A0A096M4Q9_POEFO Loading...

Ribonuclease

Catalytic subunit of RNase HII, an endonuclease that specifically degrades the RNA of RNA:DNA hybrids. Participates in DNA replication, possibly by mediating the removal of lagging-strand Okazaki fragment RNA primers during DNA replication. Mediates the excision of single ribonucleotides from DNA:RNA duplexes. Endonuclease that specifically degrades the RNA of RNA-DNA hybrids.

AlphaFold DB , UniProt , Accession A0A096M4Q9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 358 aa.

Structure Viewer

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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	33.7	Very low	29	Very low	239 Å²	239	188.9 Å²	188.9	100%	1.177	89%	0.89	S	S	*	*				0	101.6	0	-154.8	-178.6	-73.4	0	0	105.1
2	F	28.9	Very low	29.1	Very low	208 Å²	208	182.7 Å²	182.7	91%	0.912	88%	0.882	S	S	*	*			trans	33.5	111.6	177.9	-75.1	-89	0	0	0	120.9
3	E	27.7	Very low	29.4	Very low	170 Å²	170	176.2 Å²	176.2	79%	0.794	88%	0.877	S	S	*	*			trans	-62	134.3	161.2	-74.6	171.7	136.4	0	0	111.8	R5	E3-R5 PolarHBondContact O-N 3.39Å
4	E	29.1	Very low	29.6	Very low	197 Å²	197	171.1 Å²	171.1	92%	0.921	87%	0.867	S	S	*	*			trans	-69.5	114.9	163.9	-74.7	-178.9	143	0	0	109.9
5	R	29.9	Very low	29.7	Very low	212 Å²	212	166.5 Å²	166.5	80%	0.8	85%	0.853	S	S	*	*			trans	-96.8	112.3	159.7	-69.6	-173.5	-161.1	-174	4.7	108.3	E3 F7	E3-R5 PolarHBondContact O-N 3.39Å; R5-F7 PolarHBondContact O-N 3.23Å
6	C	27.6	Very low	30	Very low	129 Å²	129	162.3 Å²	162.3	87%	0.872	84%	0.84	S	S	*	*			trans	-57.8	117.7	161.9	-73.9	0	0	0	0	109.3
7	F	27	Very low	30.1	Very low	196 Å²	196	156.8 Å²	156.8	86%	0.86	82%	0.817	S	S	*	*			trans	-97.1	110.5	167.1	-124.1	-92.7	0	0	0	107.4	R5	R5-F7 PolarHBondContact O-N 3.23Å
8	E	28.6	Very low	30.5	Very low	173 Å²	173	153.6 Å²	153.6	81%	0.808	81%	0.805	S	S	*	*			trans	-64.6	132.9	165.3	-69.5	-177.3	155	0	0	109.5	R10	E8-R10 PolarHBondContact O-N 3.26Å
9	P	28.8	Very low	30.6	Very low	122 Å²	122	152.2 Å²	152.2	79%	0.792	79%	0.794	S	S	*	*			trans	-75.1	113.7	169.3	28.5	-28.3	0	0	0	109	M11	P9-M11 PolarHBondContact O-N 3.11Å
10	R	28	Very low	30.8	Very low	242 Å²	242	149.5 Å²	149.5	91%	0.913	78%	0.784	S	S	*	*			trans	-50.2	121.5	167.4	-74.3	-179.9	-179.4	-171.7	-1.1	109.6	E8 S12	E8-R10 PolarHBondContact O-N 3.26Å; R10-S12 PolarHBondContact O-N 3.21Å; R10-S12 VanDerWaalsContact O-N 3.11Å
11	M	29.2	Very low	31.1	Very low	190 Å²	190	146.3 Å²	146.3	94%	0.936	77%	0.77	S	S	*	*			trans	-60.2	111.1	164.4	-72.1	-171.7	119.5	0	0	108.8	P9 A13	P9-M11 PolarHBondContact O-N 3.11Å; M11-A13 PolarHBondContact O-N 3.42Å
12	S	31	Very low	31	Very low	114 Å²	114	138.1 Å²	138.1	80%	0.797	74%	0.741	S	S	*	*			trans	-74.8	105.4	166.4	60.5	0	0	0	0	108.2	R10 S14	R10-S12 PolarHBondContact O-N 3.21Å; R10-S12 VanDerWaalsContact O-N 3.11Å; S12-S14 PolarHBondContact O-N 2.8Å; S12-S14 VanDerWaalsContact O-N 3.13Å
13	A	33.1	Very low	31.2	Very low	99 Å²	99	131.2 Å²	131.2	82%	0.818	72%	0.716	S	S	*	*			trans	-63	110	166.7	0	0	0	0	0	108.8	M11	M11-A13 PolarHBondContact O-N 3.42Å
14	S	31.2	Very low	31.5	Very low	105 Å²	105	126.5 Å²	126.5	73%	0.734	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-72.6	127.2	166.7	48.9	0	0	0	0	109	S12	S12-S14 PolarHBondContact O-N 2.8Å; S12-S14 VanDerWaalsContact O-N 3.13Å
15	P	32.2	Very low	31.8	Very low	102 Å²	102	121.2 Å²	121.2	66%	0.662	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-68.5	149.9	175.6	29.2	-33.2	0	0	0	110.7
16	P	33.9	Very low	31.9	Very low	98 Å²	98	114.6 Å²	114.6	64%	0.636	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-67.9	146.5	179.5	27.4	-32.6	0	0	0	111.5	V18	P16-V18 VanDerWaalsContact C-N 3.25Å; P16-V18 PolarHBondContact O-N 3.03Å
17	P	32.3	Very low	32	Very low	69 Å²	69	116 Å²	116	45%	0.448	64%	0.644	S	S	.	*	G	3₁₀ helix	trans	-79.5	14.7	-166.5	29.2	-32.1	0	0	0	116
18	V	36.4	Very low	32.5	Very low	100 Å²	100	112.2 Å²	112.2	61%	0.606	63%	0.632	S	S	*	*	G	3₁₀ helix	trans	-90.6	-3.6	-175	-169.2	0	0	0	0	113.1	P16	P16-V18 VanDerWaalsContact C-N 3.25Å; P16-V18 PolarHBondContact O-N 3.03Å
19	Q	32.8	Very low	33.2	Very low	126 Å²	126	109.3 Å²	109.3	59%	0.589	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-84.5	-8.5	-177.7	-84.8	-178.5	-18.2	0	0	115.4	V21 A22 V23	Q19-V21 PolarHBondContact O-N 3.26Å; Q19-A22 PolarHBondContact O-N 2.95Å; Q19-V23 HydrophobicContact CB-CG2 4.4Å; Q19-V23 WeakPolarHBondContact O-CB 3.43Å; Q19-V23 WeakPolarHBondContact O-CG2 3.46Å; Q19-V23 PolarHBondContact O-N 3.32Å
20	V	34.8	Very low	33.4	Very low	98 Å²	98	110.7 Å²	110.7	59%	0.594	62%	0.619	S	S	*	*	H	α-helix	trans	-72.3	-34.5	-168	-174.3	0	0	0	0	112.7	I24	V20-I24 HydrophobicContact CG1-CD1 4.42Å; V20-I24 WeakPolarHBondContact O-CD1 3.44Å; V20-I24 WeakPolarHBondContact O-CG1 3.35Å; V20-I24 PolarHBondContact O-N 3.04Å
21	V	36.4	Very low	33.8	Very low	84 Å²	84	110.5 Å²	110.5	51%	0.509	62%	0.619	S	S	.	*	H	α-helix	trans	-72	-38.4	178	-173.8	0	0	0	0	111.5	Q19 W308	Q19-V21 PolarHBondContact O-N 3.26Å; V21-W308 HydrophobicContact CG2-CH2 4.07Å
22	A	32.7	Very low	34.1	Very low	67 Å²	67	106.2 Å²	106.2	55%	0.554	61%	0.607	S	S	*	*	H	α-helix	trans	-71.5	-32.9	178.3	0	0	0	0	0	113.3	Q19	Q19-A22 PolarHBondContact O-N 2.95Å
23	V	31.8	Very low	34.2	Very low	63 Å²	63	104.3 Å²	104.3	38%	0.382	61%	0.606	S	S	.	*	H	α-helix	trans	-72.2	-29.5	-179.1	171.7	0	0	0	0	112.1	Q19 Y25 S26 K27	Q19-V23 HydrophobicContact CB-CG2 4.4Å; Q19-V23 WeakPolarHBondContact O-CB 3.43Å; Q19-V23 WeakPolarHBondContact O-CG2 3.46Å; Q19-V23 PolarHBondContact O-N 3.32Å; V23-Y25 VanDerWaalsContact C-N 3.34Å; V23-Y25 PolarHBondContact O-N 2.79Å; V23-S26 PolarHBondContact O-N 2.84Å; V23-S26 PolarHBondContact O-OG 3.45Å; V23-S26 VanDerWaalsContact O-OG 3.05Å; V23-K27 HydrophobicContact CG1-CD 4.43Å; V23-K27 PolarHBondContact O-N 3.06Å
24	I	34.1	Very low	34.4	Very low	70 Å²	70	110.1 Å²	110.1	36%	0.359	61%	0.613	S	S	.	*	H	α-helix	trans	-64.9	-37.9	179.4	-67.7	168.1	0	0	0	111.2	V20 I28 F282	V20-I24 HydrophobicContact CG1-CD1 4.42Å; V20-I24 WeakPolarHBondContact O-CD1 3.44Å; V20-I24 WeakPolarHBondContact O-CG1 3.35Å; V20-I24 PolarHBondContact O-N 3.04Å; I24-I28 HydrophobicContact CG2-CD1 3.74Å; I24-I28 WeakPolarHBondContact O-CG1 3.4Å; I24-F282 HydrophobicContact CG2-CE1 4.09Å; I24-F282 HydrophobicContact CG2-CZ 4.34Å
25	Y	35.3	Very low	34.3	Very low	86 Å²	86	109.4 Å²	109.4	34%	0.337	61%	0.613	S	S	.	*	H	α-helix	trans	-62.2	-45.2	176	-100.7	-94.3	0	0	0	112.8	V23 K27 E251 F282	V23-Y25 VanDerWaalsContact C-N 3.34Å; V23-Y25 PolarHBondContact O-N 2.79Å; Y25-K27 PolarHBondContact O-N 3.26Å; Y25-E251 HydrophobicContact CE1-CB 4.21Å; Y25-E251 HydrophobicContact CE1-CG 3.72Å; Y25-E251 WeakPolarHBondContact OH-CG 2.95Å; Y25-F282 HydrophobicContact CE2-CD1 4.27Å
26	S	32.3	Very low	34.1	Very low	73 Å²	73	109.7 Å²	109.7	51%	0.51	63%	0.625	S	S	.	*	H	α-helix	trans	-70.9	-28.4	-175.6	72.6	0	0	0	0	114.8	V23	V23-S26 PolarHBondContact O-N 2.84Å; V23-S26 PolarHBondContact O-OG 3.45Å; V23-S26 VanDerWaalsContact O-OG 3.05Å
27	K	29.2	Very low	33.8	Very low	158 Å²	158	111 Å²	111	69%	0.687	63%	0.63	S	S	*	*	H	α-helix	trans	-89.5	-23.5	-173.5	-102.5	178.5	177.7	175.6	0	114.1	V23 Y25	V23-K27 HydrophobicContact CG1-CD 4.43Å; V23-K27 PolarHBondContact O-N 3.06Å; Y25-K27 PolarHBondContact O-N 3.26Å
28	I	38.7	Very low	33.4	Very low	118 Å²	118	116.7 Å²	116.7	61%	0.605	65%	0.651	S	S	*	*	H	α-helix	trans	-84.1	-32.6	-179.6	-62.8	176.4	0	0	0	111.2	I24 N30	I24-I28 HydrophobicContact CG2-CD1 3.74Å; I24-I28 WeakPolarHBondContact O-CG1 3.4Å; I28-N30 VanDerWaalsContact C-N 3.32Å; I28-N30 PolarHBondContact O-N 3.26Å
29	Q	42.2	Very low	33	Very low	112 Å²	112	117.6 Å²	117.6	52%	0.523	66%	0.657	S	S	.	*	G	3₁₀ helix	trans	-72.9	-18.3	-179.5	-71.3	-169	-21.3	0	0	114.8	R31	Q29-R31 PolarHBondContact O-N 3.13Å
30	N	34.8	Very low	32.7	Very low	151 Å²	151	121 Å²	121	81%	0.807	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-82.5	12.7	-179.5	-112	-21.2	0	0	0	114.3	I28	I28-N30 VanDerWaalsContact C-N 3.32Å; I28-N30 PolarHBondContact O-N 3.26Å
31	R	34.9	Very low	32.5	Very low	237 Å²	237	128 Å²	128	89%	0.894	69%	0.685	S	S	*	*	G	3₁₀ helix	trans	-120.9	0.3	-177.4	-85.7	-170.4	171.4	-167.8	-1.9	116.7	Q29	Q29-R31 PolarHBondContact O-N 3.13Å
32	S	36.7	Very low	32	Very low	100 Å²	100	135.1 Å²	135.1	70%	0.699	70%	0.703	S	S	*	*	S	Bend	trans	-102.2	117.1	173.1	33.5	0	0	0	0	111
33	G	32.7	Very low	31.8	Very low	75 Å²	75	137.1 Å²	137.1	77%	0.773	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-60.7	150.9	-176.2	0	0	0	0	0	114.5	A35	G33-A35 PolarHBondContact O-N 3.19Å
34	K	36.1	Very low	31.7	Very low	220 Å²	220	140.3 Å²	140.3	96%	0.957	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-50.5	123.5	175	-67.5	175.7	174.4	178.7	0	112.1
35	A	29.2	Very low	31.4	Very low	90 Å²	90	145.6 Å²	145.6	74%	0.744	76%	0.763	S	S	*	*			trans	-121.6	115.4	150.6	0	0	0	0	0	107.4	G33 V37	G33-A35 PolarHBondContact O-N 3.19Å; A35-V37 PolarHBondContact O-N 2.7Å
36	A	28.8	Very low	31	Very low	109 Å²	109	147 Å²	147	90%	0.901	78%	0.782	S	S	*	*			trans	-72.7	113.9	175.1	0	0	0	0	0	108.7
37	V	27.3	Very low	31.1	Very low	125 Å²	125	149 Å²	149	76%	0.758	79%	0.793	S	S	*	*			trans	-103.1	114.7	168.6	179	0	0	0	0	107.5	A35 V39	A35-V37 PolarHBondContact O-N 2.7Å; V37-V39 PolarHBondContact O-N 3.34Å
38	E	24.5	Very low	31.3	Very low	188 Å²	188	146.4 Å²	146.4	88%	0.879	80%	0.795	S	S	*	*			trans	-73.1	101.9	176.7	-168	177.2	-178	0	0	109.3	K40	E38-K40 PolarHBondContact O-N 2.89Å
39	V	28.6	Very low	31	Very low	120 Å²	120	150.4 Å²	150.4	73%	0.727	81%	0.811	S	S	*	*			trans	-76.9	108.4	176.5	179.3	0	0	0	0	109.1	V37 R41	V37-V39 PolarHBondContact O-N 3.34Å; V39-R41 PolarHBondContact O-N 3.27Å
40	K	25.8	Very low	30.7	Very low	198 Å²	198	153.1 Å²	153.1	86%	0.861	82%	0.824	S	S	*	*			trans	-61.8	107.2	168.8	-83.4	-179.3	175.5	175.8	0	109.8	E38 R42	E38-K40 PolarHBondContact O-N 2.89Å; K40-R42 PolarHBondContact O-N 3.34Å
41	R	29.2	Very low	30.8	Very low	243 Å²	243	147.9 Å²	147.9	92%	0.917	80%	0.799	S	S	*	*			trans	-65	111.8	171.2	-68.3	-178.6	175.3	-177.1	-2.3	109.6	V39	V39-R41 PolarHBondContact O-N 3.27Å
42	R	27.5	Very low	31.6	Very low	234 Å²	234	141.3 Å²	141.3	88%	0.883	80%	0.795	S	S	*	*			trans	-75.3	124.9	161.9	-109.6	180	174.7	177	-1.9	107.7	K40 T44	K40-R42 PolarHBondContact O-N 3.34Å; R42-T44 PolarHBondContact O-N 3.37Å; R42-T44 VanDerWaalsContact O-N 3.12Å
43	A	27.7	Very low	32.9	Very low	109 Å²	109	137.5 Å²	137.5	90%	0.901	77%	0.77	S	S	*	*			trans	-67.8	104.9	174.1	0	0	0	0	0	109.6
44	T	30.2	Very low	35.2	Very low	131 Å²	131	134.5 Å²	134.5	80%	0.804	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-91.8	138.8	162.9	34.6	0	0	0	0	108.7	R42	R42-T44 PolarHBondContact O-N 3.37Å; R42-T44 VanDerWaalsContact O-N 3.12Å
45	Q	27.9	Very low	37.5	Very low	181 Å²	181	128 Å²	128	85%	0.846	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-53.7	148.9	177.6	-75.4	174.8	-28.2	0	0	111.3
46	P	27.3	Very low	40.2	Very low	116 Å²	116	124.2 Å²	124.2	75%	0.753	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-62	135.3	-178.8	25.7	-31.9	0	0	0	109.9	S48	P46-S48 PolarHBondContact O-N 2.9Å
47	P	34.3	Very low	42.9	Very low	113 Å²	113	125.7 Å²	125.7	73%	0.734	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-64.1	133.9	170.8	-6.8	21	0	0	0	108.5	E49	P47-E49 PolarHBondContact O-N 3.04Å
48	S	32.4	Very low	45.5	Very low	104 Å²	104	126.5 Å²	126.5	73%	0.727	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-46	130.6	161.3	50.6	0	0	0	0	109.6	P46 Q50	P46-S48 PolarHBondContact O-N 2.9Å; S48-Q50 PolarHBondContact O-N 2.69Å
49	E	32.1	Very low	48.4	Very low	202 Å²	202	117.8 Å²	117.8	94%	0.944	62%	0.62	S	S	*	*			trans	-45.8	99.8	-179.2	-74.1	175.2	146.8	0	0	111.4	P47	P47-E49 PolarHBondContact O-N 3.04Å
50	Q	36	Very low	51.1	Low	169 Å²	169	116.2 Å²	116.2	79%	0.79	60%	0.604	S	S	*	*			trans	-72.3	130	166.1	-76.7	175.1	-17.3	0	0	107.1	S48 A52	S48-Q50 PolarHBondContact O-N 2.69Å; Q50-A52 PolarHBondContact O-N 3.05Å
51	S	37.6	Very low	53.8	Low	42 Å²	42	111 Å²	111	29%	0.294	60%	0.598	S	S	.	*			trans	-45.7	130.2	177.9	160	0	0	0	0	111.2	A53 D137	S51-A53 PolarHBondContact O-N 3.04Å; S51-A53 VanDerWaalsContact OG-CB 3.27Å; S51-A53 WeakPolarHBondContact OG-CB 3.49Å; S51-A53 PolarHBondContact OG-N 3.3Å; S51-D137 PolarHBondContact OG-OD2 2.95Å
52	A	51.9	Low	56.5	Low	98 Å²	98	104.2 Å²	104.2	81%	0.81	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	9.2	180	0	0	0	0	0	114.4	Q50 M54	Q50-A52 PolarHBondContact O-N 3.05Å; A52-M54 PolarHBondContact O-N 3.28Å
53	A	63.6	Low	59.2	Low	20 Å²	20	93.7 Å²	93.7	17%	0.165	54%	0.541	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-23.7	-166.9	0	0	0	0	0	116	S51 F133 D137 W145	S51-A53 PolarHBondContact O-N 3.04Å; S51-A53 VanDerWaalsContact OG-CB 3.27Å; S51-A53 WeakPolarHBondContact OG-CB 3.49Å; S51-A53 PolarHBondContact OG-N 3.3Å; A53-F133 HydrophobicContact CB-CE1 3.77Å; A53-F133 HydrophobicContact CB-CZ 3.94Å; A53-D137 HydrophobicContact CB-CB 4.07Å; A53-D137 WeakPolarHBondContact CB-OD1 3.34Å; A53-D137 WeakPolarHBondContact CB-OD2 3.35Å; A53-W145 WeakPolarHBondContact O-CH2 3.45Å; A53-W145 WeakPolarHBondContact O-CZ2 3.32Å
54	M	80.8	Confident	61.8	Low	12 Å²	12	90.4 Å²	90.4	6%	0.059	51%	0.512	C	S	.	.			trans	-126.5	93.1	168.6	-63.1	-172.6	-168.5	0	0	111.1	A52 L56 L69 F133 W145 L147 C235 V238 A239	A52-M54 PolarHBondContact O-N 3.28Å; M54-L56 PolarHBondContact O-N 2.67Å; M54-L69 HydrophobicContact CB-CD2 3.64Å; M54-L69 HydrophobicContact CG-CD2 3.88Å; M54-L69 HydrophobicContact SD-CD2 4.46Å; M54-F133 HydrophobicContact CE-CD1 4.23Å; M54-F133 HydrophobicContact CE-CD2 3.56Å; M54-F133 HydrophobicContact CE-CE1 3.84Å; M54-F133 HydrophobicContact CE-CE2 3.12Å; M54-F133 HydrophobicContact CE-CG 4.11Å; M54-F133 HydrophobicContact CE-CZ 3.28Å; M54-F133 HydrophobicContact CG-CE1 3.89Å; M54-F133 HydrophobicContact CG-CE2 4.36Å; M54-F133 HydrophobicContact CG-CZ 3.56Å; M54-F133 HydrophobicContact SD-CE1 4.46Å; M54-F133 HydrophobicContact SD-CZ 4.19Å; M54-W145 HydrophobicContact CG-CH2 3.73Å; M54-W145 HydrophobicContact CG-CZ2 4.14Å; M54-W145 HydrophobicContact CG-CZ3 4.45Å; M54-L147 HydrophobicContact CE-CD1 3.86Å; M54-L147 HydrophobicContact SD-CD1 3.93Å; M54-C235 HydrophobicContact CE-CB 4.46Å; M54-V238 HydrophobicContact CE-CB 4.36Å; M54-V238 HydrophobicContact CE-CG1 4.14Å; M54-V238 HydrophobicContact SD-CG1 4.37Å; M54-A239 HydrophobicContact CE-CB 4.27Å; M54-A239 HydrophobicContact SD-CB 3.77Å
55	D	84.7	Confident	64.5	Low	83 Å²	83	85.6 Å²	85.6	44%	0.444	49%	0.488	S	S	.	.			trans	-79	106.5	172.3	-169.3	-4.5	0	0	0	110.5	K57	D55-K57 VanDerWaalsContact OD1-CB 3.26Å; D55-K57 WeakPolarHBondContact OD1-CB 3.47Å; D55-K57 VanDerWaalsContact OD1-CD 3.29Å; D55-K57 WeakPolarHBondContact OD1-CD 3.2Å; D55-K57 WeakPolarHBondContact OD1-CG 3.37Å; D55-K57 PolarHBondContact OD1-N 2.77Å
56	L	86.9	Confident	67.3	Low	11 Å²	11	79.6 Å²	79.6	6%	0.058	47%	0.466	C	S	.	.			trans	-94.3	2.2	179	-64.7	175.6	0	0	0	113.2	M54 Q58 F59 E60 L69 I149 R242 V243	M54-L56 PolarHBondContact O-N 2.67Å; L56-Q58 PolarHBondContact O-N 3.23Å; L56-Q58 VanDerWaalsContact O-N 3.1Å; L56-F59 CarbonylContact O-C 3.57Å; L56-F59 WeakPolarHBondContact O-CA 3.37Å; L56-F59 WeakPolarHBondContact O-CB 3.31Å; L56-F59 PolarHBondContact O-N 2.86Å; L56-E60 HydrophobicContact CB-CG 4.38Å; L56-E60 WeakPolarHBondContact O-CG 3.48Å; L56-E60 PolarHBondContact O-N 3.18Å; L56-L69 HydrophobicContact CD2-CD2 4.11Å; L56-I149 HydrophobicContact CD2-CD1 3.79Å; L56-R242 HydrophobicContact CD1-CB 3.62Å; L56-V243 HydrophobicContact CD1-CG2 3.85Å; L56-V243 HydrophobicContact CD2-CG2 4.11Å
57	K	85.6	Confident	70.4	Confident	141 Å²	141	75.6 Å²	75.6	61%	0.613	44%	0.437	S	S	*	.	H	α-helix	trans	-55.2	-36.6	-173.4	-72.8	169.4	-166.3	166	0	114	D55 E60 A61	D55-K57 VanDerWaalsContact OD1-CB 3.26Å; D55-K57 WeakPolarHBondContact OD1-CB 3.47Å; D55-K57 VanDerWaalsContact OD1-CD 3.29Å; D55-K57 WeakPolarHBondContact OD1-CD 3.2Å; D55-K57 WeakPolarHBondContact OD1-CG 3.37Å; D55-K57 PolarHBondContact OD1-N 2.77Å; K57-E60 PolarHBondContact O-N 2.93Å; K57-A61 WeakPolarHBondContact O-CB 3.45Å; K57-A61 PolarHBondContact O-N 3.22Å
58	Q	82.1	Confident	73.3	Confident	142 Å²	142	75.4 Å²	75.4	66%	0.664	42%	0.422	S	S	*	.	H	α-helix	trans	-67.2	-39.4	177.8	-68.8	-174.8	6.1	0	0	111.6	L56 A61 D62 F67	L56-Q58 PolarHBondContact O-N 3.23Å; L56-Q58 VanDerWaalsContact O-N 3.1Å; Q58-A61 PolarHBondContact O-N 3.45Å; Q58-D62 PolarHBondContact O-N 3.45Å; Q58-F67 HydrophobicContact CB-CD2 4.31Å; Q58-F67 HydrophobicContact CB-CE2 3.43Å; Q58-F67 VanDerWaalsContact CB-CE2 3.43Å; Q58-F67 HydrophobicContact CB-CZ 3.63Å; Q58-F67 HydrophobicContact CG-CE2 4.35Å; Q58-F67 HydrophobicContact CG-CZ 4.41Å; Q58-F67 VanDerWaalsContact OE1-CE2 3.23Å
59	F	84.3	Confident	76.3	Confident	5 Å²	5	71.5 Å²	71.5	2%	0.022	39%	0.392	C	S	.	.	H	α-helix	trans	-69.9	-39.3	173.9	-175.7	-94.2	0	0	0	111.9	L56 A61 D62 N63 F67 I149 V243 W247	L56-F59 CarbonylContact O-C 3.57Å; L56-F59 WeakPolarHBondContact O-CA 3.37Å; L56-F59 WeakPolarHBondContact O-CB 3.31Å; L56-F59 PolarHBondContact O-N 2.86Å; F59-A61 PolarHBondContact O-N 3.04Å; F59-D62 CarbonylContact O-C 3.59Å; F59-D62 PolarHBondContact O-N 3.36Å; F59-N63 HydrophobicContact CD1-CB 4.01Å; F59-N63 HydrophobicContact CD2-CB 4.42Å; F59-N63 HydrophobicContact CE1-CB 3.43Å; F59-N63 VanDerWaalsContact CE1-CB 3.43Å; F59-N63 HydrophobicContact CE2-CB 3.97Å; F59-N63 HydrophobicContact CG-CB 4.48Å; F59-N63 HydrophobicContact CZ-CB 3.45Å; F59-N63 VanDerWaalsContact CZ-CB 3.45Å; F59-N63 WeakPolarHBondContact O-CA 3.33Å; F59-N63 WeakPolarHBondContact O-CB 3.29Å; F59-N63 PolarHBondContact O-N 2.85Å; F59-N63 VanDerWaalsContact O-N 3.1Å; F59-F67 HydrophobicContact CB-CB 4.29Å; F59-F67 HydrophobicContact CB-CD1 3.95Å; F59-F67 HydrophobicContact CB-CE1 4.48Å; F59-F67 HydrophobicContact CB-CG 4.04Å; F59-F67 HydrophobicContact CD2-CB 3.55Å; F59-F67 HydrophobicContact CD2-CG 4.23Å; F59-F67 HydrophobicContact CE2-CB 4.38Å; F59-F67 HydrophobicContact CG-CB 4.36Å; F59-I149 HydrophobicContact CD2-CG2 4.16Å; F59-I149 HydrophobicContact CE1-CG2 4.48Å; F59-I149 HydrophobicContact CE2-CB 4.4Å; F59-I149 HydrophobicContact CE2-CG2 3.63Å; F59-I149 HydrophobicContact CZ-CG2 3.8Å; F59-V243 HydrophobicContact CD1-CG1 3.9Å; F59-V243 HydrophobicContact CD1-CG2 4.21Å; F59-V243 HydrophobicContact CE1-CB 4.42Å; F59-V243 HydrophobicContact CE1-CG1 3.25Å; F59-V243 HydrophobicContact CE1-CG2 4.31Å; F59-V243 HydrophobicContact CZ-CG1 3.93Å; F59-W247 HydrophobicContact CE1-CE3 4.18Å; F59-W247 HydrophobicContact CE1-CH2 4.47Å; F59-W247 AromaticContact CE1-CZ3 3.71Å; F59-W247 HydrophobicContact CE1-CZ3 3.71Å; F59-W247 HydrophobicContact CZ-CH2 4.15Å; F59-W247 AromaticContact CZ-CZ3 3.66Å; F59-W247 HydrophobicContact CZ-CZ3 3.66Å
