0.522	S	S	*	.			trans	-53.3	117.9	168.5	40.8	0	0	0	0	108.6	V362 L366	V362-S364 VanDerWaalsContact C-N 3.31Å; V362-S364 PolarHBondContact O-N 3.12Å; S364-L366 VanDerWaalsContact C-N 3.31Å; S364-L366 PolarHBondContact O-N 3.04Å; S364-L366 VanDerWaalsContact O-N 3.1Å
365	K	45.3	Very low	66.8	Low	208 Å²	208	105.4 Å²	105.4	90%	0.904	56%	0.557	S	S	*	*			trans	-76.2	92.7	164.8	-69.1	-176.1	178.7	-178.7	0	106.9	R363	R363-K365 PolarHBondContact O-N 3.5Å; R363-K365 VanDerWaalsContact O-N 3.13Å
366	L	42.5	Very low	64.2	Low	229 Å²	229	114.5 Å²	114.5	100%	1.199	61%	0.606	S	S	*	*			trans	-78.4	0	158.9	-69	167.5	0	0	0	108.9	S364	S364-L366 VanDerWaalsContact C-N 3.31Å; S364-L366 PolarHBondContact O-N 3.04Å; S364-L366 VanDerWaalsContact O-N 3.1Å

Retrieved 366 of 366 residues in 358.6 ms (Link to these results)

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