60	E	85.2	Confident	79.4	Confident	86 Å²	86	63.4 Å²	63.4	40%	0.402	36%	0.361	S	S	.	.	H	α-helix	trans	-64.5	-29.3	176.4	-68.6	170.4	175.6	0	0	112.4	L56 K57	L56-E60 HydrophobicContact CB-CG 4.38Å; L56-E60 WeakPolarHBondContact O-CG 3.48Å; L56-E60 PolarHBondContact O-N 3.18Å; K57-E60 PolarHBondContact O-N 2.93Å
61	A	83.6	Confident	82.2	Confident	88 Å²	88	56.5 Å²	56.5	73%	0.727	33%	0.331	S	S	*	.	H	α-helix	trans	-74.1	-36.6	175	0	0	0	0	0	113	K57 Q58 F59	K57-A61 WeakPolarHBondContact O-CB 3.45Å; K57-A61 PolarHBondContact O-N 3.22Å; Q58-A61 PolarHBondContact O-N 3.45Å; F59-A61 PolarHBondContact O-N 3.04Å
62	D	84.7	Confident	84.9	Confident	101 Å²	101	62.9 Å²	62.9	54%	0.54	35%	0.348	S	S	.	.			trans	-147.8	99.6	174.1	-178.1	5	0	0	0	111	Q58 F59 S64	Q58-D62 PolarHBondContact O-N 3.45Å; F59-D62 CarbonylContact O-C 3.59Å; F59-D62 PolarHBondContact O-N 3.36Å; D62-S64 VanDerWaalsContact OD1-CB 3.28Å; D62-S64 WeakPolarHBondContact OD1-CB 3.48Å; D62-S64 PolarHBondContact OD1-N 2.91Å; D62-S64 PolarHBondContact OD1-OG 3.41Å
63	N	85.3	Confident	87.1	Confident	13 Å²	13	58.9 Å²	58.9	7%	0.07	31%	0.313	C	S	.	.			trans	-97.7	12.4	179.3	61.9	4	0	0	0	113.2	F59 S151 W247 N248	F59-N63 HydrophobicContact CD1-CB 4.01Å; F59-N63 HydrophobicContact CD2-CB 4.42Å; F59-N63 HydrophobicContact CE1-CB 3.43Å; F59-N63 VanDerWaalsContact CE1-CB 3.43Å; F59-N63 HydrophobicContact CE2-CB 3.97Å; F59-N63 HydrophobicContact CG-CB 4.48Å; F59-N63 HydrophobicContact CZ-CB 3.45Å; F59-N63 VanDerWaalsContact CZ-CB 3.45Å; F59-N63 WeakPolarHBondContact O-CA 3.33Å; F59-N63 WeakPolarHBondContact O-CB 3.29Å; F59-N63 PolarHBondContact O-N 2.85Å; F59-N63 VanDerWaalsContact O-N 3.1Å; N63-S151 WeakPolarHBondContact O-CB 3.3Å; N63-W247 HydrophobicContact CB-CH2 3.88Å; N63-W247 HydrophobicContact CB-CZ2 4.26Å; N63-W247 HydrophobicContact CB-CZ3 4.19Å; N63-W247 VanDerWaalsContact ND2-CZ2 3.29Å; N63-W247 WeakPolarHBondContact ND2-CZ2 3.4Å; N63-N248 PolarHBondContact ND2-O 3.45Å
64	S	82.1	Confident	88.6	Confident	40 Å²	40	58.1 Å²	58.1	28%	0.28	31%	0.307	S	S	.	.	S	Bend	trans	-76.2	-29.3	-178.8	71.5	0	0	0	0	112.5	D62 S151 N153	D62-S64 VanDerWaalsContact OD1-CB 3.28Å; D62-S64 WeakPolarHBondContact OD1-CB 3.48Å; D62-S64 PolarHBondContact OD1-N 2.91Å; D62-S64 PolarHBondContact OD1-OG 3.41Å; S64-S151 PolarHBondContact O-OG 3.31Å; S64-N153 PolarHBondContact O-ND2 3.43Å
65	G	85.8	Confident	89.4	Confident	30 Å²	30	62.1 Å²	62.1	31%	0.309	33%	0.328	S	S	.	.	S	Bend	trans	-102.7	-167.9	-179.8	0	0	0	0	0	114.5	S151	G65-S151 WeakPolarHBondContact O-CB 3.41Å; G65-S151 PolarHBondContact O-OG 3.21Å
66	S	87.3	Confident	90	Very high	56 Å²	56	60.6 Å²	60.6	39%	0.392	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	149.2	167.7	56.7	0	0	0	0	112	I149 M154	S66-I149 CarbonylContact C-O 3.51Å; S66-I149 WeakPolarHBondContact CA-O 3.48Å; S66-I149 VanDerWaalsContact CB-O 3.26Å; S66-I149 WeakPolarHBondContact CB-O 3.46Å; S66-M154 WeakPolarHBondContact CB-SD 3.35Å; S66-M154 PolarHBondContact OG-SD 2.88Å; S66-M154 VanDerWaalsContact OG-SD 3.36Å
67	F	93.2	Very high	90.5	Very high	31 Å²	31	60.1 Å²	60.1	14%	0.136	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	134	-177.1	-176.4	-105.2	0	0	0	111	Q58 F59 L69 Q148 I149	Q58-F67 HydrophobicContact CB-CD2 4.31Å; Q58-F67 HydrophobicContact CB-CE2 3.43Å; Q58-F67 VanDerWaalsContact CB-CE2 3.43Å; Q58-F67 HydrophobicContact CB-CZ 3.63Å; Q58-F67 HydrophobicContact CG-CE2 4.35Å; Q58-F67 HydrophobicContact CG-CZ 4.41Å; Q58-F67 VanDerWaalsContact OE1-CE2 3.23Å; F59-F67 HydrophobicContact CB-CB 4.29Å; F59-F67 HydrophobicContact CB-CD1 3.95Å; F59-F67 HydrophobicContact CB-CE1 4.48Å; F59-F67 HydrophobicContact CB-CG 4.04Å; F59-F67 HydrophobicContact CD2-CB 3.55Å; F59-F67 HydrophobicContact CD2-CG 4.23Å; F59-F67 HydrophobicContact CE2-CB 4.38Å; F59-F67 HydrophobicContact CG-CB 4.36Å; F67-L69 HydrophobicContact CD1-CB 4.38Å; F67-L69 HydrophobicContact CE1-CB 3.97Å; F67-L69 HydrophobicContact CE1-CD1 4.36Å; F67-Q148 VanDerWaalsContact C-NE2 3.26Å; F67-Q148 PolarHBondContact O-NE2 3.45Å; F67-Q148 VanDerWaalsContact O-NE2 3.11Å; F67-I149 HydrophobicContact CD1-CD1 4.27Å; F67-I149 PolarHBondContact N-O 3.08Å; F67-I149 PolarHBondContact O-N 2.9Å
68	R	95.2	Very high	91.1	Very high	110 Å²	110	58.6 Å²	58.6	42%	0.415	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	128.8	175.3	-172.6	-179.3	-60.6	167	2.1	109.4	L147	R68-L147 VanDerWaalsContact CA-O 3.31Å; R68-L147 WeakPolarHBondContact CA-O 3.47Å; R68-L147 WeakPolarHBondContact CG-O 3.1Å
69	L	94.9	Very high	91.8	Very high	21 Å²	21	56.6 Å²	56.6	11%	0.11	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	138.9	174	-178.5	65.1	0	0	0	108.5	M54 L56 F67 W145 A146 L147	M54-L69 HydrophobicContact CB-CD2 3.64Å; M54-L69 HydrophobicContact CG-CD2 3.88Å; M54-L69 HydrophobicContact SD-CD2 4.46Å; L56-L69 HydrophobicContact CD2-CD2 4.11Å; F67-L69 HydrophobicContact CD1-CB 4.38Å; F67-L69 HydrophobicContact CE1-CB 3.97Å; F67-L69 HydrophobicContact CE1-CD1 4.36Å; L69-W145 HydrophobicContact CD2-CH2 4.05Å; L69-W145 HydrophobicContact CD2-CZ3 4.17Å; L69-W145 HydrophobicContact CG-CH2 3.95Å; L69-W145 HydrophobicContact CG-CZ3 3.9Å; L69-A146 CarbonylContact O-C 3.33Å; L69-A146 WeakPolarHBondContact O-CA 3.23Å; L69-L147 HydrophobicContact CB-CB 4.48Å; L69-L147 HydrophobicContact CD2-CD1 4.42Å; L69-L147 PolarHBondContact N-O 3.26Å; L69-L147 PolarHBondContact O-N 2.82Å
70	A	95.9	Very high	92.5	Very high	33 Å²	33	60.1 Å²	60.1	27%	0.273	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	152.8	179.6	0	0	0	0	0	111.5	W145 A146 Y181	A70-W145 WeakPolarHBondContact CA-O 3.37Å; A70-A146 HydrophobicContact CB-CB 3.73Å; A70-Y181 HydrophobicContact CB-CE1 3.79Å; A70-Y181 VanDerWaalsContact CB-OH 3.28Å; A70-Y181 WeakPolarHBondContact CB-OH 3.45Å
71	S	95.5	Very high	93.1	Very high	23 Å²	23	59.4 Å²	59.4	16%	0.161	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-72.3	171.1	168.7	73.9	0	0	0	0	111.2	G144 W145	S71-G144 WeakPolarHBondContact OG-CA 3.5Å; S71-W145 PolarHBondContact N-O 3.04Å; S71-W145 PolarHBondContact OG-N 3.24Å; S71-W145 PolarHBondContact OG-O 3.43Å
72	R	94.9	Very high	93.8	Very high	176 Å²	176	55.2 Å²	55.2	66%	0.664	29%	0.288	S	S	*	.	P	Polyproline II helix	trans	-58.3	142.3	159.4	179.7	178.6	171.3	-170.5	-4.7	109.2	P74 D75	R72-P74 WeakPolarHBondContact O-CD 3.43Å; R72-D75 IonicContact NH2-OD1 3.21Å; R72-D75 IonicContact NH2-OD2 2.69Å; R72-D75 PolarHBondContact NH2-OD2 3.14Å
73	I	96.6	Very high	94.5	Very high	15 Å²	15	50.4 Å²	50.4	8%	0.077	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-78.9	119.4	170.6	-49.3	-58.4	0	0	0	108.5	R78 F104 V187	I73-R78 HydrophobicContact CG2-CG 4.3Å; I73-F104 HydrophobicContact CD1-CE1 4.48Å; I73-F104 HydrophobicContact CD1-CE2 4.49Å; I73-F104 HydrophobicContact CD1-CZ 3.67Å; I73-F104 HydrophobicContact CG2-CE2 4.37Å; I73-V187 HydrophobicContact CD1-CG2 4.38Å; I73-V187 HydrophobicContact CG2-CG2 3.84Å
74	P	96.7	Very high	95.1	Very high	4 Å²	4	49.8 Å²	49.8	3%	0.026	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-63.9	140.8	176.5	-18.6	31.1	0	0	0	111.3	R72 V76 C77 Q140 V143	R72-P74 WeakPolarHBondContact O-CD 3.43Å; P74-V76 VanDerWaalsContact C-N 3.26Å; P74-V76 HydrophobicContact CB-CG2 4.06Å; P74-V76 PolarHBondContact O-N 3.25Å; P74-C77 WeakPolarHBondContact O-CB 3.35Å; P74-C77 PolarHBondContact O-N 2.8Å; P74-Q140 WeakPolarHBondContact CG-O 3.39Å; P74-V143 WeakPolarHBondContact CG-O 3.46Å
75	D	97.1	Very high	95.9	Very high	96 Å²	96	47.9 Å²	47.9	51%	0.513	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-63.4	-34.8	-175.4	-63.3	-39.1	0	0	0	111.6	R72 C77 R78	R72-D75 IonicContact NH2-OD1 3.21Å; R72-D75 IonicContact NH2-OD2 2.69Å; R72-D75 PolarHBondContact NH2-OD2 3.14Å; D75-C77 PolarHBondContact O-N 3.21Å; D75-R78 WeakPolarHBondContact O-CB 3.36Å; D75-R78 PolarHBondContact O-N 2.75Å
76	V	97.6	Very high	96.5	Very high	51 Å²	51	46.5 Å²	46.5	31%	0.309	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-60	-32.3	175.1	-61.8	0	0	0	0	112.7	P74 R78 T79 E80 P106 S141	P74-V76 VanDerWaalsContact C-N 3.26Å; P74-V76 HydrophobicContact CB-CG2 4.06Å; P74-V76 PolarHBondContact O-N 3.25Å; V76-R78 PolarHBondContact O-N 3.46Å; V76-T79 PolarHBondContact O-N 2.81Å; V76-T79 PolarHBondContact O-OG1 3.46Å; V76-E80 WeakPolarHBondContact O-CB 3.26Å; V76-E80 PolarHBondContact O-N 2.92Å; V76-P106 HydrophobicContact CB-CG 4.34Å; V76-P106 HydrophobicContact CG2-CG 3.88Å; V76-S141 WeakPolarHBondContact CG2-O 3.41Å
77	C	97.8	Very high	97	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-72.6	-8.4	179	-62.6	0	0	0	0	113.1	P74 D75 C82 F104 Y142 V187 Q188	P74-C77 WeakPolarHBondContact O-CB 3.35Å; P74-C77 PolarHBondContact O-N 2.8Å; D75-C77 PolarHBondContact O-N 3.21Å; C77-C82 VanDerWaalsContact CA-SG 3.53Å; C77-F104 HydrophobicContact CB-CD2 4.25Å; C77-F104 HydrophobicContact CB-CE2 4.12Å; C77-Y142 PolarHBondContact SG-O 3.16Å; C77-V187 HydrophobicContact CB-CG1 4.46Å; C77-V187 CarbonylContact O-C 3.56Å; C77-V187 WeakPolarHBondContact O-CA 2.95Å; C77-Q188 PolarHBondContact O-N 3.35Å
78	R	97.9	Very high	97.2	Very high	109 Å²	109	43.7 Å²	43.7	41%	0.411	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-92.6	-16.5	176.8	-55.7	-179.9	169.9	-73.9	-4.7	112.9	I73 D75 V76 S185 G186 Q188	I73-R78 HydrophobicContact CG2-CG 4.3Å; D75-R78 WeakPolarHBondContact O-CB 3.36Å; D75-R78 PolarHBondContact O-N 2.75Å; V76-R78 PolarHBondContact O-N 3.46Å; R78-S185 VanDerWaalsContact CZ-O 3.25Å; R78-S185 PolarHBondContact NH1-O 2.68Å; R78-S185 PolarHBondContact NH2-O 3.35Å; R78-G186 WeakPolarHBondContact CA-O 3.47Å; R78-Q188 PolarHBondContact O-OE1 3.43Å
79	T	97.1	Very high	97.2	Very high	101 Å²	101	38.9 Å²	38.9	62%	0.62	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-122.1	-22.7	-172.1	55.4	0	0	0	0	113.6	V76 Q188	V76-T79 PolarHBondContact O-N 2.81Å; V76-T79 PolarHBondContact O-OG1 3.46Å; T79-Q188 PolarHBondContact O-OE1 3.35Å
80	E	98	Very high	97.2	Very high	78 Å²	78	38.2 Å²	38.2	36%	0.364	20%	0.195	S	C	.	.	S	Bend	trans	-107.1	145.4	176.3	-67.9	-173.5	-144	0	0	111.1	V76 C82 P106 S108 Q188	V76-E80 WeakPolarHBondContact O-CB 3.26Å; V76-E80 PolarHBondContact O-N 2.92Å; E80-C82 PolarHBondContact O-N 3.36Å; E80-C82 PolarHBondContact O-SG 2.96Å; E80-C82 VanDerWaalsContact O-SG 3.41Å; E80-P106 HydrophobicContact CB-CB 4.1Å; E80-P106 HydrophobicContact CB-CG 4.45Å; E80-S108 PolarHBondContact OE2-OG 3.28Å; E80-Q188 WeakPolarHBondContact O-CB 3.47Å
81	D	98.4	Very high	97.2	Very high	71 Å²	71	38.9 Å²	38.9	38%	0.38	19%	0.19	S	C	.	.			trans	-58.8	123.1	173.8	-76	-10	0	0	0	110.5	P106 V107 Q188 K190	D81-P106 WeakPolarHBondContact O-CA 3.46Å; D81-V107 WeakPolarHBondContact O-CG2 3.24Å; D81-V107 PolarHBondContact O-N 2.83Å; D81-Q188 WeakPolarHBondContact CA-O 3.43Å; D81-Q188 PolarHBondContact OD1-NE2 2.99Å; D81-K190 HydrophobicContact CB-CB 4.28Å; D81-K190 HydrophobicContact CB-CG 3.47Å; D81-K190 VanDerWaalsContact CB-CG 3.47Å; D81-K190 WeakPolarHBondContact OD1-CE 3.4Å; D81-K190 WeakPolarHBondContact OD1-CG 3.28Å; D81-K190 WeakPolarHBondContact OD2-CE 3.24Å
82	C	98.6	Very high	97.2	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	150.6	-177.5	-68.8	0	0	0	0	113	C77 E80 C105 V187 Q188 K190 E191	C77-C82 VanDerWaalsContact CA-SG 3.53Å; E80-C82 PolarHBondContact O-N 3.36Å; E80-C82 PolarHBondContact O-SG 2.96Å; E80-C82 VanDerWaalsContact O-SG 3.41Å; C82-C105 CarbonylContact C-O 3.5Å; C82-C105 VanDerWaalsContact CA-O 3.23Å; C82-C105 WeakPolarHBondContact CA-O 3.33Å; C82-C105 WeakPolarHBondContact CB-O 3.47Å; C82-V187 HydrophobicContact CB-CG1 3.97Å; C82-Q188 PolarHBondContact N-O 2.85Å; C82-K190 PolarHBondContact O-N 3.37Å; C82-E191 PolarHBondContact O-N 3.4Å
83	C	98.4	Very high	97.3	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.007	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	148.7	160.1	63.7	0	0	0	0	110.7	F104 C105 V107 K110 E191 Y193	C83-F104 WeakPolarHBondContact O-CA 3.34Å; C83-F104 WeakPolarHBondContact O-CB 3.38Å; C83-C105 PolarHBondContact N-O 3.47Å; C83-C105 PolarHBondContact O-N 3.22Å; C83-C105 VanDerWaalsContact O-N 3.14Å; C83-V107 HydrophobicContact CB-CG2 4.23Å; C83-K110 WeakPolarHBondContact SG-CE 3.19Å; C83-E191 CarbonylContact C-O 3.56Å; C83-E191 WeakPolarHBondContact CA-O 3.46Å; C83-E191 HydrophobicContact CB-CB 4Å; C83-Y193 HydrophobicContact CB-CD2 4.48Å; C83-Y193 HydrophobicContact CB-CE2 4Å
84	L	98.8	Very high	97.4	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	138.8	178.2	-177.8	154.1	0	0	0	110.4	V86 I102 C103 F104 I179 A182 L189 E191 V192 Y193	L84-V86 HydrophobicContact CD2-CG2 3.43Å; L84-V86 VanDerWaalsContact CD2-CG2 3.43Å; L84-I102 HydrophobicContact CD1-CB 4.33Å; L84-I102 HydrophobicContact CD1-CD1 3.87Å; L84-I102 HydrophobicContact CD2-CB 4.1Å; L84-I102 HydrophobicContact CD2-CG2 3.99Å; L84-I102 HydrophobicContact CG-CB 4.25Å; L84-C103 CarbonylContact C-O 3.57Å; L84-C103 VanDerWaalsContact CA-O 3.26Å; L84-C103 WeakPolarHBondContact CA-O 3.49Å; L84-F104 HydrophobicContact CB-CB 4.02Å; L84-F104 HydrophobicContact CD1-CB 4.29Å; L84-F104 HydrophobicContact CD1-CD1 4.42Å; L84-F104 HydrophobicContact CG-CB 4.2Å; L84-I179 HydrophobicContact CD2-CG1 4.21Å; L84-A182 HydrophobicContact CD1-CB 3.82Å; L84-L189 HydrophobicContact CB-CD1 3.39Å; L84-L189 HydrophobicContact CB-CD2 4.38Å; L84-L189 HydrophobicContact CD1-CD1 4.24Å; L84-L189 HydrophobicContact CD1-CD2 3.96Å; L84-L189 HydrophobicContact CG-CD1 4.46Å; L84-E191 PolarHBondContact N-O 3.3Å; L84-V192 HydrophobicContact CB-CG2 4.27Å; L84-V192 HydrophobicContact CD2-CG1 4.33Å; L84-V192 HydrophobicContact CD2-CG2 4.36Å; L84-V192 CarbonylContact O-C 3.55Å; L84-V192 WeakPolarHBondContact O-CA 3.26Å; L84-Y193 PolarHBondContact O-N 3.1Å
85	G	98.5	Very high	97.5	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	142	172.3	0	0	0	0	0	110.7	I102 C103 Y193 V228 A232	G85-I102 WeakPolarHBondContact O-CA 3.49Å; G85-C103 PolarHBondContact N-O 3.24Å; G85-C103 PolarHBondContact O-N 3.44Å; G85-C103 VanDerWaalsContact O-N 3.08Å; G85-Y193 CarbonylContact C-O 3.06Å; G85-Y193 VanDerWaalsContact CA-O 3.3Å; G85-Y193 WeakPolarHBondContact CA-O 3.47Å; G85-V228 VanDerWaalsContact N-CG2 3.29Å; G85-A232 WeakPolarHBondContact O-CB 3.38Å
86	V	98.5	Very high	97.4	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.006	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	130.2	175	-169.8	0	0	0	0	109.3	L84 Y100 G101 I102 A175 I179 V192 Y193 V194 D195	L84-V86 HydrophobicContact CD2-CG2 3.43Å; L84-V86 VanDerWaalsContact CD2-CG2 3.43Å; V86-Y100 HydrophobicContact CG1-CD1 4.24Å; V86-G101 WeakPolarHBondContact CA-O 3.41Å; V86-I102 HydrophobicContact CB-CG2 4.37Å; V86-I102 HydrophobicContact CG1-CG2 4.19Å; V86-I102 HydrophobicContact CG2-CG2 3.91Å; V86-A175 HydrophobicContact CG1-CB 4.03Å; V86-I179 HydrophobicContact CG2-CD1 4.15Å; V86-I179 HydrophobicContact CG2-CG1 4.08Å; V86-V192 HydrophobicContact CG2-CG1 4.36Å; V86-Y193 PolarHBondContact N-O 3.09Å; V86-V194 HydrophobicContact CB-CB 4.35Å; V86-V194 HydrophobicContact CB-CG1 4.13Å; V86-V194 HydrophobicContact CB-CG2 4.04Å; V86-V194 HydrophobicContact CG1-CG1 4.49Å; V86-V194 HydrophobicContact CG2-CG2 3.87Å; V86-D195 PolarHBondContact O-N 2.71Å; V86-D195 VanDerWaalsContact O-N 3.07Å
87	D	97.7	Very high	97.4	Very high	7 Å²	7	23.3 Å²	23.3	4%	0.037	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	169.5	172.5	-162.7	3.7	0	0	0	110.4	G101 V229 A232 S233	D87-G101 PolarHBondContact N-O 3.03Å; D87-G101 VanDerWaalsContact N-O 3.1Å; D87-G101 PolarHBondContact O-N 2.99Å; D87-V229 HydrophobicContact CB-CG1 4.12Å; D87-A232 HydrophobicContact CB-CB 4.31Å; D87-S233 WeakPolarHBondContact OD2-CA 3.29Å; D87-S233 WeakPolarHBondContact OD2-CB 3.44Å; D87-S233 PolarHBondContact OD2-OG 3.16Å
88	E	96.5	Very high	97.4	Very high	21 Å²	21	23.3 Å²	23.3	10%	0.098	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	163.4	176.1	82.7	-94.8	-179.2	0	0	114.6	R91 V99 Y100	E88-R91 HydrophobicContact CG-CB 4.25Å; E88-R91 WeakPolarHBondContact OE1-CD 3.48Å; E88-V99 CarbonylContact C-O 3.56Å; E88-V99 VanDerWaalsContact CA-O 3.26Å; E88-V99 WeakPolarHBondContact CA-O 3.37Å; E88-V99 WeakPolarHBondContact CB-O 3.43Å; E88-Y100 HydrophobicContact CB-CD1 4Å; E88-Y100 HydrophobicContact CB-CD2 4.04Å; E88-Y100 HydrophobicContact CB-CE1 3.76Å; E88-Y100 HydrophobicContact CB-CE2 3.82Å; E88-Y100 HydrophobicContact CB-CG 4.1Å; E88-Y100 VanDerWaalsContact CD-OH 3.32Å; E88-Y100 HydrophobicContact CG-CE1 4.48Å; E88-Y100 HydrophobicContact CG-CE2 4.32Å; E88-Y100 WeakPolarHBondContact OE2-CE1 3.3Å; E88-Y100 PolarHBondContact OE2-OH 3.34Å
89	A	95.8	Very high	97.4	Very high	8 Å²	8	18.1 Å²	18.1	7%	0.066	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	143.1	169.3	0	0	0	0	0	110.5	V99 A236 K237 R240	A89-V99 PolarHBondContact N-O 3.05Å; A89-V99 PolarHBondContact O-N 2.98Å; A89-A236 HydrophobicContact CB-CB 3.98Å; A89-K237 HydrophobicContact CB-CB 4.43Å; A89-K237 HydrophobicContact CB-CG 3.84Å; A89-R240 HydrophobicContact CB-CB 4.16Å
90	G	95.4	Very high	97.5	Very high	8 Å²	8	13.6 Å²	13.6	8%	0.082	8%	0.077	C	C	.	.			trans	79.7	29.1	175.1	0	0	0	0	0	114.7	R240 R289	G90-R240 VanDerWaalsContact CA-CD 3.48Å; G90-R289 VanDerWaalsContact O-CZ 3.3Å; G90-R289 PolarHBondContact O-NH1 2.57Å; G90-R289 PolarHBondContact O-NH2 2.91Å
91	R	95.7	Very high	97.5	Very high	47 Å²	47	9.9 Å²	9.9	18%	0.177	6%	0.06	C	C	.	.	S	Bend	trans	-64.1	-47.2	175	-172.9	-175.6	179.2	82.9	11.2	113.3	E88 M98 L167 N168 S171 R289 W292	E88-R91 HydrophobicContact CG-CB 4.25Å; E88-R91 WeakPolarHBondContact OE1-CD 3.48Å; R91-M98 HydrophobicContact CB-SD 4.16Å; R91-M98 HydrophobicContact CG-SD 4.14Å; R91-L167 HydrophobicContact CG-CD2 4.18Å; R91-N168 PolarHBondContact NH2-OD1 2.83Å; R91-S171 PolarHBondContact NH1-OG 3.35Å; R91-R289 PolarHBondContact O-NH1 3.39Å; R91-R289 VanDerWaalsContact O-NH1 3.14Å; R91-W292 WeakPolarHBondContact O-CZ2 3.42Å
92	G	95.5	Very high	97.5	Very high	35 Å²	35	6.5 Å²	6.5	36%	0.361	4%	0.042	S	C	.	.	S	Bend	trans	-83.2	-29.6	-172.6	0	0	0	0	0	119.1	W292	G92-W292 PolarHBondContact O-NE1 3.27Å
93	P	97.7	Very high	97.5	Very high	0 Å²	0	6.5 Å²	6.5	0%	0	4%	0.042	C	C	.	.			trans	-53.8	144.1	-179.5	-30.5	37.3	0	0	0	114.1	L95 G263 Y264 R289 W292	P93-L95 VanDerWaalsContact C-N 3.34Å; P93-L95 VanDerWaalsContact CB-O 3.27Å; P93-L95 WeakPolarHBondContact CB-O 3.24Å; P93-G263 CarbonylContact C-O 3.57Å; P93-G263 VanDerWaalsContact CA-O 3.25Å; P93-G263 WeakPolarHBondContact CA-O 3.37Å; P93-G263 WeakPolarHBondContact CB-O 3.42Å; P93-Y264 HydrophobicContact CG-CD1 4.3Å; P93-Y264 HydrophobicContact CG-CD2 4.11Å; P93-Y264 HydrophobicContact CG-CE1 3.93Å; P93-Y264 HydrophobicContact CG-CE2 3.72Å; P93-Y264 HydrophobicContact CG-CG 4.39Å; P93-R289 WeakPolarHBondContact O-CD 3.5Å; P93-R289 PolarHBondContact O-NE 2.65Å; P93-R289 PolarHBondContact O-NH1 3.31Å; P93-W292 VanDerWaalsContact O-CE2 3.29Å; P93-W292 WeakPolarHBondContact O-CZ2 3.34Å; P93-W292 PolarHBondContact O-NE1 3.18Å
94	V	98.3	Very high	97.5	Very high	0 Å²	0	6.5 Å²	6.5	0%	0	4%	0.041	C	C	.	.	S	Bend	trans	-81.8	-19.5	167.8	58.5	0	0	0	0	111.5	G263 P265 T270 L274 V288 R289 W292 A295	V94-G263 WeakPolarHBondContact CG1-O 3.4Å; V94-G263 PolarHBondContact N-O 3.36Å; V94-P265 HydrophobicContact CB-CG 4.19Å; V94-P265 HydrophobicContact CG1-CG 4.31Å; V94-T270 HydrophobicContact CG1-CG2 3.76Å; V94-L274 HydrophobicContact CG1-CD1 4.03Å; V94-L274 HydrophobicContact CG2-CD1 4.37Å; V94-V288 HydrophobicContact CG2-CG1 4.19Å; V94-R289 WeakPolarHBondContact O-CB 3.35Å; V94-R289 WeakPolarHBondContact O-CG 3.49Å; V94-R289 PolarHBondContact O-N 3.24Å; V94-W292 HydrophobicContact CB-CB 4.28Å; V94-W292 HydrophobicContact CB-CG 4.08Å; V94-W292 HydrophobicContact CG2-CB 3.79Å; V94-W292 HydrophobicContact CG2-CG 4.09Å; V94-A295 HydrophobicContact CG2-CB 4.19Å
95	L	97.4	Very high	97.4	Very high	2 Å²	2	6.5 Å²	6.5	1%	0.01	4%	0.041	C	C	.	.	B	Isolated β-bridge	trans	-108.8	146.3	176.9	-55.2	-174.6	0	0	0	111.9	P93 Y260 G263 T270 W273 L274 F287 V288	P93-L95 VanDerWaalsContact C-N 3.34Å; P93-L95 VanDerWaalsContact CB-O 3.27Å; P93-L95 WeakPolarHBondContact CB-O 3.24Å; L95-Y260 HydrophobicContact CD1-CD2 3.95Å; L95-Y260 HydrophobicContact CD1-CG 3.87Å; L95-G263 PolarHBondContact N-O 2.95Å; L95-T270 HydrophobicContact CD1-CG2 3.83Å; L95-T270 HydrophobicContact CG-CG2 4.02Å; L95-W273 HydrophobicContact CD1-CD2 4.46Å; L95-W273 HydrophobicContact CD1-CE3 4.06Å; L95-W273 HydrophobicContact CD1-CZ3 4.47Å; L95-W273 HydrophobicContact CD2-CE3 4.22Å; L95-W273 HydrophobicContact CD2-CZ3 4.05Å; L95-L274 HydrophobicContact CD2-CD2 3.9Å; L95-F287 HydrophobicContact CB-CD1 4.19Å; L95-F287 HydrophobicContact CB-CE1 3.82Å; L95-F287 HydrophobicContact CB-CZ 4.33Å; L95-F287 HydrophobicContact CD1-CE1 4.28Å; L95-F287 HydrophobicContact CD2-CD1 4.46Å; L95-V288 HydrophobicContact CD2-CB 4.25Å; L95-V288 HydrophobicContact CD2-CG1 4.31Å; L95-V288 HydrophobicContact CD2-CG2 3.65Å
96	G	96.3	Very high	97.4	Very high	0 Å²	0	6.6 Å²	6.6	0%	0	4%	0.042	C	C	.	.	S	Bend	trans	77.6	178.3	170.4	0	0	0	0	0	115.1	F287 R289	G96-F287 PolarHBondContact N-O 2.8Å; G96-R289 VanDerWaalsContact O-CZ 3.24Å; G96-R289 PolarHBondContact O-NE 3.49Å; G96-R289 PolarHBondContact O-NH2 3.05Å
97	P	97	Very high	97.4	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	6%	0.055	C	C	.	.			trans	-77.9	163.9	-171.6	35.5	-40.7	0	0	0	112.8	I149 L150 V243 V244 R289	P97-I149 HydrophobicContact CB-CG2 3.96Å; P97-L150 VanDerWaalsContact CA-O 3.22Å; P97-L150 WeakPolarHBondContact CA-O 3.13Å; P97-L150 WeakPolarHBondContact CB-O 3.48Å; P97-V243 HydrophobicContact CG-CB 4.23Å; P97-V243 HydrophobicContact CG-CG1 3.65Å; P97-V244 HydrophobicContact CG-CG2 4.23Å; P97-R289 PolarHBondContact O-NH2 3.48Å
98	M	97.7	Very high	97.3	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	131.4	162.6	-175.9	169.4	70.4	0	0	107.9	R91 Y100 L150 I155 L167	R91-M98 HydrophobicContact CB-SD 4.16Å; R91-M98 HydrophobicContact CG-SD 4.14Å; M98-Y100 HydrophobicContact CE-CD2 4.37Å; M98-Y100 HydrophobicContact CE-CE2 3.88Å; M98-Y100 HydrophobicContact CG-CE2 4.48Å; M98-Y100 HydrophobicContact SD-CE2 4.2Å; M98-L150 HydrophobicContact CB-CB 4.5Å; M98-L150 HydrophobicContact CE-CD1 3.5Å; M98-L150 VanDerWaalsContact CE-CD1 3.5Å; M98-L150 PolarHBondContact N-O 3.26Å; M98-L150 WeakPolarHBondContact O-CB 3.49Å; M98-L150 PolarHBondContact O-N 2.92Å; M98-I155 HydrophobicContact CB-CD1 3.7Å; M98-L167 HydrophobicContact CE-CD1 3.82Å; M98-L167 HydrophobicContact SD-CD1 4.2Å
99	V	98.1	Very high	97.2	Very high	0 Å²	0	14 Å²	14	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	121.2	-178	-175	0	0	0	0	108.9	E88 A89 L147 Q148 I149 A236 A239 R240	E88-V99 CarbonylContact C-O 3.56Å; E88-V99 VanDerWaalsContact CA-O 3.26Å; E88-V99 WeakPolarHBondContact CA-O 3.37Å; E88-V99 WeakPolarHBondContact CB-O 3.43Å; A89-V99 PolarHBondContact N-O 3.05Å; A89-V99 PolarHBondContact O-N 2.98Å; V99-L147 HydrophobicContact CG1-CB 4.47Å; V99-L147 HydrophobicContact CG1-CD2 4.3Å; V99-Q148 WeakPolarHBondContact CA-O 3.42Å; V99-I149 HydrophobicContact CG1-CG1 4.09Å; V99-I149 HydrophobicContact CG2-CB 4.45Å; V99-I149 HydrophobicContact CG2-CG1 4.05Å; V99-I149 HydrophobicContact CG2-CG2 4.25Å; V99-A236 HydrophobicContact CG1-CB 4.37Å; V99-A239 HydrophobicContact CG1-CB 4.11Å; V99-R240 HydrophobicContact CB-CB 4.38Å; V99-R240 HydrophobicContact CG2-CB 3.82Å; V99-R240 HydrophobicContact CG2-CG 4.44Å
100	Y	98.3	Very high	97	Very high	7 Å²	7	16.3 Å²	16.3	3%	0.027	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	139.1	167.1	-95	-89.8	0	0	0	109.4	V86 E88 M98 L147 Q148 S171 T174 A175	V86-Y100 HydrophobicContact CG1-CD1 4.24Å; E88-Y100 HydrophobicContact CB-CD1 4Å; E88-Y100 HydrophobicContact CB-CD2 4.04Å; E88-Y100 HydrophobicContact CB-CE1 3.76Å; E88-Y100 HydrophobicContact CB-CE2 3.82Å; E88-Y100 HydrophobicContact CB-CG 4.1Å; E88-Y100 VanDerWaalsContact CD-OH 3.32Å; E88-Y100 HydrophobicContact CG-CE1 4.48Å; E88-Y100 HydrophobicContact CG-CE2 4.32Å; E88-Y100 WeakPolarHBondContact OE2-CE1 3.3Å; E88-Y100 PolarHBondContact OE2-OH 3.34Å; M98-Y100 HydrophobicContact CE-CD2 4.37Å; M98-Y100 HydrophobicContact CE-CE2 3.88Å; M98-Y100 HydrophobicContact CG-CE2 4.48Å; M98-Y100 HydrophobicContact SD-CE2 4.2Å; Y100-L147 CarbonylContact O-C 3.56Å; Y100-L147 VanDerWaalsContact O-CA 3.24Å; Y100-L147 WeakPolarHBondContact O-CA 3.43Å; Y100-Q148 PolarHBondContact N-O 3.28Å; Y100-Q148 PolarHBondContact O-N 3.36Å; Y100-S171 VanDerWaalsContact OH-CB 3.29Å; Y100-S171 WeakPolarHBondContact OH-CB 3.07Å; Y100-T174 HydrophobicContact CD2-CG2 3.68Å; Y100-T174 HydrophobicContact CG-CG2 3.67Å; Y100-A175 HydrophobicContact CD1-CB 4.25Å; Y100-A175 HydrophobicContact CE1-CB 4.19Å
101	G	98.1	Very high	96.7	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	145.9	176.2	0	0	0	0	0	112.2	V86 D87 A146	V86-G101 WeakPolarHBondContact CA-O 3.41Å; D87-G101 PolarHBondContact N-O 3.03Å; D87-G101 VanDerWaalsContact N-O 3.1Å; D87-G101 PolarHBondContact O-N 2.99Å; G101-A146 CarbonylContact C-O 3.59Å; G101-A146 WeakPolarHBondContact CA-O 3.29Å
102	I	98.6	Very high	96.6	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	144.8	165.2	61.9	162.6	0	0	0	110.1	L84 G85 V86 F104 W145 A146 L178 A182	L84-I102 HydrophobicContact CD1-CB 4.33Å; L84-I102 HydrophobicContact CD1-CD1 3.87Å; L84-I102 HydrophobicContact CD2-CB 4.1Å; L84-I102 HydrophobicContact CD2-CG2 3.99Å; L84-I102 HydrophobicContact CG-CB 4.25Å; G85-I102 WeakPolarHBondContact O-CA 3.49Å; V86-I102 HydrophobicContact CB-CG2 4.37Å; V86-I102 HydrophobicContact CG1-CG2 4.19Å; V86-I102 HydrophobicContact CG2-CG2 3.91Å; I102-F104 HydrophobicContact CD1-CD1 4.49Å; I102-W145 CarbonylContact O-C 3.5Å; I102-W145 WeakPolarHBondContact O-CA 3.38Å; I102-W145 VanDerWaalsContact O-CB 3.26Å; I102-W145 WeakPolarHBondContact O-CB 3.33Å; I102-A146 HydrophobicContact CD1-CB 3.94Å; I102-A146 HydrophobicContact CG1-CB 3.69Å; I102-A146 WeakPolarHBondContact CG1-O 3.21Å; I102-A146 PolarHBondContact N-O 3.38Å; I102-A146 PolarHBondContact O-N 3.39Å; I102-L178 HydrophobicContact CD1-CB 4.15Å; I102-L178 WeakPolarHBondContact CD1-O 3.26Å; I102-L178 HydrophobicContact CG1-CB 4.23Å; I102-L178 HydrophobicContact CG2-CB 3.65Å; I102-L178 HydrophobicContact CG2-CD1 4.04Å; I102-L178 HydrophobicContact CG2-CG 4.46Å; I102-A182 HydrophobicContact CD1-CB 3.98Å
103	C	98.4	Very high	96.3	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	144.1	169.5	-177.1	0	0	0	0	108	L84 G85 G144 V228 A231 A232	L84-C103 CarbonylContact C-O 3.57Å; L84-C103 VanDerWaalsContact CA-O 3.26Å; L84-C103 WeakPolarHBondContact CA-O 3.49Å; G85-C103 PolarHBondContact N-O 3.24Å; G85-C103 PolarHBondContact O-N 3.44Å; G85-C103 VanDerWaalsContact O-N 3.08Å; C103-G144 CarbonylContact C-O 3.59Å; C103-G144 WeakPolarHBondContact CA-O 3.06Å; C103-V228 HydrophobicContact CB-CG2 4.32Å; C103-V228 WeakPolarHBondContact O-CG2 3.43Å; C103-A231 HydrophobicContact CB-CB 3.94Å; C103-A231 VanDerWaalsContact SG-CB 3.56Å; C103-A232 HydrophobicContact CB-CB 3.98Å
104	F	98.4	Very high	95.8	Very high	1 Å²	1	26.7 Å²	26.7	0%	0.004	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	150	179.4	57.9	-90.4	0	0	0	111.6	I73 C77 C83 L84 I102 G144 V187	I73-F104 HydrophobicContact CD1-CE1 4.48Å; I73-F104 HydrophobicContact CD1-CE2 4.49Å; I73-F104 HydrophobicContact CD1-CZ 3.67Å; I73-F104 HydrophobicContact CG2-CE2 4.37Å; C77-F104 HydrophobicContact CB-CD2 4.25Å; C77-F104 HydrophobicContact CB-CE2 4.12Å; C83-F104 WeakPolarHBondContact O-CA 3.34Å; C83-F104 WeakPolarHBondContact O-CB 3.38Å; L84-F104 HydrophobicContact CB-CB 4.02Å; L84-F104 HydrophobicContact CD1-CB 4.29Å; L84-F104 HydrophobicContact CD1-CD1 4.42Å; L84-F104 HydrophobicContact CG-CB 4.2Å; I102-F104 HydrophobicContact CD1-CD1 4.49Å; F104-G144 WeakPolarHBondContact CD1-O 3.26Å; F104-G144 VanDerWaalsContact CE1-C 3.48Å; F104-G144 PolarHBondContact N-O 3.08Å; F104-G144 PolarHBondContact O-N 3.07Å; F104-V187 HydrophobicContact CD2-CG1 3.83Å; F104-V187 HydrophobicContact CD2-CG2 3.98Å; F104-V187 HydrophobicContact CE1-CG2 4.39Å; F104-V187 HydrophobicContact CE2-CG1 4.22Å; F104-V187 HydrophobicContact CE2-CG2 3.53Å; F104-V187 HydrophobicContact CG-CG1 4.31Å; F104-V187 HydrophobicContact CZ-CG2 3.77Å
105	C	98.1	Very high	95.3	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	165.1	174.5	65.5	0	0	0	0	110	C82 C83 Y142 V143	C82-C105 CarbonylContact C-O 3.5Å; C82-C105 VanDerWaalsContact CA-O 3.23Å; C82-C105 WeakPolarHBondContact CA-O 3.33Å; C82-C105 WeakPolarHBondContact CB-O 3.47Å; C83-C105 PolarHBondContact N-O 3.47Å; C83-C105 PolarHBondContact O-N 3.22Å; C83-C105 VanDerWaalsContact O-N 3.14Å; C105-Y142 WeakPolarHBondContact CA-O 3.43Å; C105-Y142 HydrophobicContact CB-CD2 4.23Å; C105-Y142 WeakPolarHBondContact CB-O 3.32Å; C105-V143 HydrophobicContact CB-CG2 4.41Å
106	P	98.4	Very high	94.6	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.006	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.5	142.1	172.4	-25.4	35.9	0	0	0	111.8	V76 E80 D81 S108 K109 Y142	V76-P106 HydrophobicContact CB-CG 4.34Å; V76-P106 HydrophobicContact CG2-CG 3.88Å; E80-P106 HydrophobicContact CB-CB 4.1Å; E80-P106 HydrophobicContact CB-CG 4.45Å; D81-P106 WeakPolarHBondContact O-CA 3.46Å; P106-S108 WeakPolarHBondContact CB-OG 3.2Å; P106-S108 PolarHBondContact O-N 2.92Å; P106-K109 HydrophobicContact CB-CB 4.34Å; P106-K109 HydrophobicContact CB-CG 4.01Å; P106-K109 HydrophobicContact CG-CG 4.16Å; P106-K109 WeakPolarHBondContact O-CA 3.45Å; P106-K109 WeakPolarHBondContact O-CB 3.47Å; P106-K109 PolarHBondContact O-N 3.43Å; P106-Y142 VanDerWaalsContact CD-O 3.24Å; P106-Y142 WeakPolarHBondContact CD-O 3.49Å
107	V	97.3	Very high	93.7	Very high	47 Å²	47	41.7 Å²	41.7	29%	0.285	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-58.1	-33.5	176.8	172.3	0	0	0	0	110.9	D81 C83 K109 K110	D81-V107 WeakPolarHBondContact O-CG2 3.24Å; D81-V107 PolarHBondContact O-N 2.83Å; C83-V107 HydrophobicContact CB-CG2 4.23Å; V107-K109 PolarHBondContact O-N 2.81Å; V107-K110 HydrophobicContact CG1-CD 4.26Å; V107-K110 WeakPolarHBondContact O-CG 3.42Å; V107-K110 PolarHBondContact O-N 3.19Å
108	S	96.6	Very high	92.4	Very high	78 Å²	78	41.7 Å²	41.7	55%	0.545	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-59.7	-22.6	173.6	58.1	0	0	0	0	113.6	E80 P106	E80-S108 PolarHBondContact OE2-OG 3.28Å; P106-S108 WeakPolarHBondContact CB-OG 3.2Å; P106-S108 PolarHBondContact O-N 2.92Å
109	K	95.1	Very high	90.5	Very high	61 Å²	61	43.4 Å²	43.4	27%	0.265	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-104.9	9.5	-174.6	-63.2	-66	-172.3	172.4	0	114.3	P106 V107 E111 E112 L113 Y142	P106-K109 HydrophobicContact CB-CB 4.34Å; P106-K109 HydrophobicContact CB-CG 4.01Å; P106-K109 HydrophobicContact CG-CG 4.16Å; P106-K109 WeakPolarHBondContact O-CA 3.45Å; P106-K109 WeakPolarHBondContact O-CB 3.47Å; P106-K109 PolarHBondContact O-N 3.43Å; V107-K109 PolarHBondContact O-N 2.81Å; K109-E111 PolarHBondContact O-N 2.63Å; K109-E112 HydrophobicContact CD-CG 4.41Å; K109-E112 WeakPolarHBondContact CD-OE1 3.41Å; K109-E112 WeakPolarHBondContact CD-OE2 3.31Å; K109-E112 WeakPolarHBondContact CE-OE1 3.08Å; K109-E112 IonicContact NZ-OE1 2.77Å; K109-E112 PolarHBondContact NZ-OE1 2.88Å; K109-E112 IonicContact NZ-OE2 2.67Å; K109-E112 PolarHBondContact NZ-OE2 3.41Å; K109-E112 PolarHBondContact O-N 2.65Å; K109-L113 PolarHBondContact O-N 3.38Å; K109-Y142 HydrophobicContact CB-CD2 3.8Å; K109-Y142 HydrophobicContact CB-CE2 4.2Å; K109-Y142 HydrophobicContact CD-CD2 4.49Å; K109-Y142 HydrophobicContact CG-CD2 4.06Å; K109-Y142 HydrophobicContact CG-CG 4.38Å
110	K	91.3	Very high	88.5	Confident	56 Å²	56	50.5 Å²	50.5	24%	0.243	26%	0.258	C	S	.	.	H	α-helix	trans	-58	-42	179.9	-79.1	176.7	173.8	-179.7	0	113.8	C83 V107 L113 K114 E191 Y193	C83-K110 WeakPolarHBondContact SG-CE 3.19Å; V107-K110 HydrophobicContact CG1-CD 4.26Å; V107-K110 WeakPolarHBondContact O-CG 3.42Å; V107-K110 PolarHBondContact O-N 3.19Å; K110-L113 PolarHBondContact O-N 2.88Å; K110-K114 PolarHBondContact O-N 3.37Å; K110-K114 VanDerWaalsContact O-N 3.07Å; K110-E191 VanDerWaalsContact CE-OE2 3.23Å; K110-E191 WeakPolarHBondContact CE-OE2 3.46Å; K110-E191 IonicContact NZ-OE1 3.3Å; K110-E191 PolarHBondContact NZ-OE1 3.05Å; K110-E191 IonicContact NZ-OE2 2.65Å; K110-E191 PolarHBondContact NZ-OE2 3.28Å; K110-Y193 PolarHBondContact NZ-OH 3.5Å
111	E	88.9	Confident	86.5	Confident	119 Å²	119	51.1 Å²	51.1	56%	0.556	26%	0.263	S	S	*	.	H	α-helix	trans	-70.6	-37.8	179	-65	-56.6	130.2	0	0	111.5	K109 L113 K114 D115	K109-E111 PolarHBondContact O-N 2.63Å; E111-L113 VanDerWaalsContact C-N 3.31Å; E111-L113 PolarHBondContact O-N 3.21Å; E111-K114 WeakPolarHBondContact O-CB 3.45Å; E111-K114 PolarHBondContact O-N 2.91Å; E111-K114 VanDerWaalsContact O-N 3.09Å; E111-K114 WeakPolarHBondContact OE2-CD 3.34Å; E111-K114 IonicContact OE2-NZ 2.81Å; E111-K114 PolarHBondContact OE2-NZ 2.8Å; E111-D115 PolarHBondContact O-N 2.99Å
112	E	92.2	Very high	84.5	Confident	83 Å²	83	58.5 Å²	58.5	39%	0.388	30%	0.295	S	S	.	.	H	α-helix	trans	-60.7	-41	173.5	-72.1	173	-130.8	0	0	111.6	K109 K114 D115 L116 Y142	K109-E112 HydrophobicContact CD-CG 4.41Å; K109-E112 WeakPolarHBondContact CD-OE1 3.41Å; K109-E112 WeakPolarHBondContact CD-OE2 3.31Å; K109-E112 WeakPolarHBondContact CE-OE1 3.08Å; K109-E112 IonicContact NZ-OE1 2.77Å; K109-E112 PolarHBondContact NZ-OE1 2.88Å; K109-E112 IonicContact NZ-OE2 2.67Å; K109-E112 PolarHBondContact NZ-OE2 3.41Å; K109-E112 PolarHBondContact O-N 2.65Å; E112-K114 VanDerWaalsContact C-N 3.31Å; E112-K114 PolarHBondContact O-N 2.82Å; E112-D115 PolarHBondContact O-N 2.94Å; E112-L116 PolarHBondContact O-N 3.14Å; E112-Y142 HydrophobicContact CB-CE2 4.47Å
113	L	90.1	Very high	83	Confident	1 Å²	1	64.8 Å²	64.8	1%	0.005	33%	0.334	C	S	.	.	H	α-helix	trans	-63.3	-38.3	174.3	-175.6	68.2	0	0	0	112	K109 K110 E111 D115 L116 L136 V143 P227 V228 A231	K109-L113 PolarHBondContact O-N 3.38Å; K110-L113 PolarHBondContact O-N 2.88Å; E111-L113 VanDerWaalsContact C-N 3.31Å; E111-L113 PolarHBondContact O-N 3.21Å; L113-D115 VanDerWaalsContact C-N 3.34Å; L113-L116 HydrophobicContact CD1-CD1 4.19Å; L113-L116 WeakPolarHBondContact O-CB 3.49Å; L113-L116 PolarHBondContact O-N 3.18Å; L113-L136 HydrophobicContact CD1-CD2 3.83Å; L113-V143 HydrophobicContact CD1-CG2 4.09Å; L113-P227 HydrophobicContact CD2-CB 4.21Å; L113-P227 HydrophobicContact CG-CB 4.29Å; L113-V228 HydrophobicContact CD2-CB 3.9Å; L113-V228 HydrophobicContact CD2-CG2 4.27Å; L113-A231 HydrophobicContact CD1-CB 4.39Å
114	K	88	Confident	82.3	Confident	104 Å²	104	66.6 Å²	66.6	45%	0.452	34%	0.343	S	S	.	.	H	α-helix	trans	-66.6	-37.5	176.7	-174.5	-176.6	169.9	-168.3	0	111.6	K110 E111 E112 L116 K117 P227	K110-K114 PolarHBondContact O-N 3.37Å; K110-K114 VanDerWaalsContact O-N 3.07Å; E111-K114 WeakPolarHBondContact O-CB 3.45Å; E111-K114 PolarHBondContact O-N 2.91Å; E111-K114 VanDerWaalsContact O-N 3.09Å; E111-K114 WeakPolarHBondContact OE2-CD 3.34Å; E111-K114 IonicContact OE2-NZ 2.81Å; E111-K114 PolarHBondContact OE2-NZ 2.8Å; E112-K114 VanDerWaalsContact C-N 3.31Å; E112-K114 PolarHBondContact O-N 2.82Å; K114-L116 PolarHBondContact O-N 2.57Å; K114-K117 WeakPolarHBondContact O-CA 3.39Å; K114-K117 PolarHBondContact O-N 2.93Å; K114-P227 HydrophobicContact CB-CB 4.27Å; K114-P227 HydrophobicContact CB-CG 3.86Å; K114-P227 HydrophobicContact CD-CG 4.47Å; K114-P227 HydrophobicContact CG-CG 4.05Å
115	D	86.6	Confident	81.8	Confident	120 Å²	120	70.4 Å²	70.4	64%	0.642	36%	0.363	S	S	*	.	H	α-helix	trans	-66.2	-20.2	177.8	-72.4	-20.4	0	0	0	113.2	E111 E112 L113 K117	E111-D115 PolarHBondContact O-N 2.99Å; E112-D115 PolarHBondContact O-N 2.94Å; L113-D115 VanDerWaalsContact C-N 3.34Å; D115-K117 PolarHBondContact O-N 2.86Å; D115-K117 VanDerWaalsContact O-N 3.12Å
116	L	82.2	Confident	81.4	Confident	38 Å²	38	73.9 Å²	73.9	20%	0.199	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-7.9	168	-59.1	-176.3	0	0	0	113.2	E112 L113 K114 V118 L136 A139	E112-L116 PolarHBondContact O-N 3.14Å; L113-L116 HydrophobicContact CD1-CD1 4.19Å; L113-L116 WeakPolarHBondContact O-CB 3.49Å; L113-L116 PolarHBondContact O-N 3.18Å; K114-L116 PolarHBondContact O-N 2.57Å; L116-V118 VanDerWaalsContact C-N 3.28Å; L116-V118 HydrophobicContact CB-CG1 4.16Å; L116-V118 PolarHBondContact O-N 3.36Å; L116-L136 HydrophobicContact CD1-CD2 4.18Å; L116-A139 HydrophobicContact CD1-CB 4.07Å
117	K	78.4	Confident	81	Confident	159 Å²	159	77.2 Å²	77.2	69%	0.691	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	34.8	179.4	-58.4	-173.7	-179.9	-177.4	0	113.9	K114 D115 A119	K114-K117 WeakPolarHBondContact O-CA 3.39Å; K114-K117 PolarHBondContact O-N 2.93Å; D115-K117 PolarHBondContact O-N 2.86Å; D115-K117 VanDerWaalsContact O-N 3.12Å; K117-A119 VanDerWaalsContact C-N 3.25Å; K117-A119 PolarHBondContact O-N 3.34Å
118	V	68.6	Low	80.7	Confident	0 Å²	0	79 Å²	79	0%	0	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-23.6	176.4	-66.5	0	0	0	0	113.1	L116 L136 P227 S230 A231	L116-V118 VanDerWaalsContact C-N 3.28Å; L116-V118 HydrophobicContact CB-CG1 4.16Å; L116-V118 PolarHBondContact O-N 3.36Å; V118-L136 HydrophobicContact CG1-CD2 4.15Å; V118-L136 HydrophobicContact CG1-CG 4.35Å; V118-P227 HydrophobicContact CG2-CB 4.49Å; V118-S230 PolarHBondContact O-OG 3.05Å; V118-A231 HydrophobicContact CG2-CB 4.41Å
119	A	59.1	Low	80.5	Confident	36 Å²	36	77.3 Å²	77.3	30%	0.298	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-16	-171.5	0	0	0	0	0	116.5	K117 S121 S230	K117-A119 VanDerWaalsContact C-N 3.25Å; K117-A119 PolarHBondContact O-N 3.34Å; A119-S121 VanDerWaalsContact C-N 3.28Å; A119-S121 PolarHBondContact O-N 2.83Å; A119-S230 WeakPolarHBondContact CA-OG 3.42Å
120	D	56.2	Low	80.4	Confident	150 Å²	150	77.1 Å²	77.1	80%	0.802	39%	0.394	S	S	*	.			trans	-93.9	36.8	-170.1	-143.9	1.6	0	0	0	112.8
121	S	55.6	Low	80.4	Confident	19 Å²	19	78.4 Å²	78.4	13%	0.133	40%	0.404	C	S	.	.			trans	-100.4	11.9	-153.6	60.4	0	0	0	0	116.9	A119 T123 L124	A119-S121 VanDerWaalsContact C-N 3.28Å; A119-S121 PolarHBondContact O-N 2.83Å; S121-T123 PolarHBondContact O-N 2.85Å; S121-L124 WeakPolarHBondContact O-CG 3.23Å; S121-L124 PolarHBondContact O-N 3.49Å
122	K	57.1	Low	80.6	Confident	156 Å²	156	73.5 Å²	73.5	68%	0.678	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-12.7	-167.6	-68.8	-178	178.8	171.3	0	115.2	S224	K122-S224 WeakPolarHBondContact CE-OG 3.21Å; K122-S224 PolarHBondContact NZ-OG 3.06Å
123	T	67.3	Low	80.6	Confident	132 Å²	132	69.6 Å²	69.6	81%	0.81	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142.3	38.6	176.7	56.7	0	0	0	0	112.4	S121 N125	S121-T123 PolarHBondContact O-N 2.85Å; T123-N125 PolarHBondContact O-N 3Å
124	L	81.9	Confident	80.8	Confident	37 Å²	37	73.6 Å²	73.6	19%	0.194	38%	0.381	C	S	.	.			trans	-69.8	136.2	176.1	-60.4	179.5	0	0	0	111	S121 E128 R129 L132 I234	S121-L124 WeakPolarHBondContact O-CG 3.23Å; S121-L124 PolarHBondContact O-N 3.49Å; L124-E128 VanDerWaalsContact CA-OE2 3.27Å; L124-E128 WeakPolarHBondContact CA-OE2 3.38Å; L124-E128 HydrophobicContact CB-CB 4.13Å; L124-E128 HydrophobicContact CD2-CB 3.98Å; L124-E128 HydrophobicContact CG-CB 4.48Å; L124-R129 HydrophobicContact CB-CG 3.85Å; L124-R129 HydrophobicContact CD1-CG 4.09Å; L124-R129 PolarHBondContact O-NH1 3.11Å; L124-L132 HydrophobicContact CD1-CD1 3.29Å; L124-I234 HydrophobicContact CD1-CD1 3.66Å
125	N	87.9	Confident	81	Confident	81 Å²	81	72 Å²	72	43%	0.433	38%	0.375	S	S	.	.			trans	-77.3	173.1	162.8	71.4	54.3	0	0	0	110.4	T123 A127 E128 R129	T123-N125 PolarHBondContact O-N 3Å; N125-A127 PolarHBondContact O-N 3.41Å; N125-A127 WeakPolarHBondContact OD1-CB 3.47Å; N125-A127 PolarHBondContact OD1-N 2.81Å; N125-E128 VanDerWaalsContact CG-OE2 3.32Å; N125-E128 PolarHBondContact N-OE2 2.86Å; N125-E128 PolarHBondContact ND2-OE1 2.8Å; N125-E128 PolarHBondContact ND2-OE2 3.16Å; N125-E128 VanDerWaalsContact ND2-OE2 3.13Å; N125-E128 PolarHBondContact O-N 3.15Å; N125-E128 WeakPolarHBondContact OD1-CG 3.48Å; N125-E128 PolarHBondContact OD1-N 3.25Å; N125-R129 PolarHBondContact O-N 3.06Å; N125-R129 VanDerWaalsContact O-N 3.1Å
126	E	89.6	Confident	81.3	Confident	74 Å²	74	66.4 Å²	66.4	35%	0.346	35%	0.345	S	S	.	.	H	α-helix	trans	-62.5	-42.4	-176.8	-168.8	-172.3	162.6	0	0	113.2	E128 R129 E130 D241 K245	E126-E128 VanDerWaalsContact C-N 3.31Å; E126-E128 PolarHBondContact O-N 3.34Å; E126-R129 PolarHBondContact O-N 3.15Å; E126-E130 WeakPolarHBondContact O-CB 3.2Å; E126-E130 PolarHBondContact O-N 3.42Å; E126-D241 HydrophobicContact CG-CB 4.39Å; E126-K245 WeakPolarHBondContact OE1-CE 3.35Å; E126-K245 IonicContact OE1-NZ 3.46Å; E126-K245 PolarHBondContact OE1-NZ 2.95Å; E126-K245 WeakPolarHBondContact OE2-CE 3.44Å; E126-K245 IonicContact OE2-NZ 3.22Å; E126-K245 PolarHBondContact OE2-NZ 2.9Å
127	A	90.6	Very high	81.7	Confident	70 Å²	70	66 Å²	66	58%	0.579	34%	0.342	S	S	*	.	H	α-helix	trans	-66	-35.6	179.9	0	0	0	0	0	112	N125 E130 N131	N125-A127 PolarHBondContact O-N 3.41Å; N125-A127 WeakPolarHBondContact OD1-CB 3.47Å; N125-A127 PolarHBondContact OD1-N 2.81Å; A127-E130 PolarHBondContact O-N 3.36Å; A127-N131 PolarHBondContact O-N 3.05Å
128	E	91	Very high	82.4	Confident	84 Å²	84	64.4 Å²	64.4	39%	0.393	34%	0.337	S	S	.	.	H	α-helix	trans	-66.9	-41.1	174.5	-69.5	167.6	155.4	0	0	111.8	L124 N125 E126 E130 N131 L132	L124-E128 VanDerWaalsContact CA-OE2 3.27Å; L124-E128 WeakPolarHBondContact CA-OE2 3.38Å; L124-E128 HydrophobicContact CB-CB 4.13Å; L124-E128 HydrophobicContact CD2-CB 3.98Å; L124-E128 HydrophobicContact CG-CB 4.48Å; N125-E128 VanDerWaalsContact CG-OE2 3.32Å; N125-E128 PolarHBondContact N-OE2 2.86Å; N125-E128 PolarHBondContact ND2-OE1 2.8Å; N125-E128 PolarHBondContact ND2-OE2 3.16Å; N125-E128 VanDerWaalsContact ND2-OE2 3.13Å; N125-E128 PolarHBondContact O-N 3.15Å; N125-E128 WeakPolarHBondContact OD1-CG 3.48Å; N125-E128 PolarHBondContact OD1-N 3.25Å; E126-E128 VanDerWaalsContact C-N 3.31Å; E126-E128 PolarHBondContact O-N 3.34Å; E128-E130 VanDerWaalsContact C-N 3.34Å; E128-N131 PolarHBondContact O-N 2.72Å; E128-L132 WeakPolarHBondContact O-CG 3.41Å; E128-L132 PolarHBondContact O-N 3.35Å
129	R	91.8	Very high	83.6	Confident	43 Å²	43	64.8 Å²	64.8	16%	0.162	34%	0.341	C	S	.	.	H	α-helix	trans	-61.9	-42.9	173.9	-72.2	-166.9	-70.7	-81.9	3.3	111.9	L124 N125 E126 L132 F133 I234 V238 D241	L124-R129 HydrophobicContact CB-CG 3.85Å; L124-R129 HydrophobicContact CD1-CG 4.09Å; L124-R129 PolarHBondContact O-NH1 3.11Å; N125-R129 PolarHBondContact O-N 3.06Å; N125-R129 VanDerWaalsContact O-N 3.1Å; E126-R129 PolarHBondContact O-N 3.15Å; R129-L132 PolarHBondContact O-N 2.91Å; R129-F133 PolarHBondContact O-N 3.42Å; R129-I234 HydrophobicContact CG-CD1 4.1Å; R129-V238 HydrophobicContact CB-CG2 3.74Å; R129-D241 IonicContact CZ-OD2 2.56Å; R129-D241 VanDerWaalsContact CZ-OD2 3.3Å; R129-D241 IonicContact NE-OD2 2.7Å; R129-D241 PolarHBondContact NE-OD2 3.14Å; R129-D241 VanDerWaalsContact NE-OD2 3.09Å; R129-D241 IonicContact NH2-OD2 3.33Å; R129-D241 PolarHBondContact NH2-OD2 3.19Å
130	E	93.3	Very high	85.3	Confident	57 Å²	57	68.2 Å²	68.2	27%	0.266	35%	0.35	S	S	.	.	H	α-helix	trans	-61.1	-44.6	177.7	-174.6	58.4	-144.7	0	0	111.5	E126 A127 E128 L132 F133 Q134 V238 R242	E126-E130 WeakPolarHBondContact O-CB 3.2Å; E126-E130 PolarHBondContact O-N 3.42Å; A127-E130 PolarHBondContact O-N 3.36Å; E128-E130 VanDerWaalsContact C-N 3.34Å; E130-L132 PolarHBondContact O-N 2.97Å; E130-F133 PolarHBondContact O-N 3.18Å; E130-Q134 PolarHBondContact O-N 3.13Å; E130-V238 WeakPolarHBondContact OE2-CG1 3.45Å; E130-R242 IonicContact OE1-CZ 3.18Å; E130-R242 IonicContact OE1-NH2 2.81Å; E130-R242 PolarHBondContact OE1-NH2 3.23Å; E130-R242 IonicContact OE2-CZ 2.63Å; E130-R242 IonicContact OE2-NE 3.87Å; E130-R242 PolarHBondContact OE2-NE 3.47Å; E130-R242 IonicContact OE2-NH2 2.57Å; E130-R242 PolarHBondContact OE2-NH2 3.37Å
131	N	92.1	Very high	87.1	Confident	84 Å²	84	65.1 Å²	65.1	45%	0.449	34%	0.341	S	S	.	.	H	α-helix	trans	-62.9	-41.5	174.7	-175.2	17	0	0	0	112.5	A127 E128 F133 Q134 K135	A127-N131 PolarHBondContact O-N 3.05Å; E128-N131 PolarHBondContact O-N 2.72Å; N131-F133 VanDerWaalsContact C-N 3.34Å; N131-Q134 WeakPolarHBondContact O-CB 3.31Å; N131-Q134 PolarHBondContact O-N 3.33Å; N131-K135 PolarHBondContact O-N 3.28Å; N131-K135 VanDerWaalsContact O-N 3.1Å
132	L	92.4	Very high	89.1	Confident	15 Å²	15	65.5 Å²	65.5	8%	0.079	34%	0.339	C	S	.	.	H	α-helix	trans	-65.1	-38.4	174.8	-72.3	-179.8	0	0	0	112.2	L124 E128 R129 E130 Q134 K135 L136 I234	L124-L132 HydrophobicContact CD1-CD1 3.29Å; E128-L132 WeakPolarHBondContact O-CG 3.41Å; E128-L132 PolarHBondContact O-N 3.35Å; R129-L132 PolarHBondContact O-N 2.91Å; E130-L132 PolarHBondContact O-N 2.97Å; L132-Q134 VanDerWaalsContact C-N 3.34Å; L132-K135 HydrophobicContact CD2-CD 4.31Å; L132-K135 PolarHBondContact O-N 2.89Å; L132-L136 WeakPolarHBondContact O-CG 3.44Å; L132-L136 PolarHBondContact O-N 2.77Å; L132-L136 VanDerWaalsContact O-N 3.11Å; L132-I234 HydrophobicContact CB-CD1 4.46Å; L132-I234 HydrophobicContact CB-CG1 4.45Å; L132-I234 HydrophobicContact CB-CG2 4.06Å; L132-I234 HydrophobicContact CD1-CD1 3.78Å; L132-I234 HydrophobicContact CD1-CG1 4.22Å
133	F	93.8	Very high	91	Very high	1 Å²	1	58.1 Å²	58.1	0%	0.004	31%	0.307	C	S	.	.	H	α-helix	trans	-63.9	-40.8	174.2	177.2	-104.7	0	0	0	111.6	A53 M54 R129 E130 N131 K135 L136 D137 W145 I234 V238	A53-F133 HydrophobicContact CB-CE1 3.77Å; A53-F133 HydrophobicContact CB-CZ 3.94Å; M54-F133 HydrophobicContact CE-CD1 4.23Å; M54-F133 HydrophobicContact CE-CD2 3.56Å; M54-F133 HydrophobicContact CE-CE1 3.84Å; M54-F133 HydrophobicContact CE-CE2 3.12Å; M54-F133 HydrophobicContact CE-CG 4.11Å; M54-F133 HydrophobicContact CE-CZ 3.28Å; M54-F133 HydrophobicContact CG-CE1 3.89Å; M54-F133 HydrophobicContact CG-CE2 4.36Å; M54-F133 HydrophobicContact CG-CZ 3.56Å; M54-F133 HydrophobicContact SD-CE1 4.46Å; M54-F133 HydrophobicContact SD-CZ 4.19Å; R129-F133 PolarHBondContact O-N 3.42Å; E130-F133 PolarHBondContact O-N 3.18Å; N131-F133 VanDerWaalsContact C-N 3.34Å; F133-K135 VanDerWaalsContact C-N 3.3Å; F133-K135 PolarHBondContact O-N 2.93Å; F133-L136 WeakPolarHBondContact O-CB 3.42Å; F133-L136 PolarHBondContact O-N 3.47Å; F133-L136 VanDerWaalsContact O-N 3.08Å; F133-D137 PolarHBondContact O-N 2.83Å; F133-W145 HydrophobicContact CE2-CD2 4.49Å; F133-W145 AromaticContact CE2-CE2 3.89Å; F133-W145 HydrophobicContact CE2-CZ2 4.13Å; F133-W145 AromaticContact CE2-NE1 3.84Å; F133-W145 AromaticContact CZ-CZ2 3.8Å; F133-W145 HydrophobicContact CZ-CZ2 3.8Å; F133-I234 HydrophobicContact CB-CG2 4.01Å; F133-V238 HydrophobicContact CB-CB 4.47Å; F133-V238 HydrophobicContact CB-CG1 4.38Å; F133-V238 HydrophobicContact CB-CG2 3.95Å; F133-V238 HydrophobicContact CD1-CG1 4.28Å; F133-V238 HydrophobicContact CG-CG1 4.26Å
134	Q	93.1	Very high	92.4	Very high	85 Å²	85	51.8 Å²	51.8	40%	0.397	27%	0.269	S	S	.	.	H	α-helix	trans	-57.9	-42.4	173.8	-178.1	176.8	-7.6	0	0	111.9	E130 N131 L132 L136 D137 E138	E130-Q134 PolarHBondContact O-N 3.13Å; N131-Q134 WeakPolarHBondContact O-CB 3.31Å; N131-Q134 PolarHBondContact O-N 3.33Å; L132-Q134 VanDerWaalsContact C-N 3.34Å; Q134-L136 VanDerWaalsContact C-N 3.31Å; Q134-L136 PolarHBondContact O-N 3.16Å; Q134-D137 WeakPolarHBondContact O-CB 3.38Å; Q134-D137 PolarHBondContact O-N 3.05Å; Q134-E138 HydrophobicContact CG-CG 4.49Å; Q134-E138 WeakPolarHBondContact CG-OE1 3.41Å; Q134-E138 PolarHBondContact NE2-OE1 2.83Å; Q134-E138 WeakPolarHBondContact O-CG 3.18Å; Q134-E138 PolarHBondContact O-N 3.02Å
135	K	92.4	Very high	93.2	Very high	72 Å²	72	50.3 Å²	50.3	31%	0.313	26%	0.261	S	S	.	.	H	α-helix	trans	-62.5	-37	174.9	-68.7	174.1	-179.5	176.5	0	113.1	N131 L132 F133 D137 E138 A139	N131-K135 PolarHBondContact O-N 3.28Å; N131-K135 VanDerWaalsContact O-N 3.1Å; L132-K135 HydrophobicContact CD2-CD 4.31Å; L132-K135 PolarHBondContact O-N 2.89Å; F133-K135 VanDerWaalsContact C-N 3.3Å; F133-K135 PolarHBondContact O-N 2.93Å; K135-D137 VanDerWaalsContact C-N 3.33Å; K135-E138 PolarHBondContact O-N 3.17Å; K135-A139 WeakPolarHBondContact O-CB 3.45Å; K135-A139 PolarHBondContact O-N 2.71Å; K135-A139 VanDerWaalsContact O-N 3.11Å
136	L	92.6	Very high	93.7	Very high	2 Å²	2	46.5 Å²	46.5	1%	0.01	24%	0.24	C	C	.	.	H	α-helix	trans	-65.7	-38.8	174.7	-70	170.9	0	0	0	111.3	L113 L116 V118 L132 F133 Q134 A139 V143 A231 I234	L113-L136 HydrophobicContact CD1-CD2 3.83Å; L116-L136 HydrophobicContact CD1-CD2 4.18Å; V118-L136 HydrophobicContact CG1-CD2 4.15Å; V118-L136 HydrophobicContact CG1-CG 4.35Å; L132-L136 WeakPolarHBondContact O-CG 3.44Å; L132-L136 PolarHBondContact O-N 2.77Å; L132-L136 VanDerWaalsContact O-N 3.11Å; F133-L136 WeakPolarHBondContact O-CB 3.42Å; F133-L136 PolarHBondContact O-N 3.47Å; F133-L136 VanDerWaalsContact O-N 3.08Å; Q134-L136 VanDerWaalsContact C-N 3.31Å; Q134-L136 PolarHBondContact O-N 3.16Å; L136-A139 CarbonylContact O-C 3.47Å; L136-A139 PolarHBondContact O-N 2.96Å; L136-V143 HydrophobicContact CD2-CG1 4.31Å; L136-A231 HydrophobicContact CD1-CB 3.98Å; L136-A231 HydrophobicContact CD2-CB 3.87Å; L136-I234 HydrophobicContact CD1-CB 4.38Å; L136-I234 HydrophobicContact CD1-CG2 4.25Å
137	D	91.1	Very high	94.1	Very high	29 Å²	29	43 Å²	43	16%	0.155	22%	0.224	C	C	.	.	H	α-helix	trans	-69.1	-37.3	176.1	-171.7	58.4	0	0	0	112.7	S51 A53 F133 Q134 K135 A139 Q140	S51-D137 PolarHBondContact OG-OD2 2.95Å; A53-D137 HydrophobicContact CB-CB 4.07Å; A53-D137 WeakPolarHBondContact CB-OD1 3.34Å; A53-D137 WeakPolarHBondContact CB-OD2 3.35Å; F133-D137 PolarHBondContact O-N 2.83Å; Q134-D137 WeakPolarHBondContact O-CB 3.38Å; Q134-D137 PolarHBondContact O-N 3.05Å; K135-D137 VanDerWaalsContact C-N 3.33Å; D137-A139 PolarHBondContact O-N 3.02Å; D137-Q140 WeakPolarHBondContact O-CB 3.26Å; D137-Q140 WeakPolarHBondContact O-CG 3.17Å; D137-Q140 PolarHBondContact O-N 3.49Å; D137-Q140 PolarHBondContact O-NE2 3.39Å; D137-Q140 VanDerWaalsContact O-NE2 3.15Å
138	E	92.9	Very high	94.5	Very high	125 Å²	125	40.6 Å²	40.6	58%	0.584	20%	0.2	S	C	*	.	H	α-helix	trans	-65.1	-27.4	171.6	-71.7	169.6	-173.3	0	0	111.9	Q134 K135 Q140	Q134-E138 HydrophobicContact CG-CG 4.49Å; Q134-E138 WeakPolarHBondContact CG-OE1 3.41Å; Q134-E138 PolarHBondContact NE2-OE1 2.83Å; Q134-E138 WeakPolarHBondContact O-CG 3.18Å; Q134-E138 PolarHBondContact O-N 3.02Å; K135-E138 PolarHBondContact O-N 3.17Å; E138-Q140 VanDerWaalsContact C-N 3.28Å; E138-Q140 PolarHBondContact O-N 3.01Å
139	A	93.7	Very high	94.8	Very high	8 Å²	8	36.6 Å²	36.6	7%	0.066	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85	12.8	175.1	0	0	0	0	0	114.4	L116 K135 L136 D137 S141 Y142 V143	L116-A139 HydrophobicContact CD1-CB 4.07Å; K135-A139 WeakPolarHBondContact O-CB 3.45Å; K135-A139 PolarHBondContact O-N 2.71Å; K135-A139 VanDerWaalsContact O-N 3.11Å; L136-A139 CarbonylContact O-C 3.47Å; L136-A139 PolarHBondContact O-N 2.96Å; D137-A139 PolarHBondContact O-N 3.02Å; A139-S141 PolarHBondContact O-N 3.1Å; A139-Y142 HydrophobicContact CB-CE1 3.75Å; A139-Y142 PolarHBondContact O-N 3.07Å; A139-V143 HydrophobicContact CB-CB 4.29Å; A139-V143 HydrophobicContact CB-CG2 3.81Å; A139-V143 PolarHBondContact O-N 3.35Å
140	Q	94.3	Very high	95.1	Very high	108 Å²	108	34.6 Å²	34.6	51%	0.505	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-9.1	-178.4	65	-176.2	-66.3	0	0	115.9	P74 D137 E138 Y142	P74-Q140 WeakPolarHBondContact CG-O 3.39Å; D137-Q140 WeakPolarHBondContact O-CB 3.26Å; D137-Q140 WeakPolarHBondContact O-CG 3.17Å; D137-Q140 PolarHBondContact O-N 3.49Å; D137-Q140 PolarHBondContact O-NE2 3.39Å; D137-Q140 VanDerWaalsContact O-NE2 3.15Å; E138-Q140 VanDerWaalsContact C-N 3.28Å; E138-Q140 PolarHBondContact O-N 3.01Å; Q140-Y142 VanDerWaalsContact C-N 3.25Å; Q140-Y142 PolarHBondContact O-N 2.82Å
141	S	95.5	Very high	95.2	Very high	86 Å²	86	31.9 Å²	31.9	60%	0.601	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-21.3	173.3	58.8	0	0	0	0	113.1	V76 A139	V76-S141 WeakPolarHBondContact CG2-O 3.41Å; A139-S141 PolarHBondContact O-N 3.1Å
142	Y	96.6	Very high	95.5	Very high	26 Å²	26	27.9 Å²	27.9	10%	0.102	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-141.6	-11.1	178.3	68.8	-87.1	0	0	0	114.3	C77 C105 P106 K109 E112 A139 Q140	C77-Y142 PolarHBondContact SG-O 3.16Å; C105-Y142 WeakPolarHBondContact CA-O 3.43Å; C105-Y142 HydrophobicContact CB-CD2 4.23Å; C105-Y142 WeakPolarHBondContact CB-O 3.32Å; P106-Y142 VanDerWaalsContact CD-O 3.24Å; P106-Y142 WeakPolarHBondContact CD-O 3.49Å; K109-Y142 HydrophobicContact CB-CD2 3.8Å; K109-Y142 HydrophobicContact CB-CE2 4.2Å; K109-Y142 HydrophobicContact CD-CD2 4.49Å; K109-Y142 HydrophobicContact CG-CD2 4.06Å; K109-Y142 HydrophobicContact CG-CG 4.38Å; E112-Y142 HydrophobicContact CB-CE2 4.47Å; A139-Y142 HydrophobicContact CB-CE1 3.75Å; A139-Y142 PolarHBondContact O-N 3.07Å; Q140-Y142 VanDerWaalsContact C-N 3.25Å; Q140-Y142 PolarHBondContact O-N 2.82Å
143	V	97.1	Very high	95.7	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.006	15%	0.148	C	C	.	.			trans	-102.9	132.5	175.1	-178.8	0	0	0	0	109.8	P74 C105 L113 L136 A139	P74-V143 WeakPolarHBondContact CG-O 3.46Å; C105-V143 HydrophobicContact CB-CG2 4.41Å; L113-V143 HydrophobicContact CD1-CG2 4.09Å; L136-V143 HydrophobicContact CD2-CG1 4.31Å; A139-V143 HydrophobicContact CB-CB 4.29Å; A139-V143 HydrophobicContact CB-CG2 3.81Å; A139-V143 PolarHBondContact O-N 3.35Å
144	G	97.6	Very high	95.7	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	155.6	167.4	0	0	0	0	0	111.3	S71 C103 F104	S71-G144 WeakPolarHBondContact OG-CA 3.5Å; C103-G144 CarbonylContact C-O 3.59Å; C103-G144 WeakPolarHBondContact CA-O 3.06Å; F104-G144 WeakPolarHBondContact CD1-O 3.26Å; F104-G144 VanDerWaalsContact CE1-C 3.48Å; F104-G144 PolarHBondContact N-O 3.08Å; F104-G144 PolarHBondContact O-N 3.07Å
145	W	98.1	Very high	95.9	Very high	6 Å²	6	27.8 Å²	27.8	2%	0.023	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	157.2	178.4	57.9	-98	0	0	0	111.6	A53 M54 L69 A70 S71 I102 F133 L147	A53-W145 WeakPolarHBondContact O-CH2 3.45Å; A53-W145 WeakPolarHBondContact O-CZ2 3.32Å; M54-W145 HydrophobicContact CG-CH2 3.73Å; M54-W145 HydrophobicContact CG-CZ2 4.14Å; M54-W145 HydrophobicContact CG-CZ3 4.45Å; L69-W145 HydrophobicContact CD2-CH2 4.05Å; L69-W145 HydrophobicContact CD2-CZ3 4.17Å; L69-W145 HydrophobicContact CG-CH2 3.95Å; L69-W145 HydrophobicContact CG-CZ3 3.9Å; A70-W145 WeakPolarHBondContact CA-O 3.37Å; S71-W145 PolarHBondContact N-O 3.04Å; S71-W145 PolarHBondContact OG-N 3.24Å; S71-W145 PolarHBondContact OG-O 3.43Å; I102-W145 CarbonylContact O-C 3.5Å; I102-W145 WeakPolarHBondContact O-CA 3.38Å; I102-W145 VanDerWaalsContact O-CB 3.26Å; I102-W145 WeakPolarHBondContact O-CB 3.33Å; F133-W145 HydrophobicContact CE2-CD2 4.49Å; F133-W145 AromaticContact CE2-CE2 3.89Å; F133-W145 HydrophobicContact CE2-CZ2 4.13Å; F133-W145 AromaticContact CE2-NE1 3.84Å; F133-W145 AromaticContact CZ-CZ2 3.8Å; F133-W145 HydrophobicContact CZ-CZ2 3.8Å; W145-L147 HydrophobicContact CE3-CD1 4.15Å; W145-L147 HydrophobicContact CE3-CG 3.91Å; W145-L147 HydrophobicContact CZ3-CD1 3.81Å; W145-L147 HydrophobicContact CZ3-CG 3.96Å
146	A	98.3	Very high	96.2	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	152.6	170.1	0	0	0	0	0	110.5	L69 A70 G101 I102 L178 Y181	L69-A146 CarbonylContact O-C 3.33Å; L69-A146 WeakPolarHBondContact O-CA 3.23Å; A70-A146 HydrophobicContact CB-CB 3.73Å; G101-A146 CarbonylContact C-O 3.59Å; G101-A146 WeakPolarHBondContact CA-O 3.29Å; I102-A146 HydrophobicContact CD1-CB 3.94Å; I102-A146 HydrophobicContact CG1-CB 3.69Å; I102-A146 WeakPolarHBondContact CG1-O 3.21Å; I102-A146 PolarHBondContact N-O 3.38Å; I102-A146 PolarHBondContact O-N 3.39Å; A146-L178 HydrophobicContact CB-CD2 4.23Å; A146-Y181 HydrophobicContact CB-CD1 3.84Å; A146-Y181 HydrophobicContact CB-CE1 3.68Å
147	L	98.3	Very high	96.3	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	144.9	-174.5	-61.3	173.4	0	0	0	109.5	M54 R68 L69 V99 Y100 W145 C235 A239	M54-L147 HydrophobicContact CE-CD1 3.86Å; M54-L147 HydrophobicContact SD-CD1 3.93Å; R68-L147 VanDerWaalsContact CA-O 3.31Å; R68-L147 WeakPolarHBondContact CA-O 3.47Å; R68-L147 WeakPolarHBondContact CG-O 3.1Å; L69-L147 HydrophobicContact CB-CB 4.48Å; L69-L147 HydrophobicContact CD2-CD1 4.42Å; L69-L147 PolarHBondContact N-O 3.26Å; L69-L147 PolarHBondContact O-N 2.82Å; V99-L147 HydrophobicContact CG1-CB 4.47Å; V99-L147 HydrophobicContact CG1-CD2 4.3Å; Y100-L147 CarbonylContact O-C 3.56Å; Y100-L147 VanDerWaalsContact O-CA 3.24Å; Y100-L147 WeakPolarHBondContact O-CA 3.43Å; W145-L147 HydrophobicContact CE3-CD1 4.15Å; W145-L147 HydrophobicContact CE3-CG 3.91Å; W145-L147 HydrophobicContact CZ3-CD1 3.81Å; W145-L147 HydrophobicContact CZ3-CG 3.96Å; L147-C235 HydrophobicContact CD2-CB 3.82Å; L147-A239 HydrophobicContact CD1-CB 3.45Å; L147-A239 VanDerWaalsContact CD1-CB 3.45Å
148	Q	97.9	Very high	96.6	Very high	20 Å²	20	26.9 Å²	26.9	9%	0.093	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	110	165.8	-170.8	69.5	61.1	0	0	108.4	F67 V99 Y100 L150 T174 L178	F67-Q148 VanDerWaalsContact C-NE2 3.26Å; F67-Q148 PolarHBondContact O-NE2 3.45Å; F67-Q148 VanDerWaalsContact O-NE2 3.11Å; V99-Q148 WeakPolarHBondContact CA-O 3.42Å; Y100-Q148 PolarHBondContact N-O 3.28Å; Y100-Q148 PolarHBondContact O-N 3.36Å; Q148-L150 HydrophobicContact CG-CD2 3.92Å; Q148-T174 HydrophobicContact CB-CG2 3.78Å; Q148-T174 HydrophobicContact CG-CG2 3.76Å; Q148-L178 HydrophobicContact CB-CD1 3.94Å; Q148-L178 HydrophobicContact CB-CD2 4.04Å; Q148-L178 HydrophobicContact CB-CG 4.06Å
149	I	97.8	Very high	96.7	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	119.4	174.3	-58.1	165.3	0	0	0	107.2	L56 F59 S66 F67 P97 V99 V243	L56-I149 HydrophobicContact CD2-CD1 3.79Å; F59-I149 HydrophobicContact CD2-CG2 4.16Å; F59-I149 HydrophobicContact CE1-CG2 4.48Å; F59-I149 HydrophobicContact CE2-CB 4.4Å; F59-I149 HydrophobicContact CE2-CG2 3.63Å; F59-I149 HydrophobicContact CZ-CG2 3.8Å; S66-I149 CarbonylContact C-O 3.51Å; S66-I149 WeakPolarHBondContact CA-O 3.48Å; S66-I149 VanDerWaalsContact CB-O 3.26Å; S66-I149 WeakPolarHBondContact CB-O 3.46Å; F67-I149 HydrophobicContact CD1-CD1 4.27Å; F67-I149 PolarHBondContact N-O 3.08Å; F67-I149 PolarHBondContact O-N 2.9Å; P97-I149 HydrophobicContact CB-CG2 3.96Å; V99-I149 HydrophobicContact CG1-CG1 4.09Å; V99-I149 HydrophobicContact CG2-CB 4.45Å; V99-I149 HydrophobicContact CG2-CG1 4.05Å; V99-I149 HydrophobicContact CG2-CG2 4.25Å; I149-V243 HydrophobicContact CD1-CG2 3.81Å; I149-V243 HydrophobicContact CG2-CG2 4.43Å
150	L	97.4	Very high	96.8	Very high	2 Å²	2	27.7 Å²	27.7	1%	0.01	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	114.8	175.8	-55.3	173.8	0	0	0	108.4	P97 M98 Q148 M154 I155 L170 T174	P97-L150 VanDerWaalsContact CA-O 3.22Å; P97-L150 WeakPolarHBondContact CA-O 3.13Å; P97-L150 WeakPolarHBondContact CB-O 3.48Å; M98-L150 HydrophobicContact CB-CB 4.5Å; M98-L150 HydrophobicContact CE-CD1 3.5Å; M98-L150 VanDerWaalsContact CE-CD1 3.5Å; M98-L150 PolarHBondContact N-O 3.26Å; M98-L150 WeakPolarHBondContact O-CB 3.49Å; M98-L150 PolarHBondContact O-N 2.92Å; Q148-L150 HydrophobicContact CG-CD2 3.92Å; L150-M154 HydrophobicContact CD2-SD 3.9Å; L150-I155 HydrophobicContact CB-CD1 4.36Å; L150-I155 HydrophobicContact CB-CG1 4.15Å; L150-L170 HydrophobicContact CD1-CD1 4.39Å; L150-L170 HydrophobicContact CD1-CD2 4.39Å; L150-L170 HydrophobicContact CD1-CG 4.2Å; L150-T174 HydrophobicContact CD1-CG2 4.21Å; L150-T174 HydrophobicContact CD2-CG2 4.44Å
151	S	96.9	Very high	96.8	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.143	C	C	.	.			trans	-62.9	152.4	177.7	67.9	0	0	0	0	111.6	N63 S64 G65 N153 M154 I155	N63-S151 WeakPolarHBondContact O-CB 3.3Å; S64-S151 PolarHBondContact O-OG 3.31Å; G65-S151 WeakPolarHBondContact O-CB 3.41Å; G65-S151 PolarHBondContact O-OG 3.21Å; S151-N153 PolarHBondContact O-N 2.96Å; S151-M154 PolarHBondContact O-N 2.89Å; S151-M154 VanDerWaalsContact O-N 3.13Å; S151-M154 WeakPolarHBondContact OG-CB 3.3Å; S151-M154 PolarHBondContact OG-N 3.04Å; S151-I155 VanDerWaalsContact O-CG1 3.31Å; S151-I155 WeakPolarHBondContact O-CG1 3.33Å; S151-I155 PolarHBondContact O-N 2.89Å
152	P	97.1	Very high	96.6	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-58.6	-34.2	172.8	-1.8	9.4	0	0	0	111.9	I155 S156 W247 Q286 F287 R289	P152-I155 PolarHBondContact O-N 3.49Å; P152-S156 WeakPolarHBondContact O-CB 3.41Å; P152-S156 PolarHBondContact O-N 3.07Å; P152-S156 PolarHBondContact O-OG 2.99Å; P152-W247 HydrophobicContact CG-CH2 3.89Å; P152-W247 HydrophobicContact CG-CZ2 4.2Å; P152-Q286 WeakPolarHBondContact CB-O 3.45Å; P152-Q286 WeakPolarHBondContact CG-O 3.45Å; P152-F287 WeakPolarHBondContact CB-O 3.5Å; P152-F287 HydrophobicContact CG-CD2 4.42Å; P152-F287 VanDerWaalsContact CG-O 3.32Å; P152-F287 WeakPolarHBondContact CG-O 3.41Å; P152-R289 HydrophobicContact CB-CG 3.66Å
153	N	96.3	Very high	96.3	Very high	45 Å²	45	33.3 Å²	33.3	24%	0.241	17%	0.169	C	C	.	.	H	α-helix	trans	-62.6	-46.7	172.9	-179.2	56.6	0	0	0	112.5	S64 S151 I155 S156 T157 Q286	S64-N153 PolarHBondContact O-ND2 3.43Å; S151-N153 PolarHBondContact O-N 2.96Å; N153-I155 VanDerWaalsContact C-N 3.35Å; N153-I155 PolarHBondContact O-N 3.48Å; N153-S156 PolarHBondContact O-N 2.83Å; N153-T157 WeakPolarHBondContact O-CB 3.48Å; N153-T157 WeakPolarHBondContact O-CG2 3.47Å; N153-T157 PolarHBondContact O-N 3.07Å; N153-T157 PolarHBondContact O-OG1 3.09Å; N153-Q286 HydrophobicContact CB-CB 4.32Å; N153-Q286 HydrophobicContact CB-CG 4.34Å
154	M	95.5	Very high	96	Very high	53 Å²	53	42.1 Å²	42.1	26%	0.261	21%	0.207	S	C	.	.	H	α-helix	trans	-62.5	-42.7	175.8	-174.4	-178.9	-177.9	0	0	111.3	S66 L150 S151 S156 T157 S158	S66-M154 WeakPolarHBondContact CB-SD 3.35Å; S66-M154 PolarHBondContact OG-SD 2.88Å; S66-M154 VanDerWaalsContact OG-SD 3.36Å; L150-M154 HydrophobicContact CD2-SD 3.9Å; S151-M154 PolarHBondContact O-N 2.89Å; S151-M154 VanDerWaalsContact O-N 3.13Å; S151-M154 WeakPolarHBondContact OG-CB 3.3Å; S151-M154 PolarHBondContact OG-N 3.04Å; M154-S156 VanDerWaalsContact C-N 3.32Å; M154-S156 PolarHBondContact O-N 3.36Å; M154-T157 WeakPolarHBondContact CA-OG1 3.17Å; M154-T157 PolarHBondContact O-OG1 3.12Å; M154-S158 WeakPolarHBondContact O-CB 3.46Å; M154-S158 PolarHBondContact O-N 3.05Å; M154-S158 PolarHBondContact O-OG 3Å
155	I	97.4	Very high	95.9	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-61.8	-43.7	177.7	-61.7	164.6	0	0	0	110.3	M98 L150 S151 P152 N153 M159 L167 L170 W292	M98-I155 HydrophobicContact CB-CD1 3.7Å; L150-I155 HydrophobicContact CB-CD1 4.36Å; L150-I155 HydrophobicContact CB-CG1 4.15Å; S151-I155 VanDerWaalsContact O-CG1 3.31Å; S151-I155 WeakPolarHBondContact O-CG1 3.33Å; S151-I155 PolarHBondContact O-N 2.89Å; P152-I155 PolarHBondContact O-N 3.49Å; N153-I155 VanDerWaalsContact C-N 3.35Å; N153-I155 PolarHBondContact O-N 3.48Å; I155-M159 HydrophobicContact CG2-SD 3.9Å; I155-M159 WeakPolarHBondContact O-CB 3.37Å; I155-M159 WeakPolarHBondContact O-CG 3.27Å; I155-M159 PolarHBondContact O-N 3.27Å; I155-M159 VanDerWaalsContact O-N 3.07Å; I155-L167 HydrophobicContact CG2-CD1 4.21Å; I155-L170 HydrophobicContact CB-CD2 4.41Å; I155-L170 HydrophobicContact CG1-CD2 4.1Å; I155-L170 HydrophobicContact CG2-CD2 4.34Å; I155-W292 HydrophobicContact CG2-CH2 3.87Å; I155-W292 HydrophobicContact CG2-CZ3 3.5Å
156	S	97.1	Very high	95.7	Very high	6 Å²	6	48 Å²	48	4%	0.042	24%	0.235	C	C	.	.	H	α-helix	trans	-63.2	-55.3	179.3	-59.8	0	0	0	0	111.7	P152 N153 M154 S158 M159 L160 R289 F290	P152-S156 WeakPolarHBondContact O-CB 3.41Å; P152-S156 PolarHBondContact O-N 3.07Å; P152-S156 PolarHBondContact O-OG 2.99Å; N153-S156 PolarHBondContact O-N 2.83Å; M154-S156 VanDerWaalsContact C-N 3.32Å; M154-S156 PolarHBondContact O-N 3.36Å; S156-S158 VanDerWaalsContact C-N 3.28Å; S156-S158 PolarHBondContact O-N 3.22Å; S156-M159 PolarHBondContact O-N 3.47Å; S156-L160 WeakPolarHBondContact O-CB 3.16Å; S156-L160 WeakPolarHBondContact O-CG 3.26Å; S156-L160 PolarHBondContact O-N 3.46Å; S156-R289 WeakPolarHBondContact OG-CA 3.43Å; S156-F290 PolarHBondContact OG-N 3.11Å
157	T	95.8	Very high	95.6	Very high	62 Å²	62	49.2 Å²	49.2	38%	0.38	24%	0.241	S	C	.	.	H	α-helix	trans	-62.8	-35.1	-179.3	51.6	0	0	0	0	112.3	N153 M154 Q161	N153-T157 WeakPolarHBondContact O-CB 3.48Å; N153-T157 WeakPolarHBondContact O-CG2 3.47Å; N153-T157 PolarHBondContact O-N 3.07Å; N153-T157 PolarHBondContact O-OG1 3.09Å; M154-T157 WeakPolarHBondContact CA-OG1 3.17Å; M154-T157 PolarHBondContact O-OG1 3.12Å; T157-Q161 WeakPolarHBondContact O-CB 3.17Å; T157-Q161 PolarHBondContact O-N 2.9Å
158	S	96.1	Very high	95.4	Very high	16 Å²	16	53.2 Å²	53.2	11%	0.112	26%	0.262	C	S	.	.	H	α-helix	trans	-66.8	-41.8	175.4	-65.8	0	0	0	0	112.3	M154 S156 Q161	M154-S158 WeakPolarHBondContact O-CB 3.46Å; M154-S158 PolarHBondContact O-N 3.05Å; M154-S158 PolarHBondContact O-OG 3Å; S156-S158 VanDerWaalsContact C-N 3.28Å; S156-S158 PolarHBondContact O-N 3.22Å; S158-Q161 WeakPolarHBondContact O-CG 3.18Å; S158-Q161 PolarHBondContact O-NE2 3.05Å
159	M	96.5	Very high	95.2	Very high	52 Å²	52	53.4 Å²	53.4	26%	0.256	27%	0.268	S	S	.	.	H	α-helix	trans	-84.4	-24.4	-175.8	-71.1	179.9	63.9	0	0	114.3	I155 S156 Y165 L167 S291 W292	I155-M159 HydrophobicContact CG2-SD 3.9Å; I155-M159 WeakPolarHBondContact O-CB 3.37Å; I155-M159 WeakPolarHBondContact O-CG 3.27Å; I155-M159 PolarHBondContact O-N 3.27Å; I155-M159 VanDerWaalsContact O-N 3.07Å; S156-M159 PolarHBondContact O-N 3.47Å; M159-Y165 WeakPolarHBondContact CA-O 3.34Å; M159-L167 HydrophobicContact CE-CB 4.09Å; M159-L167 HydrophobicContact SD-CB 3.9Å; M159-L167 HydrophobicContact SD-CD1 4.12Å; M159-S291 VanDerWaalsContact CB-CB 3.5Å; M159-S291 PolarHBondContact SD-OG 2.98Å; M159-S291 VanDerWaalsContact SD-OG 3.42Å; M159-W292 HydrophobicContact SD-CZ3 4.19Å
160	L	95.1	Very high	95.1	Very high	98 Å²	98	53.6 Å²	53.6	51%	0.513	27%	0.269	S	S	.	.	S	Bend	trans	-101.5	11.3	-179.9	-62.3	171.8	0	0	0	112.9	S156 F290	S156-L160 WeakPolarHBondContact O-CB 3.16Å; S156-L160 WeakPolarHBondContact O-CG 3.26Å; S156-L160 PolarHBondContact O-N 3.46Å; L160-F290 HydrophobicContact CD1-CB 3.77Å
161	Q	93.7	Very high	95	Very high	79 Å²	79	53.6 Å²	53.6	37%	0.369	27%	0.269	S	S	.	.	S	Bend	trans	-72.6	157.2	172.8	75.3	-173.8	-56.2	0	0	111.1	T157 S158 T163	T157-Q161 WeakPolarHBondContact O-CB 3.17Å; T157-Q161 PolarHBondContact O-N 2.9Å; S158-Q161 WeakPolarHBondContact O-CG 3.18Å; S158-Q161 PolarHBondContact O-NE2 3.05Å; Q161-T163 VanDerWaalsContact C-N 3.27Å; Q161-T163 WeakPolarHBondContact CG-O 3.19Å; Q161-T163 PolarHBondContact O-N 3.45Å
162	R	91.1	Very high	94.9	Very high	151 Å²	151	55.7 Å²	55.7	57%	0.57	28%	0.279	S	S	*	.	S	Bend	trans	-49.7	-43.6	179.4	-64.3	-174.4	168.3	-166.3	-8.2	113.8	D310	R162-D310 WeakPolarHBondContact CG-OD2 3.34Å
163	T	91.9	Very high	94.9	Very high	108 Å²	108	58.9 Å²	58.9	66%	0.663	30%	0.296	S	S	*	.	S	Bend	trans	-87.7	119.3	177.2	-55.5	0	0	0	0	109.9	Q161 Y165	Q161-T163 VanDerWaalsContact C-N 3.27Å; Q161-T163 WeakPolarHBondContact CG-O 3.19Å; Q161-T163 PolarHBondContact O-N 3.45Å; T163-Y165 PolarHBondContact O-N 3.47Å
164	K	90.4	Very high	95	Very high	187 Å²	187	57.5 Å²	57.5	81%	0.813	29%	0.289	S	S	*	.			trans	-50.9	114.5	-178.5	-172.6	174.2	-173.1	169.6	0	112.8
165	Y	95.3	Very high	95.1	Very high	57 Å²	57	55 Å²	55	22%	0.224	28%	0.276	C	S	.	.			trans	-135.3	98.3	174.9	-173.4	-123.2	0	0	0	109.8	M159 T163 A169 L170 D173	M159-Y165 WeakPolarHBondContact CA-O 3.34Å; T163-Y165 PolarHBondContact O-N 3.47Å; Y165-A169 HydrophobicContact CD2-CB 3.55Å; Y165-A169 HydrophobicContact CE2-CB 3.39Å; Y165-L170 HydrophobicContact CD1-CB 4.44Å; Y165-L170 HydrophobicContact CE1-CB 3.75Å; Y165-L170 HydrophobicContact CE1-CD1 3.9Å; Y165-L170 HydrophobicContact CE1-CG 4.38Å; Y165-L170 WeakPolarHBondContact OH-CA 3.46Å; Y165-D173 VanDerWaalsContact CE2-OD2 3.3Å; Y165-D173 WeakPolarHBondContact CE2-OD2 3.45Å; Y165-D173 WeakPolarHBondContact OH-CB 3.24Å; Y165-D173 PolarHBondContact OH-OD2 2.8Å
166	N	94.8	Very high	95.1	Very high	71 Å²	71	55.9 Å²	55.9	38%	0.38	28%	0.281	S	S	.	.			trans	-83.4	168.1	-172.4	65.5	54.6	0	0	0	112.4	N168 A169 L170	N166-N168 PolarHBondContact O-N 2.9Å; N166-N168 WeakPolarHBondContact OD1-CA 3.36Å; N166-N168 VanDerWaalsContact OD1-CB 3.3Å; N166-N168 WeakPolarHBondContact OD1-CB 3.44Å; N166-N168 PolarHBondContact OD1-N 2.94Å; N166-A169 WeakPolarHBondContact O-CB 3.47Å; N166-A169 PolarHBondContact O-N 2.94Å; N166-A169 PolarHBondContact OD1-N 3.17Å; N166-L170 PolarHBondContact O-N 2.86Å; N166-L170 VanDerWaalsContact O-N 3.08Å
167	L	94.9	Very high	95.2	Very high	26 Å²	26	56.8 Å²	56.8	14%	0.136	29%	0.291	C	S	.	.	H	α-helix	trans	-57.4	-33.6	-179.2	-170.6	62	0	0	0	113.2	R91 M98 I155 M159 L170 S171 W292	R91-L167 HydrophobicContact CG-CD2 4.18Å; M98-L167 HydrophobicContact CE-CD1 3.82Å; M98-L167 HydrophobicContact SD-CD1 4.2Å; I155-L167 HydrophobicContact CG2-CD1 4.21Å; M159-L167 HydrophobicContact CE-CB 4.09Å; M159-L167 HydrophobicContact SD-CB 3.9Å; M159-L167 HydrophobicContact SD-CD1 4.12Å; L167-L170 HydrophobicContact CD1-CD2 4.4Å; L167-S171 VanDerWaalsContact O-CB 3.22Å; L167-S171 WeakPolarHBondContact O-CB 3.46Å; L167-S171 PolarHBondContact O-N 3.49Å; L167-S171 PolarHBondContact O-OG 3.22Å; L167-W292 HydrophobicContact CD1-CH2 4.33Å; L167-W292 HydrophobicContact CD2-CH2 4.08Å; L167-W292 HydrophobicContact CD2-CZ2 4.34Å
168	N	93.9	Very high	95.3	Very high	84 Å²	84	53.9 Å²	53.9	45%	0.449	27%	0.273	S	S	.	.	H	α-helix	trans	-66.2	-42	176.4	-65.8	-24.5	0	0	0	111.4	R91 N166 S171 H172	R91-N168 PolarHBondContact NH2-OD1 2.83Å; N166-N168 PolarHBondContact O-N 2.9Å; N166-N168 WeakPolarHBondContact OD1-CA 3.36Å; N166-N168 VanDerWaalsContact OD1-CB 3.3Å; N166-N168 WeakPolarHBondContact OD1-CB 3.44Å; N166-N168 PolarHBondContact OD1-N 2.94Å; N168-S171 WeakPolarHBondContact O-CB 3.38Å; N168-S171 PolarHBondContact O-N 2.68Å; N168-H172 WeakPolarHBondContact O-CB 3.38Å; N168-H172 PolarHBondContact O-CD2 2.8Å; N168-H172 PolarHBondContact O-N 2.9Å; N168-H172 PolarHBondContact O-ND1 3.19Å
169	A	94.4	Very high	95.4	Very high	25 Å²	25	53.1 Å²	53.1	21%	0.207	27%	0.268	C	S	.	.	H	α-helix	trans	-63.6	-49.2	177.1	0	0	0	0	0	110.9	Y165 N166 S171 H172 D173	Y165-A169 HydrophobicContact CD2-CB 3.55Å; Y165-A169 HydrophobicContact CE2-CB 3.39Å; N166-A169 WeakPolarHBondContact O-CB 3.47Å; N166-A169 PolarHBondContact O-N 2.94Å; N166-A169 PolarHBondContact OD1-N 3.17Å; A169-S171 VanDerWaalsContact C-N 3.28Å; A169-S171 PolarHBondContact O-N 3.24Å; A169-H172 PolarHBondContact O-N 3.35Å; A169-D173 WeakPolarHBondContact O-CB 3.5Å; A169-D173 PolarHBondContact O-N 3.11Å
170	L	95.9	Very high	95.5	Very high	4 Å²	4	53.1 Å²	53.1	2%	0.021	27%	0.268	C	S	.	.	H	α-helix	trans	-54.9	-43.6	173.7	178.5	61.8	0	0	0	112.4	L150 I155 Y165 N166 L167 T174	L150-L170 HydrophobicContact CD1-CD1 4.39Å; L150-L170 HydrophobicContact CD1-CD2 4.39Å; L150-L170 HydrophobicContact CD1-CG 4.2Å; I155-L170 HydrophobicContact CB-CD2 4.41Å; I155-L170 HydrophobicContact CG1-CD2 4.1Å; I155-L170 HydrophobicContact CG2-CD2 4.34Å; Y165-L170 HydrophobicContact CD1-CB 4.44Å; Y165-L170 HydrophobicContact CE1-CB 3.75Å; Y165-L170 HydrophobicContact CE1-CD1 3.9Å; Y165-L170 HydrophobicContact CE1-CG 4.38Å; Y165-L170 WeakPolarHBondContact OH-CA 3.46Å; N166-L170 PolarHBondContact O-N 2.86Å; N166-L170 VanDerWaalsContact O-N 3.08Å; L167-L170 HydrophobicContact CD1-CD2 4.4Å; L170-T174 VanDerWaalsContact O-CB 3.29Å; L170-T174 WeakPolarHBondContact O-CB 3.36Å; L170-T174 PolarHBondContact O-N 2.91Å; L170-T174 PolarHBondContact O-OG1 3.11Å
171	S	94.7	Very high	95.7	Very high	1 Å²	1	51 Å²	51	1%	0.007	25%	0.253	C	S	.	.	H	α-helix	trans	-63.2	-50.9	178.3	-61.7	0	0	0	0	112.1	R91 Y100 L167 N168 A169 D173 T174 A175	R91-S171 PolarHBondContact NH1-OG 3.35Å; Y100-S171 VanDerWaalsContact OH-CB 3.29Å; Y100-S171 WeakPolarHBondContact OH-CB 3.07Å; L167-S171 VanDerWaalsContact O-CB 3.22Å; L167-S171 WeakPolarHBondContact O-CB 3.46Å; L167-S171 PolarHBondContact O-N 3.49Å; L167-S171 PolarHBondContact O-OG 3.22Å; N168-S171 WeakPolarHBondContact O-CB 3.38Å; N168-S171 PolarHBondContact O-N 2.68Å; A169-S171 VanDerWaalsContact C-N 3.28Å; A169-S171 PolarHBondContact O-N 3.24Å; S171-D173 PolarHBondContact O-N 3.16Å; S171-T174 PolarHBondContact O-N 2.81Å; S171-A175 PolarHBondContact O-N 3.03Å
172	H	95.2	Very high	95.9	Very high	45 Å²	45	47.2 Å²	47.2	21%	0.208	24%	0.235	C	C	.	.	H	α-helix	trans	-64	-42.3	-179.2	-64.8	168.7	0	0	0	111.6	N168 A169 T174 A175 I176 Y203	N168-H172 WeakPolarHBondContact O-CB 3.38Å; N168-H172 PolarHBondContact O-CD2 2.8Å; N168-H172 PolarHBondContact O-N 2.9Å; N168-H172 PolarHBondContact O-ND1 3.19Å; A169-H172 PolarHBondContact O-N 3.35Å; H172-T174 VanDerWaalsContact C-N 3.31Å; H172-T174 PolarHBondContact O-N 3.35Å; H172-A175 PolarHBondContact O-N 3.1Å; H172-I176 WeakPolarHBondContact O-CB 3.36Å; H172-I176 WeakPolarHBondContact O-CD1 3.49Å; H172-I176 WeakPolarHBondContact O-CG1 3.46Å; H172-I176 PolarHBondContact O-N 3.07Å; H172-Y203 HydrophobicContact CB-CE2 3.95Å; H172-Y203 AromaticContact CD2-CD2 3.77Å; H172-Y203 AromaticContact CD2-CE1 3.78Å; H172-Y203 AromaticContact CD2-CE2 3.41Å; H172-Y203 VanDerWaalsContact CD2-CE2 3.41Å; H172-Y203 WeakPolarHBondContact CD2-CE2 3.49Å; H172-Y203 AromaticContact CD2-CZ 3.42Å; H172-Y203 VanDerWaalsContact CD2-CZ 3.42Å; H172-Y203 AromaticContact CG-CD2 3.98Å; H172-Y203 AromaticContact CG-CE2 3.63Å; H172-Y203 AromaticContact NE2-CD1 3.93Å; H172-Y203 AromaticContact NE2-CD2 3.86Å; H172-Y203 AromaticContact NE2-CE2 4Å; H172-Y203 AromaticContact NE2-CG 3.84Å
173	D	96.9	Very high	96.3	Very high	67 Å²	67	42.5 Å²	42.5	36%	0.358	22%	0.221	S	C	.	.	H	α-helix	trans	-69.2	-34	-178.8	-62.1	-15.4	0	0	0	111.1	Y165 A169 S171 G177 K206	Y165-D173 VanDerWaalsContact CE2-OD2 3.3Å; Y165-D173 WeakPolarHBondContact CE2-OD2 3.45Å; Y165-D173 WeakPolarHBondContact OH-CB 3.24Å; Y165-D173 PolarHBondContact OH-OD2 2.8Å; A169-D173 WeakPolarHBondContact O-CB 3.5Å; A169-D173 PolarHBondContact O-N 3.11Å; S171-D173 PolarHBondContact O-N 3.16Å; D173-G177 PolarHBondContact O-N 3.28Å; D173-K206 IonicContact OD1-NZ 3.09Å; D173-K206 PolarHBondContact OD1-NZ 3.46Å
174	T	97.8	Very high	96.6	Very high	16 Å²	16	43 Å²	43	10%	0.098	22%	0.22	C	C	.	.	H	α-helix	trans	-64.2	-48.3	172.7	-60.9	0	0	0	0	111.8	Y100 Q148 L150 L170 S171 H172 I176 G177 L178	Y100-T174 HydrophobicContact CD2-CG2 3.68Å; Y100-T174 HydrophobicContact CG-CG2 3.67Å; Q148-T174 HydrophobicContact CB-CG2 3.78Å; Q148-T174 HydrophobicContact CG-CG2 3.76Å; L150-T174 HydrophobicContact CD1-CG2 4.21Å; L150-T174 HydrophobicContact CD2-CG2 4.44Å; L170-T174 VanDerWaalsContact O-CB 3.29Å; L170-T174 WeakPolarHBondContact O-CB 3.36Å; L170-T174 PolarHBondContact O-N 2.91Å; L170-T174 PolarHBondContact O-OG1 3.11Å; S171-T174 PolarHBondContact O-N 2.81Å; H172-T174 VanDerWaalsContact C-N 3.31Å; H172-T174 PolarHBondContact O-N 3.35Å; T174-I176 PolarHBondContact O-N 3.19Å; T174-G177 PolarHBondContact O-N 2.85Å; T174-L178 PolarHBondContact O-N 3.2Å
175	A	97.8	Very high	96.9	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-60.9	-44.8	176.5	0	0	0	0	0	111.9	V86 Y100 S171 H172 G177 L178 I179 Y203	V86-A175 HydrophobicContact CG1-CB 4.03Å; Y100-A175 HydrophobicContact CD1-CB 4.25Å; Y100-A175 HydrophobicContact CE1-CB 4.19Å; S171-A175 PolarHBondContact O-N 3.03Å; H172-A175 PolarHBondContact O-N 3.1Å; A175-G177 VanDerWaalsContact C-N 3.3Å; A175-G177 PolarHBondContact O-N 3.38Å; A175-L178 PolarHBondContact O-N 2.87Å; A175-I179 WeakPolarHBondContact O-CG1 3.41Å; A175-I179 PolarHBondContact O-N 2.93Å; A175-Y203 WeakPolarHBondContact CB-OH 3.34Å
176	I	98.3	Very high	97	Very high	19 Å²	19	34.1 Å²	34.1	10%	0.097	20%	0.195	C	C	.	.	H	α-helix	trans	-58	-44.2	173.9	-71.9	164.7	0	0	0	110.6	H172 T174 L178 I179 Q180 K206 L207 R210 F211	H172-I176 WeakPolarHBondContact O-CB 3.36Å; H172-I176 WeakPolarHBondContact O-CD1 3.49Å; H172-I176 WeakPolarHBondContact O-CG1 3.46Å; H172-I176 PolarHBondContact O-N 3.07Å; T174-I176 PolarHBondContact O-N 3.19Å; I176-L178 VanDerWaalsContact C-N 3.33Å; I176-L178 PolarHBondContact O-N 3.21Å; I176-I179 PolarHBondContact O-N 2.81Å; I176-Q180 VanDerWaalsContact O-CB 3.31Å; I176-Q180 WeakPolarHBondContact O-CB 3.47Å; I176-Q180 PolarHBondContact O-N 3.01Å; I176-K206 HydrophobicContact CD1-CD 4.47Å; I176-L207 HydrophobicContact CD1-CD2 4.25Å; I176-L207 HydrophobicContact CG1-CD2 3.54Å; I176-R210 HydrophobicContact CG2-CG 4.2Å; I176-F211 HydrophobicContact CG1-CE2 4.39Å; I176-F211 HydrophobicContact CG2-CE2 4.35Å; I176-F211 HydrophobicContact CG2-CZ 4.02Å
177	G	98.4	Very high	97.2	Very high	25 Å²	25	31 Å²	31	26%	0.258	18%	0.178	S	C	.	.	H	α-helix	trans	-61.1	-38.6	178.4	0	0	0	0	0	113.3	D173 T174 A175 Y181	D173-G177 PolarHBondContact O-N 3.28Å; T174-G177 PolarHBondContact O-N 2.85Å; A175-G177 VanDerWaalsContact C-N 3.3Å; A175-G177 PolarHBondContact O-N 3.38Å; G177-Y181 WeakPolarHBondContact O-CB 3.49Å; G177-Y181 PolarHBondContact O-N 3.42Å
178	L	98.6	Very high	97.3	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-72.3	-41.7	176	-74.9	175.8	0	0	0	112.7	I102 A146 Q148 T174 A175 I176 Q180 Y181 A182	I102-L178 HydrophobicContact CD1-CB 4.15Å; I102-L178 WeakPolarHBondContact CD1-O 3.26Å; I102-L178 HydrophobicContact CG1-CB 4.23Å; I102-L178 HydrophobicContact CG2-CB 3.65Å; I102-L178 HydrophobicContact CG2-CD1 4.04Å; I102-L178 HydrophobicContact CG2-CG 4.46Å; A146-L178 HydrophobicContact CB-CD2 4.23Å; Q148-L178 HydrophobicContact CB-CD1 3.94Å; Q148-L178 HydrophobicContact CB-CD2 4.04Å; Q148-L178 HydrophobicContact CB-CG 4.06Å; T174-L178 PolarHBondContact O-N 3.2Å; A175-L178 PolarHBondContact O-N 2.87Å; I176-L178 VanDerWaalsContact C-N 3.33Å; I176-L178 PolarHBondContact O-N 3.21Å; L178-Q180 VanDerWaalsContact C-N 3.31Å; L178-Q180 PolarHBondContact O-N 3.21Å; L178-Y181 WeakPolarHBondContact O-CB 3.42Å; L178-Y181 PolarHBondContact O-N 3.36Å; L178-A182 PolarHBondContact O-N 3.12Å
179	I	98.6	Very high	97.5	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-60.2	-45.5	174.3	-64.7	162.1	0	0	0	109.9	L84 V86 A175 I176 Y181 A182 L183 L189 V192 L207 F211	L84-I179 HydrophobicContact CD2-CG1 4.21Å; V86-I179 HydrophobicContact CG2-CD1 4.15Å; V86-I179 HydrophobicContact CG2-CG1 4.08Å; A175-I179 WeakPolarHBondContact O-CG1 3.41Å; A175-I179 PolarHBondContact O-N 2.93Å; I176-I179 PolarHBondContact O-N 2.81Å; I179-Y181 VanDerWaalsContact C-N 3.33Å; I179-Y181 PolarHBondContact O-N 3.28Å; I179-A182 PolarHBondContact O-N 2.76Å; I179-L183 PolarHBondContact O-N 3.19Å; I179-L189 HydrophobicContact CG2-CD2 4.03Å; I179-V192 HydrophobicContact CD1-CG1 3.95Å; I179-V192 HydrophobicContact CG1-CG1 4.44Å; I179-V192 HydrophobicContact CG2-CG2 4.39Å; I179-L207 HydrophobicContact CD1-CD2 4.13Å; I179-F211 HydrophobicContact CB-CE2 4.04Å; I179-F211 HydrophobicContact CB-CZ 3.87Å; I179-F211 HydrophobicContact CD1-CE2 4.11Å; I179-F211 HydrophobicContact CG2-CD1 4.32Å; I179-F211 HydrophobicContact CG2-CD2 4.12Å; I179-F211 HydrophobicContact CG2-CE1 3.92Å; I179-F211 HydrophobicContact CG2-CE2 3.7Å; I179-F211 HydrophobicContact CG2-CG 4.41Å; I179-F211 HydrophobicContact CG2-CZ 3.58Å
180	Q	98.6	Very high	97.7	Very high	53 Å²	53	32.7 Å²	32.7	25%	0.248	18%	0.178	C	C	.	.	H	α-helix	trans	-61.5	-41.9	176.4	-171.6	64.9	60.8	0	0	111.5	I176 L178 A182 L183 D184	I176-Q180 VanDerWaalsContact O-CB 3.31Å; I176-Q180 WeakPolarHBondContact O-CB 3.47Å; I176-Q180 PolarHBondContact O-N 3.01Å; L178-Q180 VanDerWaalsContact C-N 3.31Å; L178-Q180 PolarHBondContact O-N 3.21Å; Q180-A182 VanDerWaalsContact C-N 3.31Å; Q180-A182 PolarHBondContact O-N 2.87Å; Q180-L183 WeakPolarHBondContact O-CB 3.41Å; Q180-L183 PolarHBondContact O-N 3.19Å; Q180-D184 PolarHBondContact NE2-OD1 2.77Å; Q180-D184 WeakPolarHBondContact O-CB 3.45Å; Q180-D184 PolarHBondContact O-N 3.01Å
181	Y	98.5	Very high	97.8	Very high	52 Å²	52	34 Å²	34	20%	0.204	18%	0.183	C	C	.	.	H	α-helix	trans	-58	-41	175.5	169.3	-100.5	0	0	0	112.7	A70 A146 G177 L178 I179 D184 S185	A70-Y181 HydrophobicContact CB-CE1 3.79Å; A70-Y181 VanDerWaalsContact CB-OH 3.28Å; A70-Y181 WeakPolarHBondContact CB-OH 3.45Å; A146-Y181 HydrophobicContact CB-CD1 3.84Å; A146-Y181 HydrophobicContact CB-CE1 3.68Å; G177-Y181 WeakPolarHBondContact O-CB 3.49Å; G177-Y181 PolarHBondContact O-N 3.42Å; L178-Y181 WeakPolarHBondContact O-CB 3.42Å; L178-Y181 PolarHBondContact O-N 3.36Å; I179-Y181 VanDerWaalsContact C-N 3.33Å; I179-Y181 PolarHBondContact O-N 3.28Å; Y181-D184 PolarHBondContact O-N 2.62Å; Y181-S185 WeakPolarHBondContact CE2-OG 3.29Å; Y181-S185 WeakPolarHBondContact O-CB 3.22Å; Y181-S185 PolarHBondContact O-N 2.5Å; Y181-S185 PolarHBondContact O-OG 2.78Å
182	A	98.4	Very high	98	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-62.3	-44.2	176.6	0	0	0	0	0	111.6	L84 I102 L178 I179 Q180 S185 G186 V187	L84-A182 HydrophobicContact CD1-CB 3.82Å; I102-A182 HydrophobicContact CD1-CB 3.98Å; L178-A182 PolarHBondContact O-N 3.12Å; I179-A182 PolarHBondContact O-N 2.76Å; Q180-A182 VanDerWaalsContact C-N 3.31Å; Q180-A182 PolarHBondContact O-N 2.87Å; A182-S185 PolarHBondContact O-N 3.27Å; A182-G186 PolarHBondContact O-N 2.82Å; A182-V187 HydrophobicContact CB-CB 4.36Å; A182-V187 HydrophobicContact CB-CG2 4.27Å; A182-V187 VanDerWaalsContact O-CB 3.29Å; A182-V187 WeakPolarHBondContact O-CB 3.07Å; A182-V187 WeakPolarHBondContact O-CG2 3.48Å; A182-V187 PolarHBondContact O-N 3.24Å
183	L	98.2	Very high	98.2	Very high	52 Å²	52	33 Å²	33	27%	0.272	18%	0.178	S	C	.	.	H	α-helix	trans	-61.1	-50.3	175.4	-67.8	170.3	0	0	0	111.8	I179 Q180 S185 G186 L189 F211 I214	I179-L183 PolarHBondContact O-N 3.19Å; Q180-L183 WeakPolarHBondContact O-CB 3.41Å; Q180-L183 PolarHBondContact O-N 3.19Å; L183-S185 PolarHBondContact O-N 3.08Å; L183-G186 WeakPolarHBondContact O-CA 3.48Å; L183-G186 PolarHBondContact O-N 3.25Å; L183-L189 HydrophobicContact CD2-CB 3.75Å; L183-L189 HydrophobicContact CD2-CD2 4.23Å; L183-L189 HydrophobicContact CG-CD2 4.37Å; L183-F211 HydrophobicContact CD1-CD1 3.83Å; L183-F211 HydrophobicContact CD1-CE1 3.86Å; L183-I214 HydrophobicContact CD1-CD1 4.01Å; L183-I214 HydrophobicContact CD2-CD1 3.98Å; L183-I214 HydrophobicContact CG-CD1 4.45Å
184	D	98.3	Very high	98.2	Very high	118 Å²	118	30 Å²	30	63%	0.631	16%	0.162	S	C	*	.	H	α-helix	trans	-63.2	-29.9	-179.8	-63.2	-12.8	0	0	0	111.6	Q180 Y181 G186	Q180-D184 PolarHBondContact NE2-OD1 2.77Å; Q180-D184 WeakPolarHBondContact O-CB 3.45Å; Q180-D184 PolarHBondContact O-N 3.01Å; Y181-D184 PolarHBondContact O-N 2.62Å; D184-G186 PolarHBondContact O-N 2.81Å
185	S	97.7	Very high	98.1	Very high	25 Å²	25	30.3 Å²	30.3	18%	0.175	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-2.1	174.9	-58.9	0	0	0	0	113.2	R78 Y181 A182 L183	R78-S185 VanDerWaalsContact CZ-O 3.25Å; R78-S185 PolarHBondContact NH1-O 2.68Å; R78-S185 PolarHBondContact NH2-O 3.35Å; Y181-S185 WeakPolarHBondContact CE2-OG 3.29Å; Y181-S185 WeakPolarHBondContact O-CB 3.22Å; Y181-S185 PolarHBondContact O-N 2.5Å; Y181-S185 PolarHBondContact O-OG 2.78Å; A182-S185 PolarHBondContact O-N 3.27Å; L183-S185 PolarHBondContact O-N 3.08Å
186	G	97.8	Very high	97.8	Very high	33 Å²	33	31 Å²	31	34%	0.34	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.5	23	175.4	0	0	0	0	0	115	R78 A182 L183 D184	R78-G186 WeakPolarHBondContact CA-O 3.47Å; A182-G186 PolarHBondContact O-N 2.82Å; L183-G186 WeakPolarHBondContact O-CA 3.48Å; L183-G186 PolarHBondContact O-N 3.25Å; D184-G186 PolarHBondContact O-N 2.81Å
187	V	98.4	Very high	96.9	Very high	6 Å²	6	35.1 Å²	35.1	4%	0.036	19%	0.193	C	C	.	.			trans	-73	129.2	171.1	179.7	0	0	0	0	109.3	I73 C77 C82 F104 A182 L189	I73-V187 HydrophobicContact CD1-CG2 4.38Å; I73-V187 HydrophobicContact CG2-CG2 3.84Å; C77-V187 HydrophobicContact CB-CG1 4.46Å; C77-V187 CarbonylContact O-C 3.56Å; C77-V187 WeakPolarHBondContact O-CA 2.95Å; C82-V187 HydrophobicContact CB-CG1 3.97Å; F104-V187 HydrophobicContact CD2-CG1 3.83Å; F104-V187 HydrophobicContact CD2-CG2 3.98Å; F104-V187 HydrophobicContact CE1-CG2 4.39Å; F104-V187 HydrophobicContact CE2-CG1 4.22Å; F104-V187 HydrophobicContact CE2-CG2 3.53Å; F104-V187 HydrophobicContact CG-CG1 4.31Å; F104-V187 HydrophobicContact CZ-CG2 3.77Å; A182-V187 HydrophobicContact CB-CB 4.36Å; A182-V187 HydrophobicContact CB-CG2 4.27Å; A182-V187 VanDerWaalsContact O-CB 3.29Å; A182-V187 WeakPolarHBondContact O-CB 3.07Å; A182-V187 WeakPolarHBondContact O-CG2 3.48Å; A182-V187 PolarHBondContact O-N 3.24Å; V187-L189 PolarHBondContact O-N 3.09Å
188	Q	97.8	Very high	96	Very high	71 Å²	71	35.6 Å²	35.6	33%	0.332	20%	0.198	S	C	.	.			trans	-79.7	71	178.3	-176.9	170	-17.8	0	0	110.6	C77 R78 T79 E80 D81 C82	C77-Q188 PolarHBondContact O-N 3.35Å; R78-Q188 PolarHBondContact O-OE1 3.43Å; T79-Q188 PolarHBondContact O-OE1 3.35Å; E80-Q188 WeakPolarHBondContact O-CB 3.47Å; D81-Q188 WeakPolarHBondContact CA-O 3.43Å; D81-Q188 PolarHBondContact OD1-NE2 2.99Å; C82-Q188 PolarHBondContact N-O 2.85Å
189	L	98.1	Very high	95.4	Very high	10 Å²	10	40.5 Å²	40.5	5%	0.052	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	127.9	-171.3	-171	56.5	0	0	0	112.5	L84 I179 L183 V187 E191 V192 I214	L84-L189 HydrophobicContact CB-CD1 3.39Å; L84-L189 HydrophobicContact CB-CD2 4.38Å; L84-L189 HydrophobicContact CD1-CD1 4.24Å; L84-L189 HydrophobicContact CD1-CD2 3.96Å; L84-L189 HydrophobicContact CG-CD1 4.46Å; I179-L189 HydrophobicContact CG2-CD2 4.03Å; L183-L189 HydrophobicContact CD2-CB 3.75Å; L183-L189 HydrophobicContact CD2-CD2 4.23Å; L183-L189 HydrophobicContact CG-CD2 4.37Å; V187-L189 PolarHBondContact O-N 3.09Å; L189-E191 WeakPolarHBondContact CD1-O 3.39Å; L189-V192 HydrophobicContact CD1-CG2 4.1Å; L189-V192 HydrophobicContact CD2-CG2 3.64Å; L189-V192 HydrophobicContact CG-CG2 3.98Å; L189-I214 HydrophobicContact CB-CD1 4.3Å; L189-I214 HydrophobicContact CD2-CD1 3.87Å; L189-I214 HydrophobicContact CG-CD1 4Å; L189-I214 HydrophobicContact CG-CG2 4.32Å
190	K	98.2	Very high	95.1	Very high	90 Å²	90	41.4 Å²	41.4	39%	0.391	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	-32.9	175.8	-70.2	-54.6	-174.8	-179	0	114.5	D81 C82 I214 Q215	D81-K190 HydrophobicContact CB-CB 4.28Å; D81-K190 HydrophobicContact CB-CG 3.47Å; D81-K190 VanDerWaalsContact CB-CG 3.47Å; D81-K190 WeakPolarHBondContact OD1-CE 3.4Å; D81-K190 WeakPolarHBondContact OD1-CG 3.28Å; D81-K190 WeakPolarHBondContact OD2-CE 3.24Å; C82-K190 PolarHBondContact O-N 3.37Å; K190-I214 WeakPolarHBondContact O-CG2 3.41Å; K190-Q215 PolarHBondContact O-N 3.46Å
191	E	98.5	Very high	94.9	Very high	31 Å²	31	46.5 Å²	46.5	15%	0.145	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	135.6	-175	-58.8	171.6	-177.9	0	0	110.2	C82 C83 L84 K110 L189 Y193 Q215	C82-E191 PolarHBondContact O-N 3.4Å; C83-E191 CarbonylContact C-O 3.56Å; C83-E191 WeakPolarHBondContact CA-O 3.46Å; C83-E191 HydrophobicContact CB-CB 4Å; L84-E191 PolarHBondContact N-O 3.3Å; K110-E191 VanDerWaalsContact CE-OE2 3.23Å; K110-E191 WeakPolarHBondContact CE-OE2 3.46Å; K110-E191 IonicContact NZ-OE1 3.3Å; K110-E191 PolarHBondContact NZ-OE1 3.05Å; K110-E191 IonicContact NZ-OE2 2.65Å; K110-E191 PolarHBondContact NZ-OE2 3.28Å; L189-E191 WeakPolarHBondContact CD1-O 3.39Å; E191-Y193 HydrophobicContact CB-CE2 3.98Å; E191-Y193 WeakPolarHBondContact OE2-CE2 3.26Å; E191-Y193 PolarHBondContact OE2-OH 3.36Å; E191-Q215 CarbonylContact C-O 3.57Å; E191-Q215 WeakPolarHBondContact CA-O 3.46Å
192	V	98.6	Very high	94.6	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.006	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	124.2	177	169.1	0	0	0	0	109.2	L84 V86 I179 L189 V194 I214 Q215 V216 T217	L84-V192 HydrophobicContact CB-CG2 4.27Å; L84-V192 HydrophobicContact CD2-CG1 4.33Å; L84-V192 HydrophobicContact CD2-CG2 4.36Å; L84-V192 CarbonylContact O-C 3.55Å; L84-V192 WeakPolarHBondContact O-CA 3.26Å; V86-V192 HydrophobicContact CG2-CG1 4.36Å; I179-V192 HydrophobicContact CD1-CG1 3.95Å; I179-V192 HydrophobicContact CG1-CG1 4.44Å; I179-V192 HydrophobicContact CG2-CG2 4.39Å; L189-V192 HydrophobicContact CD1-CG2 4.1Å; L189-V192 HydrophobicContact CD2-CG2 3.64Å; L189-V192 HydrophobicContact CG-CG2 3.98Å; V192-V194 HydrophobicContact CG1-CG2 3.73Å; V192-I214 HydrophobicContact CB-CG2 4.14Å; V192-I214 HydrophobicContact CG2-CG2 3.61Å; V192-Q215 PolarHBondContact N-O 2.97Å; V192-V216 HydrophobicContact CB-CG2 4.41Å; V192-V216 HydrophobicContact CG1-CG1 4.48Å; V192-V216 CarbonylContact O-C 3.52Å; V192-V216 WeakPolarHBondContact O-CA 3.44Å; V192-T217 PolarHBondContact O-N 2.9Å
193	Y	98.4	Very high	94.4	Very high	25 Å²	25	52.2 Å²	52.2	10%	0.098	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	130.7	176.5	-57.4	-77	0	0	0	109.3	C83 L84 G85 V86 K110 E191 T217 F226 V228 V229	C83-Y193 HydrophobicContact CB-CD2 4.48Å; C83-Y193 HydrophobicContact CB-CE2 4Å; L84-Y193 PolarHBondContact O-N 3.1Å; G85-Y193 CarbonylContact C-O 3.06Å; G85-Y193 VanDerWaalsContact CA-O 3.3Å; G85-Y193 WeakPolarHBondContact CA-O 3.47Å; V86-Y193 PolarHBondContact N-O 3.09Å; K110-Y193 PolarHBondContact NZ-OH 3.5Å; E191-Y193 HydrophobicContact CB-CE2 3.98Å; E191-Y193 WeakPolarHBondContact OE2-CE2 3.26Å; E191-Y193 PolarHBondContact OE2-OH 3.36Å; Y193-T217 VanDerWaalsContact CA-O 3.31Å; Y193-T217 WeakPolarHBondContact CA-O 3.4Å; Y193-T217 HydrophobicContact CD1-CG2 4.2Å; Y193-F226 AromaticContact CD1-CD1 3.56Å; Y193-F226 HydrophobicContact CD1-CD1 3.56Å; Y193-F226 AromaticContact CD1-CD2 3.92Å; Y193-F226 HydrophobicContact CD1-CD2 3.92Å; Y193-F226 AromaticContact CD1-CE1 3.49Å; Y193-F226 HydrophobicContact CD1-CE1 3.49Å; Y193-F226 VanDerWaalsContact CD1-CE1 3.49Å; Y193-F226 AromaticContact CD1-CE2 3.85Å; Y193-F226 HydrophobicContact CD1-CE2 3.85Å; Y193-F226 AromaticContact CD1-CG 3.78Å; Y193-F226 HydrophobicContact CD1-CG 3.78Å; Y193-F226 AromaticContact CD1-CZ 3.63Å; Y193-F226 HydrophobicContact CD1-CZ 3.63Å; Y193-F226 HydrophobicContact CD2-CD1 4.43Å; Y193-F226 HydrophobicContact CD2-CG 4.49Å; Y193-F226 AromaticContact CE1-CD1 3.67Å; Y193-F226 HydrophobicContact CE1-CD1 3.67Å; Y193-F226 AromaticContact CE1-CE1 3.4Å; Y193-F226 HydrophobicContact CE1-CE1 3.4Å; Y193-F226 VanDerWaalsContact CE1-CE1 3.4Å; Y193-F226 HydrophobicContact CE1-CG 4.36Å; Y193-F226 AromaticContact CE1-CZ 3.89Å; Y193-F226 HydrophobicContact CE1-CZ 3.89Å; Y193-F226 HydrophobicContact CE2-CD1 4.48Å; Y193-F226 HydrophobicContact CG-CB 4.27Å; Y193-F226 AromaticContact CG-CD1 3.96Å; Y193-F226 HydrophobicContact CG-CD1 3.96Å; Y193-F226 HydrophobicContact CG-CD2 4.15Å; Y193-F226 HydrophobicContact CG-CE1 4.34Å; Y193-F226 AromaticContact CG-CG 3.85Å; Y193-F226 HydrophobicContact CG-CG 3.85Å; Y193-V228 HydrophobicContact CD2-CG1 3.81Å; Y193-V229 VanDerWaalsContact CB-CG2 3.43Å; Y193-V229 WeakPolarHBondContact O-CG2 3.36Å
194	V	98	Very high	94.3	Very high	3 Å²	3	52 Å²	52	2%	0.018	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	130.5	-174.5	-176.2	0	0	0	0	110.2	V86 V192 Y203 L207 T217 V218 R219	V86-V194 HydrophobicContact CB-CB 4.35Å; V86-V194 HydrophobicContact CB-CG1 4.13Å; V86-V194 HydrophobicContact CB-CG2 4.04Å; V86-V194 HydrophobicContact CG1-CG1 4.49Å; V86-V194 HydrophobicContact CG2-CG2 3.87Å; V192-V194 HydrophobicContact CG1-CG2 3.73Å; V194-Y203 HydrophobicContact CG1-CD1 4.37Å; V194-Y203 HydrophobicContact CG1-CE1 3.59Å; V194-L207 HydrophobicContact CG2-CD1 3.83Å; V194-T217 PolarHBondContact N-O 3.46Å; V194-V218 HydrophobicContact CB-CG1 4.29Å; V194-V218 HydrophobicContact CB-CG2 4.1Å; V194-V218 HydrophobicContact CG1-CG1 4.48Å; V194-V218 HydrophobicContact CG2-CG2 4.41Å; V194-R219 PolarHBondContact O-N 3.43Å
195	D	95.7	Very high	94.2	Very high	22 Å²	22	51.9 Å²	51.9	12%	0.118	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	144.7	167.3	-166.5	49.1	0	0	0	111.5	V86 K221 A222 V229	V86-D195 PolarHBondContact O-N 2.71Å; V86-D195 VanDerWaalsContact O-N 3.07Å; D195-K221 VanDerWaalsContact OD1-CA 3.26Å; D195-K221 WeakPolarHBondContact OD1-CA 3.36Å; D195-K221 PolarHBondContact OD1-N 3.02Å; D195-A222 HydrophobicContact CB-CB 3.98Å; D195-A222 PolarHBondContact OD1-N 3.33Å; D195-V229 HydrophobicContact CB-CG1 4.06Å
196	T	91.9	Very high	94.1	Very high	14 Å²	14	54.3 Å²	54.3	9%	0.086	29%	0.288	C	S	.	.			trans	-145	144.7	177.3	-171.1	0	0	0	0	112.7	G198 A200 V218 R219 P220	T196-G198 WeakPolarHBondContact CG2-O 3.29Å; T196-G198 PolarHBondContact OG1-N 3.5Å; T196-G198 VanDerWaalsContact OG1-N 3.12Å; T196-A200 HydrophobicContact CG2-CB 3.98Å; T196-V218 HydrophobicContact CG2-CG1 3.62Å; T196-R219 PolarHBondContact N-O 2.99Å; T196-P220 WeakPolarHBondContact O-CA 3.26Å
197	V	78.8	Confident	94.1	Very high	106 Å²	106	52.8 Å²	52.8	64%	0.642	27%	0.272	S	S	*	.	S	Bend	trans	-95.3	2.2	170.5	-62.1	0	0	0	0	112.8
198	G	79.3	Confident	94	Very high	36 Å²	36	54.6 Å²	54.6	37%	0.371	29%	0.285	S	S	.	.	S	Bend	trans	-129.3	-167.2	-174.6	0	0	0	0	0	114.4	T196 A200	T196-G198 WeakPolarHBondContact CG2-O 3.29Å; T196-G198 PolarHBondContact OG1-N 3.5Å; T196-G198 VanDerWaalsContact OG1-N 3.12Å; G198-A200 PolarHBondContact O-N 2.61Å
199	P	85.8	Confident	94	Very high	102 Å²	102	57.8 Å²	57.8	66%	0.662	30%	0.3	S	S	*	.			trans	-62.5	107.3	-179.9	-19.5	31.8	0	0	0	111.2	E201	P199-E201 VanDerWaalsContact C-N 3.35Å; P199-E201 PolarHBondContact O-N 3.04Å
200	A	92.2	Very high	94	Very high	19 Å²	19	64.2 Å²	64.2	16%	0.157	32%	0.323	C	S	.	.	H	α-helix	trans	-61.6	-40.5	-175.3	0	0	0	0	0	112.9	T196 G198 K202 Y203 E204 V218	T196-A200 HydrophobicContact CG2-CB 3.98Å; G198-A200 PolarHBondContact O-N 2.61Å; A200-K202 PolarHBondContact O-N 3.1Å; A200-Y203 PolarHBondContact O-N 2.86Å; A200-Y203 VanDerWaalsContact O-N 3.15Å; A200-E204 WeakPolarHBondContact O-CB 3.28Å; A200-E204 PolarHBondContact O-N 2.95Å; A200-V218 HydrophobicContact CB-CB 4.38Å; A200-V218 HydrophobicContact CB-CG1 4.14Å; A200-V218 WeakPolarHBondContact CB-O 3.09Å
201	E	93.9	Very high	93.9	Very high	161 Å²	161	60.4 Å²	60.4	75%	0.752	31%	0.307	S	S	*	.	H	α-helix	trans	-57.1	-51	-174.3	-64.6	166	-173	0	0	113	P199 Y203 E204 E205	P199-E201 VanDerWaalsContact C-N 3.35Å; P199-E201 PolarHBondContact O-N 3.04Å; E201-Y203 VanDerWaalsContact C-N 3.26Å; E201-Y203 PolarHBondContact O-N 2.91Å; E201-E204 PolarHBondContact O-N 3.36Å; E201-E205 WeakPolarHBondContact O-CB 3.39Å; E201-E205 PolarHBondContact O-N 3Å
202	K	92.6	Very high	93.8	Very high	161 Å²	161	64.4 Å²	64.4	70%	0.7	34%	0.335	S	S	*	.	H	α-helix	trans	-64.8	-33.5	179.9	-70.2	-174.7	177.4	-178.2	0	112.3	A200 K206	A200-K202 PolarHBondContact O-N 3.1Å; K202-K206 WeakPolarHBondContact O-CB 3.43Å; K202-K206 PolarHBondContact O-N 2.8Å; K202-K206 VanDerWaalsContact O-N 3.09Å
203	Y	94.5	Very high	93.6	Very high	11 Å²	11	67.5 Å²	67.5	4%	0.043	37%	0.367	C	S	.	.	H	α-helix	trans	-75.9	-40.7	179.7	-170.5	-160.1	0	0	0	111.1	H172 A175 V194 A200 E201 E205 K206 L207 V218	H172-Y203 HydrophobicContact CB-CE2 3.95Å; H172-Y203 AromaticContact CD2-CD2 3.77Å; H172-Y203 AromaticContact CD2-CE1 3.78Å; H172-Y203 AromaticContact CD2-CE2 3.41Å; H172-Y203 VanDerWaalsContact CD2-CE2 3.41Å; H172-Y203 WeakPolarHBondContact CD2-CE2 3.49Å; H172-Y203 AromaticContact CD2-CZ 3.42Å; H172-Y203 VanDerWaalsContact CD2-CZ 3.42Å; H172-Y203 AromaticContact CG-CD2 3.98Å; H172-Y203 AromaticContact CG-CE2 3.63Å; H172-Y203 AromaticContact NE2-CD1 3.93Å; H172-Y203 AromaticContact NE2-CD2 3.86Å; H172-Y203 AromaticContact NE2-CE2 4Å; H172-Y203 AromaticContact NE2-CG 3.84Å; A175-Y203 WeakPolarHBondContact CB-OH 3.34Å; V194-Y203 HydrophobicContact CG1-CD1 4.37Å; V194-Y203 HydrophobicContact CG1-CE1 3.59Å; A200-Y203 PolarHBondContact O-N 2.86Å; A200-Y203 VanDerWaalsContact O-N 3.15Å; E201-Y203 VanDerWaalsContact C-N 3.26Å; E201-Y203 PolarHBondContact O-N 2.91Å; Y203-E205 VanDerWaalsContact C-N 3.33Å; Y203-E205 PolarHBondContact O-N 3.34Å; Y203-K206 PolarHBondContact O-N 2.93Å; Y203-L207 HydrophobicContact CD2-CD1 4Å; Y203-L207 HydrophobicContact CD2-CG 3.93Å; Y203-L207 HydrophobicContact CE1-CD1 4.43Å; Y203-L207 HydrophobicContact CE2-CD1 3.67Å; Y203-L207 HydrophobicContact CE2-CD2 4.02Å; Y203-L207 HydrophobicContact CE2-CG 3.68Å; Y203-L207 WeakPolarHBondContact O-CG 3.41Å; Y203-L207 PolarHBondContact O-N 3.44Å; Y203-V218 HydrophobicContact CD1-CG1 3.76Å; Y203-V218 HydrophobicContact CD1-CG2 4.42Å; Y203-V218 HydrophobicContact CG-CG1 4.38Å
204	E	96.6	Very high	93.5	Very high	47 Å²	47	67.3 Å²	67.3	22%	0.22	37%	0.367	C	S	.	.	H	α-helix	trans	-59.1	-44.6	172.7	-167	170.4	107.8	0	0	111.1	A200 E201 L207 S208 V216 V218 R219	A200-E204 WeakPolarHBondContact O-CB 3.28Å; A200-E204 PolarHBondContact O-N 2.95Å; E201-E204 PolarHBondContact O-N 3.36Å; E204-L207 PolarHBondContact O-N 3.49Å; E204-S208 VanDerWaalsContact O-CB 3.26Å; E204-S208 WeakPolarHBondContact O-CB 3.44Å; E204-S208 PolarHBondContact O-N 2.59Å; E204-S208 PolarHBondContact O-OG 3.46Å; E204-V216 HydrophobicContact CG-CG1 4.49Å; E204-V218 VanDerWaalsContact CA-CG2 3.5Å; E204-V218 HydrophobicContact CB-CB 3.98Å; E204-V218 HydrophobicContact CB-CG2 3.71Å; E204-V218 HydrophobicContact CG-CG2 4.17Å; E204-V218 PolarHBondContact OE2-N 3.43Å; E204-R219 IonicContact OE2-CZ 2.57Å; E204-R219 IonicContact OE2-NH1 3.46Å; E204-R219 PolarHBondContact OE2-NH1 3.13Å
205	E	96.3	Very high	93.5	Very high	115 Å²	115	72.9 Å²	72.9	54%	0.537	39%	0.394	S	S	.	.	H	α-helix	trans	-60.9	-49	175.2	-174.7	-178.8	-168.5	0	0	111.6	E201 Y203 L207 S208 Q209	E201-E205 WeakPolarHBondContact O-CB 3.39Å; E201-E205 PolarHBondContact O-N 3Å; Y203-E205 VanDerWaalsContact C-N 3.33Å; Y203-E205 PolarHBondContact O-N 3.34Å; E205-L207 VanDerWaalsContact C-N 3.32Å; E205-L207 PolarHBondContact O-N 2.94Å; E205-S208 PolarHBondContact O-N 2.91Å; E205-Q209 WeakPolarHBondContact O-CB 3.45Å; E205-Q209 WeakPolarHBondContact O-CG 3.33Å; E205-Q209 PolarHBondContact O-N 3.31Å; E205-Q209 PolarHBondContact OE1-NE2 3.37Å
206	K	95.6	Very high	93.7	Very high	77 Å²	77	72.3 Å²	72.3	34%	0.335	39%	0.391	S	S	.	.	H	α-helix	trans	-56	-46.3	177.8	-178.8	-178.9	178.6	-171	0	111.4	D173 I176 K202 Y203 R210	D173-K206 IonicContact OD1-NZ 3.09Å; D173-K206 PolarHBondContact OD1-NZ 3.46Å; I176-K206 HydrophobicContact CD1-CD 4.47Å; K202-K206 WeakPolarHBondContact O-CB 3.43Å; K202-K206 PolarHBondContact O-N 2.8Å; K202-K206 VanDerWaalsContact O-N 3.09Å; Y203-K206 PolarHBondContact O-N 2.93Å; K206-R210 WeakPolarHBondContact O-CB 3.03Å; K206-R210 PolarHBondContact O-N 3.08Å; K206-R210 VanDerWaalsContact O-N 3.16Å
207	L	96.8	Very high	94	Very high	0 Å²	0	72.8 Å²	72.8	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-70.6	-40.7	-179.8	-72.4	175.9	0	0	0	112.1	I176 I179 V194 Y203 E204 E205 Q209 R210 F211 V216 V218	I176-L207 HydrophobicContact CD1-CD2 4.25Å; I176-L207 HydrophobicContact CG1-CD2 3.54Å; I179-L207 HydrophobicContact CD1-CD2 4.13Å; V194-L207 HydrophobicContact CG2-CD1 3.83Å; Y203-L207 HydrophobicContact CD2-CD1 4Å; Y203-L207 HydrophobicContact CD2-CG 3.93Å; Y203-L207 HydrophobicContact CE1-CD1 4.43Å; Y203-L207 HydrophobicContact CE2-CD1 3.67Å; Y203-L207 HydrophobicContact CE2-CD2 4.02Å; Y203-L207 HydrophobicContact CE2-CG 3.68Å; Y203-L207 WeakPolarHBondContact O-CG 3.41Å; Y203-L207 PolarHBondContact O-N 3.44Å; E204-L207 PolarHBondContact O-N 3.49Å; E205-L207 VanDerWaalsContact C-N 3.32Å; E205-L207 PolarHBondContact O-N 2.94Å; L207-Q209 VanDerWaalsContact C-N 3.34Å; L207-Q209 PolarHBondContact O-N 2.9Å; L207-R210 PolarHBondContact O-N 3Å; L207-R210 VanDerWaalsContact O-N 3.14Å; L207-F211 HydrophobicContact CD2-CD2 4.37Å; L207-F211 HydrophobicContact CD2-CE2 4.06Å; L207-F211 WeakPolarHBondContact O-CD2 3.19Å; L207-F211 PolarHBondContact O-N 3.41Å; L207-V216 HydrophobicContact CB-CB 4.44Å; L207-V216 HydrophobicContact CB-CG1 3.74Å; L207-V216 HydrophobicContact CB-CG2 4.22Å; L207-V216 HydrophobicContact CD1-CG1 3.93Å; L207-V218 HydrophobicContact CD1-CG2 3.98Å
208	S	97.4	Very high	94.9	Very high	45 Å²	45	67.7 Å²	67.7	32%	0.315	36%	0.363	S	S	.	.	H	α-helix	trans	-64.1	-39.3	178.3	-57.8	0	0	0	0	111.6	E204 E205 R210 F211 P212	E204-S208 VanDerWaalsContact O-CB 3.26Å; E204-S208 WeakPolarHBondContact O-CB 3.44Å; E204-S208 PolarHBondContact O-N 2.59Å; E204-S208 PolarHBondContact O-OG 3.46Å; E205-S208 PolarHBondContact O-N 2.91Å; S208-R210 VanDerWaalsContact C-N 3.33Å; S208-F211 CarbonylContact O-C 3.51Å; S208-F211 PolarHBondContact O-N 2.89Å; S208-P212 WeakPolarHBondContact O-CA 3.44Å
209	Q	97.4	Very high	95.7	Very high	138 Å²	138	71 Å²	71	65%	0.645	36%	0.364	S	S	*	.	H	α-helix	trans	-65.3	-37.5	173.3	-71.7	176.5	8.2	0	0	112	E205 L207	E205-Q209 WeakPolarHBondContact O-CB 3.45Å; E205-Q209 WeakPolarHBondContact O-CG 3.33Å; E205-Q209 PolarHBondContact O-N 3.31Å; E205-Q209 PolarHBondContact OE1-NE2 3.37Å; L207-Q209 VanDerWaalsContact C-N 3.34Å; L207-Q209 PolarHBondContact O-N 2.9Å
210	R	97.4	Very high	96	Very high	145 Å²	145	69.9 Å²	69.9	55%	0.547	36%	0.357	S	S	.	.	H	α-helix	trans	-72.3	-33.4	178.5	-178.1	58.2	179.2	178.9	2.2	112.5	I176 K206 L207 S208	I176-R210 HydrophobicContact CG2-CG 4.2Å; K206-R210 WeakPolarHBondContact O-CB 3.03Å; K206-R210 PolarHBondContact O-N 3.08Å; K206-R210 VanDerWaalsContact O-N 3.16Å; L207-R210 PolarHBondContact O-N 3Å; L207-R210 VanDerWaalsContact O-N 3.14Å; S208-R210 VanDerWaalsContact C-N 3.33Å
211	F	97.3	Very high	95.9	Very high	10 Å²	10	76.1 Å²	76.1	4%	0.044	38%	0.38	C	S	.	.			trans	-127.6	65.5	-175	-55.8	-68.5	0	0	0	111.7	I176 I179 L183 L207 S208 G213 I214	I176-F211 HydrophobicContact CG1-CE2 4.39Å; I176-F211 HydrophobicContact CG2-CE2 4.35Å; I176-F211 HydrophobicContact CG2-CZ 4.02Å; I179-F211 HydrophobicContact CB-CE2 4.04Å; I179-F211 HydrophobicContact CB-CZ 3.87Å; I179-F211 HydrophobicContact CD1-CE2 4.11Å; I179-F211 HydrophobicContact CG2-CD1 4.32Å; I179-F211 HydrophobicContact CG2-CD2 4.12Å; I179-F211 HydrophobicContact CG2-CE1 3.92Å; I179-F211 HydrophobicContact CG2-CE2 3.7Å; I179-F211 HydrophobicContact CG2-CG 4.41Å; I179-F211 HydrophobicContact CG2-CZ 3.58Å; L183-F211 HydrophobicContact CD1-CD1 3.83Å; L183-F211 HydrophobicContact CD1-CE1 3.86Å; L207-F211 HydrophobicContact CD2-CD2 4.37Å; L207-F211 HydrophobicContact CD2-CE2 4.06Å; L207-F211 WeakPolarHBondContact O-CD2 3.19Å; L207-F211 PolarHBondContact O-N 3.41Å; S208-F211 CarbonylContact O-C 3.51Å; S208-F211 PolarHBondContact O-N 2.89Å; F211-G213 PolarHBondContact O-N 2.9Å; F211-I214 HydrophobicContact CB-CB 4.2Å; F211-I214 HydrophobicContact CB-CD1 3.96Å; F211-I214 HydrophobicContact CB-CG1 4.2Å; F211-I214 HydrophobicContact CD1-CD1 4.42Å; F211-I214 HydrophobicContact CG-CD1 4.37Å; F211-I214 PolarHBondContact O-N 2.74Å
212	P	94.9	Very high	95.9	Very high	115 Å²	115	68.4 Å²	68.4	75%	0.747	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-13.4	-168.9	26.3	-36.1	0	0	0	115.3	S208	S208-P212 WeakPolarHBondContact O-CA 3.44Å
213	G	94.3	Very high	95.8	Very high	65 Å²	65	62.1 Å²	62.1	67%	0.67	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	4.1	176.5	0	0	0	0	0	114.7	F211	F211-G213 PolarHBondContact O-N 2.9Å
214	I	97.8	Very high	95.6	Very high	21 Å²	21	63.4 Å²	63.4	11%	0.108	33%	0.329	C	S	.	.	S	Bend	trans	-121.4	133.4	-173.6	-53.9	-176.8	0	0	0	108.6	L183 L189 K190 V192 F211 V216	L183-I214 HydrophobicContact CD1-CD1 4.01Å; L183-I214 HydrophobicContact CD2-CD1 3.98Å; L183-I214 HydrophobicContact CG-CD1 4.45Å; L189-I214 HydrophobicContact CB-CD1 4.3Å; L189-I214 HydrophobicContact CD2-CD1 3.87Å; L189-I214 HydrophobicContact CG-CD1 4Å; L189-I214 HydrophobicContact CG-CG2 4.32Å; K190-I214 WeakPolarHBondContact O-CG2 3.41Å; V192-I214 HydrophobicContact CB-CG2 4.14Å; V192-I214 HydrophobicContact CG2-CG2 3.61Å; F211-I214 HydrophobicContact CB-CB 4.2Å; F211-I214 HydrophobicContact CB-CD1 3.96Å; F211-I214 HydrophobicContact CB-CG1 4.2Å; F211-I214 HydrophobicContact CD1-CD1 4.42Å; F211-I214 HydrophobicContact CG-CD1 4.37Å; F211-I214 PolarHBondContact O-N 2.74Å; I214-V216 HydrophobicContact CG2-CG2 4.5Å; I214-V216 PolarHBondContact O-N 3.28Å; I214-V216 VanDerWaalsContact O-N 3.16Å
215	Q	98.3	Very high	95.4	Very high	121 Å²	121	66.2 Å²	66.2	57%	0.565	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.8	105.1	171.1	-174.8	178.5	34.5	0	0	109.3	K190 E191 V192	K190-Q215 PolarHBondContact O-N 3.46Å; E191-Q215 CarbonylContact C-O 3.57Å; E191-Q215 WeakPolarHBondContact CA-O 3.46Å; V192-Q215 PolarHBondContact N-O 2.97Å
216	V	98.4	Very high	95.3	Very high	10 Å²	10	62.9 Å²	62.9	6%	0.061	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	135.4	176.7	-174.9	0	0	0	0	110.1	V192 E204 L207 I214 V218	V192-V216 HydrophobicContact CB-CG2 4.41Å; V192-V216 HydrophobicContact CG1-CG1 4.48Å; V192-V216 CarbonylContact O-C 3.52Å; V192-V216 WeakPolarHBondContact O-CA 3.44Å; E204-V216 HydrophobicContact CG-CG1 4.49Å; L207-V216 HydrophobicContact CB-CB 4.44Å; L207-V216 HydrophobicContact CB-CG1 3.74Å; L207-V216 HydrophobicContact CB-CG2 4.22Å; L207-V216 HydrophobicContact CD1-CG1 3.93Å; I214-V216 HydrophobicContact CG2-CG2 4.5Å; I214-V216 PolarHBondContact O-N 3.28Å; I214-V216 VanDerWaalsContact O-N 3.16Å; V216-V218 HydrophobicContact CG1-CG2 4.08Å
217	T	98.2	Very high	95.2	Very high	23 Å²	23	60.8 Å²	60.8	14%	0.141	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	119.1	171.7	-64.5	0	0	0	0	109.1	V192 Y193 V194 R219 F226	V192-T217 PolarHBondContact O-N 2.9Å; Y193-T217 VanDerWaalsContact CA-O 3.31Å; Y193-T217 WeakPolarHBondContact CA-O 3.4Å; Y193-T217 HydrophobicContact CD1-CG2 4.2Å; V194-T217 PolarHBondContact N-O 3.46Å; T217-R219 HydrophobicContact CG2-CG 3.91Å; T217-F226 HydrophobicContact CG2-CE2 4.44Å; T217-F226 HydrophobicContact CG2-CZ 4.13Å
218	V	97.8	Very high	95.2	Very high	0 Å²	0	61 Å²	61	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	125.7	176.2	-174.5	0	0	0	0	108.2	V194 T196 A200 Y203 E204 L207 V216	V194-V218 HydrophobicContact CB-CG1 4.29Å; V194-V218 HydrophobicContact CB-CG2 4.1Å; V194-V218 HydrophobicContact CG1-CG1 4.48Å; V194-V218 HydrophobicContact CG2-CG2 4.41Å; T196-V218 HydrophobicContact CG2-CG1 3.62Å; A200-V218 HydrophobicContact CB-CB 4.38Å; A200-V218 HydrophobicContact CB-CG1 4.14Å; A200-V218 WeakPolarHBondContact CB-O 3.09Å; Y203-V218 HydrophobicContact CD1-CG1 3.76Å; Y203-V218 HydrophobicContact CD1-CG2 4.42Å; Y203-V218 HydrophobicContact CG-CG1 4.38Å; E204-V218 VanDerWaalsContact CA-CG2 3.5Å; E204-V218 HydrophobicContact CB-CB 3.98Å; E204-V218 HydrophobicContact CB-CG2 3.71Å; E204-V218 HydrophobicContact CG-CG2 4.17Å; E204-V218 PolarHBondContact OE2-N 3.43Å; L207-V218 HydrophobicContact CD1-CG2 3.98Å; V216-V218 HydrophobicContact CG1-CG2 4.08Å
219	R	96.2	Very high	95.2	Very high	106 Å²	106	58.9 Å²	58.9	40%	0.4	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	146.4	179.4	-66.6	-66.5	178.5	-93.7	0.6	110.5	V194 T196 E204 T217 A222 L225 F226	V194-R219 PolarHBondContact O-N 3.43Å; T196-R219 PolarHBondContact N-O 2.99Å; E204-R219 IonicContact OE2-CZ 2.57Å; E204-R219 IonicContact OE2-NH1 3.46Å; E204-R219 PolarHBondContact OE2-NH1 3.13Å; T217-R219 HydrophobicContact CG2-CG 3.91Å; R219-A222 HydrophobicContact CB-CB 4.36Å; R219-A222 WeakPolarHBondContact O-CB 3.31Å; R219-L225 HydrophobicContact CB-CD1 4.24Å; R219-F226 HydrophobicContact CG-CE2 4.41Å
220	P	93.1	Very high	95.1	Very high	77 Å²	77	52.3 Å²	52.3	50%	0.5	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	141.5	165.8	29.6	-32.9	0	0	0	109.7	T196 A222	T196-P220 WeakPolarHBondContact O-CA 3.26Å; P220-A222 PolarHBondContact O-N 3.29Å
221	K	90.1	Very high	95	Very high	150 Å²	150	45.4 Å²	45.4	65%	0.652	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	36.5	-177.1	-52.3	177.2	179.5	177.1	0	112.2	D195 D223 S224 L225	D195-K221 VanDerWaalsContact OD1-CA 3.26Å; D195-K221 WeakPolarHBondContact OD1-CA 3.36Å; D195-K221 PolarHBondContact OD1-N 3.02Å; K221-D223 VanDerWaalsContact CA-OD1 3.26Å; K221-D223 WeakPolarHBondContact CA-OD1 3.5Å; K221-D223 PolarHBondContact O-N 2.98Å; K221-S224 WeakPolarHBondContact O-CB 3.33Å; K221-S224 PolarHBondContact O-N 3.43Å; K221-S224 VanDerWaalsContact O-N 3.09Å; K221-L225 WeakPolarHBondContact O-CG 3.35Å
222	A	93.1	Very high	95	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-64	-28.3	-179.9	0	0	0	0	0	111.9	D195 R219 P220 S224 L225 F226 V229	D195-A222 HydrophobicContact CB-CB 3.98Å; D195-A222 PolarHBondContact OD1-N 3.33Å; R219-A222 HydrophobicContact CB-CB 4.36Å; R219-A222 WeakPolarHBondContact O-CB 3.31Å; P220-A222 PolarHBondContact O-N 3.29Å; A222-S224 PolarHBondContact O-N 3.29Å; A222-L225 PolarHBondContact O-N 3.02Å; A222-F226 HydrophobicContact CB-CD2 3.94Å; A222-F226 HydrophobicContact CB-CE2 4.31Å; A222-F226 WeakPolarHBondContact O-CD2 3.22Å; A222-F226 PolarHBondContact O-N 2.86Å; A222-V229 HydrophobicContact CB-CB 4.42Å; A222-V229 HydrophobicContact CB-CG1 3.97Å; A222-V229 HydrophobicContact CB-CG2 4.2Å
223	D	90.6	Very high	95	Very high	28 Å²	28	39.5 Å²	39.5	15%	0.15	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-54.7	-32.7	170.8	69.7	-41.9	0	0	0	113.3	K221 V229 S230	K221-D223 VanDerWaalsContact CA-OD1 3.26Å; K221-D223 WeakPolarHBondContact CA-OD1 3.5Å; K221-D223 PolarHBondContact O-N 2.98Å; D223-V229 HydrophobicContact CB-CG1 4.17Å; D223-S230 VanDerWaalsContact O-CB 3.24Å; D223-S230 WeakPolarHBondContact O-CB 3.38Å; D223-S230 PolarHBondContact O-OG 3.28Å
224	S	90.1	Very high	95.1	Very high	39 Å²	39	36.5 Å²	36.5	27%	0.273	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-85.2	-14.1	177.7	-58.1	0	0	0	0	113.3	K122 K221 A222	K122-S224 WeakPolarHBondContact CE-OG 3.21Å; K122-S224 PolarHBondContact NZ-OG 3.06Å; K221-S224 WeakPolarHBondContact O-CB 3.33Å; K221-S224 PolarHBondContact O-N 3.43Å; K221-S224 VanDerWaalsContact O-N 3.09Å; A222-S224 PolarHBondContact O-N 3.29Å
225	L	91.7	Very high	95	Very high	106 Å²	106	35.5 Å²	35.5	56%	0.555	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106.4	-34.6	-172.9	-61.6	175.2	0	0	0	112	R219 K221 A222	R219-L225 HydrophobicContact CB-CD1 4.24Å; K221-L225 WeakPolarHBondContact O-CG 3.35Å; A222-L225 PolarHBondContact O-N 3.02Å
226	F	94.3	Very high	94.9	Very high	45 Å²	45	29.8 Å²	29.8	20%	0.197	15%	0.152	C	C	.	.			trans	-125.1	116.2	-172.6	-53.9	-72.5	0	0	0	109.9	Y193 T217 R219 A222 V228 V229 S230	Y193-F226 AromaticContact CD1-CD1 3.56Å; Y193-F226 HydrophobicContact CD1-CD1 3.56Å; Y193-F226 AromaticContact CD1-CD2 3.92Å; Y193-F226 HydrophobicContact CD1-CD2 3.92Å; Y193-F226 AromaticContact CD1-CE1 3.49Å; Y193-F226 HydrophobicContact CD1-CE1 3.49Å; Y193-F226 VanDerWaalsContact CD1-CE1 3.49Å; Y193-F226 AromaticContact CD1-CE2 3.85Å; Y193-F226 HydrophobicContact CD1-CE2 3.85Å; Y193-F226 AromaticContact CD1-CG 3.78Å; Y193-F226 HydrophobicContact CD1-CG 3.78Å; Y193-F226 AromaticContact CD1-CZ 3.63Å; Y193-F226 HydrophobicContact CD1-CZ 3.63Å; Y193-F226 HydrophobicContact CD2-CD1 4.43Å; Y193-F226 HydrophobicContact CD2-CG 4.49Å; Y193-F226 AromaticContact CE1-CD1 3.67Å; Y193-F226 HydrophobicContact CE1-CD1 3.67Å; Y193-F226 AromaticContact CE1-CE1 3.4Å; Y193-F226 HydrophobicContact CE1-CE1 3.4Å; Y193-F226 VanDerWaalsContact CE1-CE1 3.4Å; Y193-F226 HydrophobicContact CE1-CG 4.36Å; Y193-F226 AromaticContact CE1-CZ 3.89Å; Y193-F226 HydrophobicContact CE1-CZ 3.89Å; Y193-F226 HydrophobicContact CE2-CD1 4.48Å; Y193-F226 HydrophobicContact CG-CB 4.27Å; Y193-F226 AromaticContact CG-CD1 3.96Å; Y193-F226 HydrophobicContact CG-CD1 3.96Å; Y193-F226 HydrophobicContact CG-CD2 4.15Å; Y193-F226 HydrophobicContact CG-CE1 4.34Å; Y193-F226 AromaticContact CG-CG 3.85Å; Y193-F226 HydrophobicContact CG-CG 3.85Å; T217-F226 HydrophobicContact CG2-CE2 4.44Å; T217-F226 HydrophobicContact CG2-CZ 4.13Å; R219-F226 HydrophobicContact CG-CE2 4.41Å; A222-F226 HydrophobicContact CB-CD2 3.94Å; A222-F226 HydrophobicContact CB-CE2 4.31Å; A222-F226 WeakPolarHBondContact O-CD2 3.22Å; A222-F226 PolarHBondContact O-N 2.86Å; F226-V228 HydrophobicContact CB-CG1 4.44Å; F226-V228 PolarHBondContact O-N 3.49Å; F226-V228 VanDerWaalsContact O-N 3.11Å; F226-V229 HydrophobicContact CB-CB 4.24Å; F226-V229 HydrophobicContact CB-CG2 3.82Å; F226-V229 HydrophobicContact CD2-CG2 4.34Å; F226-V229 HydrophobicContact CG-CG2 4.49Å; F226-V229 PolarHBondContact O-N 2.93Å; F226-S230 PolarHBondContact O-N 3.37Å; F226-S230 VanDerWaalsContact O-N 3.08Å
227	P	94.6	Very high	94.7	Very high	32 Å²	32	32.5 Å²	32.5	21%	0.208	16%	0.163	C	C	.	.	H	α-helix	trans	-54.3	-34.5	-179.4	-28.4	35.1	0	0	0	113.8	L113 K114 V118 S230 A231	L113-P227 HydrophobicContact CD2-CB 4.21Å; L113-P227 HydrophobicContact CG-CB 4.29Å; K114-P227 HydrophobicContact CB-CB 4.27Å; K114-P227 HydrophobicContact CB-CG 3.86Å; K114-P227 HydrophobicContact CD-CG 4.47Å; K114-P227 HydrophobicContact CG-CG 4.05Å; V118-P227 HydrophobicContact CG2-CB 4.49Å; P227-S230 WeakPolarHBondContact O-CB 3.46Å; P227-S230 PolarHBondContact O-N 2.92Å; P227-A231 PolarHBondContact O-N 3.25Å
228	V	96.6	Very high	94.6	Very high	5 Å²	5	31.6 Å²	31.6	3%	0.03	16%	0.157	C	C	.	.	H	α-helix	trans	-68.5	-33.8	178.5	71.1	0	0	0	0	113.1	G85 C103 L113 Y193 F226 A232	G85-V228 VanDerWaalsContact N-CG2 3.29Å; C103-V228 HydrophobicContact CB-CG2 4.32Å; C103-V228 WeakPolarHBondContact O-CG2 3.43Å; L113-V228 HydrophobicContact CD2-CB 3.9Å; L113-V228 HydrophobicContact CD2-CG2 4.27Å; Y193-V228 HydrophobicContact CD2-CG1 3.81Å; F226-V228 HydrophobicContact CB-CG1 4.44Å; F226-V228 PolarHBondContact O-N 3.49Å; F226-V228 VanDerWaalsContact O-N 3.11Å; V228-A232 PolarHBondContact O-N 3.46Å
229	V	96.8	Very high	94.5	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-71.4	-40	172.5	-178.1	0	0	0	0	109.7	D87 Y193 D195 A222 D223 F226 A231 A232 S233	D87-V229 HydrophobicContact CB-CG1 4.12Å; Y193-V229 VanDerWaalsContact CB-CG2 3.43Å; Y193-V229 WeakPolarHBondContact O-CG2 3.36Å; D195-V229 HydrophobicContact CB-CG1 4.06Å; A222-V229 HydrophobicContact CB-CB 4.42Å; A222-V229 HydrophobicContact CB-CG1 3.97Å; A222-V229 HydrophobicContact CB-CG2 4.2Å; D223-V229 HydrophobicContact CB-CG1 4.17Å; F226-V229 HydrophobicContact CB-CB 4.24Å; F226-V229 HydrophobicContact CB-CG2 3.82Å; F226-V229 HydrophobicContact CD2-CG2 4.34Å; F226-V229 HydrophobicContact CG-CG2 4.49Å; F226-V229 PolarHBondContact O-N 2.93Å; V229-A231 VanDerWaalsContact C-N 3.33Å; V229-A231 PolarHBondContact O-N 2.88Å; V229-A232 WeakPolarHBondContact O-CB 3.33Å; V229-A232 PolarHBondContact O-N 3.1Å; V229-S233 WeakPolarHBondContact O-CB 3.28Å; V229-S233 PolarHBondContact O-N 2.77Å
230	S	95.1	Very high	94.5	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-60.4	-42.1	174.4	-146.3	0	0	0	0	112.5	V118 A119 D223 F226 P227 S233 I234	V118-S230 PolarHBondContact O-OG 3.05Å; A119-S230 WeakPolarHBondContact CA-OG 3.42Å; D223-S230 VanDerWaalsContact O-CB 3.24Å; D223-S230 WeakPolarHBondContact O-CB 3.38Å; D223-S230 PolarHBondContact O-OG 3.28Å; F226-S230 PolarHBondContact O-N 3.37Å; F226-S230 VanDerWaalsContact O-N 3.08Å; P227-S230 WeakPolarHBondContact O-CB 3.46Å; P227-S230 PolarHBondContact O-N 2.92Å; S230-S233 WeakPolarHBondContact O-CA 3.41Å; S230-S233 WeakPolarHBondContact O-CB 3.31Å; S230-S233 PolarHBondContact O-N 3.09Å; S230-I234 WeakPolarHBondContact O-CG1 3.38Å; S230-I234 PolarHBondContact O-N 3.32Å
231	A	95.8	Very high	94.6	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-62.5	-43.8	174.5	0	0	0	0	0	112	C103 L113 V118 L136 P227 V229 S233 I234 C235	C103-A231 HydrophobicContact CB-CB 3.94Å; C103-A231 VanDerWaalsContact SG-CB 3.56Å; L113-A231 HydrophobicContact CD1-CB 4.39Å; V118-A231 HydrophobicContact CG2-CB 4.41Å; L136-A231 HydrophobicContact CD1-CB 3.98Å; L136-A231 HydrophobicContact CD2-CB 3.87Å; P227-A231 PolarHBondContact O-N 3.25Å; V229-A231 VanDerWaalsContact C-N 3.33Å; V229-A231 PolarHBondContact O-N 2.88Å; A231-S233 VanDerWaalsContact C-N 3.26Å; A231-S233 PolarHBondContact O-N 3.42Å; A231-I234 PolarHBondContact O-N 3.29Å; A231-C235 PolarHBondContact O-N 3.03Å; A231-C235 PolarHBondContact O-SG 2.74Å; A231-C235 VanDerWaalsContact O-SG 3.35Å
232	A	97	Very high	94.8	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-59	-39.6	173.5	0	0	0	0	0	111.9	G85 D87 C103 V228 V229 C235 A236	G85-A232 WeakPolarHBondContact O-CB 3.38Å; D87-A232 HydrophobicContact CB-CB 4.31Å; C103-A232 HydrophobicContact CB-CB 3.98Å; V228-A232 PolarHBondContact O-N 3.46Å; V229-A232 WeakPolarHBondContact O-CB 3.33Å; V229-A232 PolarHBondContact O-N 3.1Å; A232-C235 PolarHBondContact O-N 3.14Å; A232-A236 WeakPolarHBondContact O-CB 3.39Å; A232-A236 PolarHBondContact O-N 2.87Å
233	S	95.5	Very high	94.8	Very high	2 Å²	2	21 Å²	21	1%	0.014	11%	0.106	C	C	.	.	H	α-helix	trans	-57.3	-46.8	174.3	-152.8	0	0	0	0	112.7	D87 V229 S230 A231 A236 K237	D87-S233 WeakPolarHBondContact OD2-CA 3.29Å; D87-S233 WeakPolarHBondContact OD2-CB 3.44Å; D87-S233 PolarHBondContact OD2-OG 3.16Å; V229-S233 WeakPolarHBondContact O-CB 3.28Å; V229-S233 PolarHBondContact O-N 2.77Å; S230-S233 WeakPolarHBondContact O-CA 3.41Å; S230-S233 WeakPolarHBondContact O-CB 3.31Å; S230-S233 PolarHBondContact O-N 3.09Å; A231-S233 VanDerWaalsContact C-N 3.26Å; A231-S233 PolarHBondContact O-N 3.42Å; S233-A236 PolarHBondContact O-N 2.98Å; S233-K237 WeakPolarHBondContact O-CB 3.36Å; S233-K237 VanDerWaalsContact O-CG 3.29Å; S233-K237 WeakPolarHBondContact O-CG 3.27Å; S233-K237 PolarHBondContact O-N 2.92Å; S233-K237 PolarHBondContact OG-NZ 3.35Å
234	I	95.3	Very high	94.9	Very high	2 Å²	2	20.5 Å²	20.5	1%	0.01	10%	0.104	C	C	.	.	H	α-helix	trans	-62.1	-49.7	176.8	-66.5	-61.5	0	0	0	110.1	L124 R129 L132 F133 L136 S230 A231 A236 K237 V238	L124-I234 HydrophobicContact CD1-CD1 3.66Å; R129-I234 HydrophobicContact CG-CD1 4.1Å; L132-I234 HydrophobicContact CB-CD1 4.46Å; L132-I234 HydrophobicContact CB-CG1 4.45Å; L132-I234 HydrophobicContact CB-CG2 4.06Å; L132-I234 HydrophobicContact CD1-CD1 3.78Å; L132-I234 HydrophobicContact CD1-CG1 4.22Å; F133-I234 HydrophobicContact CB-CG2 4.01Å; L136-I234 HydrophobicContact CD1-CB 4.38Å; L136-I234 HydrophobicContact CD1-CG2 4.25Å; S230-I234 WeakPolarHBondContact O-CG1 3.38Å; S230-I234 PolarHBondContact O-N 3.32Å; A231-I234 PolarHBondContact O-N 3.29Å; I234-A236 VanDerWaalsContact C-N 3.33Å; I234-A236 PolarHBondContact O-N 3.38Å; I234-K237 PolarHBondContact O-N 2.97Å; I234-V238 HydrophobicContact CG2-CG2 4.25Å; I234-V238 WeakPolarHBondContact O-CB 2.94Å; I234-V238 WeakPolarHBondContact O-CG2 3.38Å; I234-V238 PolarHBondContact O-N 2.77Å
235	C	96.1	Very high	94.9	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-56.9	-46.3	178.4	-63.3	0	0	0	0	111.6	M54 L147 A231 A232 A239	M54-C235 HydrophobicContact CE-CB 4.46Å; L147-C235 HydrophobicContact CD2-CB 3.82Å; A231-C235 PolarHBondContact O-N 3.03Å; A231-C235 PolarHBondContact O-SG 2.74Å; A231-C235 VanDerWaalsContact O-SG 3.35Å; A232-C235 PolarHBondContact O-N 3.14Å; C235-A239 VanDerWaalsContact O-CB 3.28Å; C235-A239 WeakPolarHBondContact O-CB 3.48Å; C235-A239 PolarHBondContact O-N 3.42Å
236	A	96.5	Very high	94.7	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-64.7	-43	179.9	0	0	0	0	0	112.5	A89 V99 A232 S233 I234 R240	A89-A236 HydrophobicContact CB-CB 3.98Å; V99-A236 HydrophobicContact CG1-CB 4.37Å; A232-A236 WeakPolarHBondContact O-CB 3.39Å; A232-A236 PolarHBondContact O-N 2.87Å; S233-A236 PolarHBondContact O-N 2.98Å; I234-A236 VanDerWaalsContact C-N 3.33Å; I234-A236 PolarHBondContact O-N 3.38Å; A236-R240 WeakPolarHBondContact O-CB 3.33Å; A236-R240 PolarHBondContact O-N 3.4Å
237	K	95.3	Very high	94.5	Very high	67 Å²	67	21.1 Å²	21.1	29%	0.291	11%	0.107	S	C	.	.	H	α-helix	trans	-68	-46.3	180	-73	175.3	177.2	67	0	112	A89 S233 I234 A239 R240 D241	A89-K237 HydrophobicContact CB-CB 4.43Å; A89-K237 HydrophobicContact CB-CG 3.84Å; S233-K237 WeakPolarHBondContact O-CB 3.36Å; S233-K237 VanDerWaalsContact O-CG 3.29Å; S233-K237 WeakPolarHBondContact O-CG 3.27Å; S233-K237 PolarHBondContact O-N 2.92Å; S233-K237 PolarHBondContact OG-NZ 3.35Å; I234-K237 PolarHBondContact O-N 2.97Å; K237-A239 PolarHBondContact O-N 3.18Å; K237-R240 PolarHBondContact O-N 3.47Å; K237-D241 WeakPolarHBondContact O-CB 3.29Å; K237-D241 PolarHBondContact O-N 3.26Å
238	V	95.5	Very high	94.2	Very high	4 Å²	4	24.5 Å²	24.5	2%	0.024	12%	0.123	C	C	.	.	H	α-helix	trans	-59.8	-47.8	177.3	169.5	0	0	0	0	110.7	M54 R129 E130 F133 I234 R240 D241 R242	M54-V238 HydrophobicContact CE-CB 4.36Å; M54-V238 HydrophobicContact CE-CG1 4.14Å; M54-V238 HydrophobicContact SD-CG1 4.37Å; R129-V238 HydrophobicContact CB-CG2 3.74Å; E130-V238 WeakPolarHBondContact OE2-CG1 3.45Å; F133-V238 HydrophobicContact CB-CB 4.47Å; F133-V238 HydrophobicContact CB-CG1 4.38Å; F133-V238 HydrophobicContact CB-CG2 3.95Å; F133-V238 HydrophobicContact CD1-CG1 4.28Å; F133-V238 HydrophobicContact CG-CG1 4.26Å; I234-V238 HydrophobicContact CG2-CG2 4.25Å; I234-V238 WeakPolarHBondContact O-CB 2.94Å; I234-V238 WeakPolarHBondContact O-CG2 3.38Å; I234-V238 PolarHBondContact O-N 2.77Å; V238-R240 PolarHBondContact O-N 2.93Å; V238-D241 PolarHBondContact O-N 3.33Å; V238-R242 HydrophobicContact CG1-CG 4.44Å; V238-R242 WeakPolarHBondContact O-CG 3.45Å; V238-R242 PolarHBondContact O-N 3.37Å
239	A	96.1	Very high	93.9	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-61.1	-44.2	177.9	0	0	0	0	0	112.2	M54 V99 L147 C235 K237 D241 R242 V243	M54-A239 HydrophobicContact CE-CB 4.27Å; M54-A239 HydrophobicContact SD-CB 3.77Å; V99-A239 HydrophobicContact CG1-CB 4.11Å; L147-A239 HydrophobicContact CD1-CB 3.45Å; L147-A239 VanDerWaalsContact CD1-CB 3.45Å; C235-A239 VanDerWaalsContact O-CB 3.28Å; C235-A239 WeakPolarHBondContact O-CB 3.48Å; C235-A239 PolarHBondContact O-N 3.42Å; K237-A239 PolarHBondContact O-N 3.18Å; A239-D241 PolarHBondContact O-N 2.67Å; A239-R242 PolarHBondContact O-N 2.93Å; A239-V243 WeakPolarHBondContact O-CB 3.43Å; A239-V243 WeakPolarHBondContact O-CG2 3.4Å; A239-V243 PolarHBondContact O-N 3.24Å
240	R	95.7	Very high	93.4	Very high	30 Å²	30	28.4 Å²	28.4	11%	0.113	15%	0.151	C	C	.	.	H	α-helix	trans	-59.1	-48.9	175.7	-178.9	-179.1	176.5	-85.1	-4.6	111.4	A89 G90 V99 A236 K237 V238 R242 V243 V244	A89-R240 HydrophobicContact CB-CB 4.16Å; G90-R240 VanDerWaalsContact CA-CD 3.48Å; V99-R240 HydrophobicContact CB-CB 4.38Å; V99-R240 HydrophobicContact CG2-CB 3.82Å; V99-R240 HydrophobicContact CG2-CG 4.44Å; A236-R240 WeakPolarHBondContact O-CB 3.33Å; A236-R240 PolarHBondContact O-N 3.4Å; K237-R240 PolarHBondContact O-N 3.47Å; V238-R240 PolarHBondContact O-N 2.93Å; R240-R242 VanDerWaalsContact C-N 3.34Å; R240-R242 PolarHBondContact O-N 3.49Å; R240-V243 PolarHBondContact O-N 3.43Å; R240-V244 HydrophobicContact CG-CG2 4.08Å; R240-V244 VanDerWaalsContact O-CB 3.26Å; R240-V244 WeakPolarHBondContact O-CB 3.33Å; R240-V244 WeakPolarHBondContact O-CG2 3.34Å; R240-V244 PolarHBondContact O-N 3.37Å
241	D	94	Very high	93.1	Very high	27 Å²	27	29 Å²	29	14%	0.144	15%	0.153	C	C	.	.	H	α-helix	trans	-61.3	-44	-177.4	-66.6	-19	0	0	0	110.7	E126 R129 K237 V238 A239 V244 K245	E126-D241 HydrophobicContact CG-CB 4.39Å; R129-D241 IonicContact CZ-OD2 2.56Å; R129-D241 VanDerWaalsContact CZ-OD2 3.3Å; R129-D241 IonicContact NE-OD2 2.7Å; R129-D241 PolarHBondContact NE-OD2 3.14Å; R129-D241 VanDerWaalsContact NE-OD2 3.09Å; R129-D241 IonicContact NH2-OD2 3.33Å; R129-D241 PolarHBondContact NH2-OD2 3.19Å; K237-D241 WeakPolarHBondContact O-CB 3.29Å; K237-D241 PolarHBondContact O-N 3.26Å; V238-D241 PolarHBondContact O-N 3.33Å; A239-D241 PolarHBondContact O-N 2.67Å; D241-V244 PolarHBondContact O-N 2.79Å; D241-K245 WeakPolarHBondContact O-CB 3.3Å; D241-K245 WeakPolarHBondContact O-CG 3.42Å; D241-K245 PolarHBondContact O-N 2.98Å
242	R	94.3	Very high	92.7	Very high	49 Å²	49	35.7 Å²	35.7	19%	0.185	19%	0.189	C	C	.	.	H	α-helix	trans	-61.5	-47.1	174.9	-69.1	-179.6	-171.9	-170.7	12.3	112.5	L56 E130 V238 A239 R240 V244 K245 G246	L56-R242 HydrophobicContact CD1-CB 3.62Å; E130-R242 IonicContact OE1-CZ 3.18Å; E130-R242 IonicContact OE1-NH2 2.81Å; E130-R242 PolarHBondContact OE1-NH2 3.23Å; E130-R242 IonicContact OE2-CZ 2.63Å; E130-R242 IonicContact OE2-NE 3.87Å; E130-R242 PolarHBondContact OE2-NE 3.47Å; E130-R242 IonicContact OE2-NH2 2.57Å; E130-R242 PolarHBondContact OE2-NH2 3.37Å; V238-R242 HydrophobicContact CG1-CG 4.44Å; V238-R242 WeakPolarHBondContact O-CG 3.45Å; V238-R242 PolarHBondContact O-N 3.37Å; A239-R242 PolarHBondContact O-N 2.93Å; R240-R242 VanDerWaalsContact C-N 3.34Å; R240-R242 PolarHBondContact O-N 3.49Å; R242-V244 VanDerWaalsContact C-N 3.34Å; R242-V244 PolarHBondContact O-N 3.17Å; R242-K245 PolarHBondContact O-N 3.38Å; R242-G246 PolarHBondContact O-N 3.44Å
243	V	93.9	Very high	92	Very high	4 Å²	4	38.1 Å²	38.1	2%	0.024	20%	0.202	C	C	.	.	H	α-helix	trans	-62.8	-41.6	179.3	171.7	0	0	0	0	111.9	L56 F59 P97 I149 A239 R240 G246 W247	L56-V243 HydrophobicContact CD1-CG2 3.85Å; L56-V243 HydrophobicContact CD2-CG2 4.11Å; F59-V243 HydrophobicContact CD1-CG1 3.9Å; F59-V243 HydrophobicContact CD1-CG2 4.21Å; F59-V243 HydrophobicContact CE1-CB 4.42Å; F59-V243 HydrophobicContact CE1-CG1 3.25Å; F59-V243 HydrophobicContact CE1-CG2 4.31Å; F59-V243 HydrophobicContact CZ-CG1 3.93Å; P97-V243 HydrophobicContact CG-CB 4.23Å; P97-V243 HydrophobicContact CG-CG1 3.65Å; I149-V243 HydrophobicContact CD1-CG2 3.81Å; I149-V243 HydrophobicContact CG2-CG2 4.43Å; A239-V243 WeakPolarHBondContact O-CB 3.43Å; A239-V243 WeakPolarHBondContact O-CG2 3.4Å; A239-V243 PolarHBondContact O-N 3.24Å; R240-V243 PolarHBondContact O-N 3.43Å; V243-G246 CarbonylContact O-C 3.47Å; V243-G246 PolarHBondContact O-N 2.84Å; V243-W247 HydrophobicContact CG1-CE3 3.82Å; V243-W247 HydrophobicContact CG1-CZ3 3.97Å; V243-W247 WeakPolarHBondContact O-CA 3.33Å; V243-W247 PolarHBondContact O-N 3.42Å
244	V	92.8	Very high	91.4	Very high	19 Å²	19	40.7 Å²	40.7	12%	0.115	23%	0.228	C	C	.	.	H	α-helix	trans	-68.4	-36.6	-179.1	167.1	0	0	0	0	111	P97 R240 D241 R242 Y260	P97-V244 HydrophobicContact CG-CG2 4.23Å; R240-V244 HydrophobicContact CG-CG2 4.08Å; R240-V244 VanDerWaalsContact O-CB 3.26Å; R240-V244 WeakPolarHBondContact O-CB 3.33Å; R240-V244 WeakPolarHBondContact O-CG2 3.34Å; R240-V244 PolarHBondContact O-N 3.37Å; D241-V244 PolarHBondContact O-N 2.79Å; R242-V244 VanDerWaalsContact C-N 3.34Å; R242-V244 PolarHBondContact O-N 3.17Å; V244-Y260 HydrophobicContact CG1-CE2 4.07Å; V244-Y260 WeakPolarHBondContact CG1-OH 3.26Å; V244-Y260 PolarHBondContact O-OH 2.77Å; V244-Y260 VanDerWaalsContact O-OH 3.09Å
245	K	89.3	Confident	90.6	Very high	142 Å²	142	49.9 Å²	49.9	62%	0.617	27%	0.271	S	S	*	.	H	α-helix	trans	-72.1	-39.6	173.8	-76.7	-177.7	171.9	-171.1	0	113.9	E126 D241 R242 W247	E126-K245 WeakPolarHBondContact OE1-CE 3.35Å; E126-K245 IonicContact OE1-NZ 3.46Å; E126-K245 PolarHBondContact OE1-NZ 2.95Å; E126-K245 WeakPolarHBondContact OE2-CE 3.44Å; E126-K245 IonicContact OE2-NZ 3.22Å; E126-K245 PolarHBondContact OE2-NZ 2.9Å; D241-K245 WeakPolarHBondContact O-CB 3.3Å; D241-K245 WeakPolarHBondContact O-CG 3.42Å; D241-K245 PolarHBondContact O-N 2.98Å; R242-K245 PolarHBondContact O-N 3.38Å; K245-W247 VanDerWaalsContact C-N 3.29Å
246	G	88.3	Confident	89.9	Confident	36 Å²	36	52.3 Å²	52.3	37%	0.371	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	12.9	178.9	0	0	0	0	0	113.9	R242 V243 N248	R242-G246 PolarHBondContact O-N 3.44Å; V243-G246 CarbonylContact O-C 3.47Å; V243-G246 PolarHBondContact O-N 2.84Å; G246-N248 PolarHBondContact O-N 2.91Å; G246-N248 VanDerWaalsContact O-N 3.17Å
247	W	90.3	Very high	89.2	Confident	25 Å²	25	55.4 Å²	55.4	10%	0.095	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-63.7	120.1	-172.1	-170.4	-88.6	0	0	0	111.4	F59 N63 P152 V243 K245 F249 F287	F59-W247 HydrophobicContact CE1-CE3 4.18Å; F59-W247 HydrophobicContact CE1-CH2 4.47Å; F59-W247 AromaticContact CE1-CZ3 3.71Å; F59-W247 HydrophobicContact CE1-CZ3 3.71Å; F59-W247 HydrophobicContact CZ-CH2 4.15Å; F59-W247 AromaticContact CZ-CZ3 3.66Å; F59-W247 HydrophobicContact CZ-CZ3 3.66Å; N63-W247 HydrophobicContact CB-CH2 3.88Å; N63-W247 HydrophobicContact CB-CZ2 4.26Å; N63-W247 HydrophobicContact CB-CZ3 4.19Å; N63-W247 VanDerWaalsContact ND2-CZ2 3.29Å; N63-W247 WeakPolarHBondContact ND2-CZ2 3.4Å; P152-W247 HydrophobicContact CG-CH2 3.89Å; P152-W247 HydrophobicContact CG-CZ2 4.2Å; V243-W247 HydrophobicContact CG1-CE3 3.82Å; V243-W247 HydrophobicContact CG1-CZ3 3.97Å; V243-W247 WeakPolarHBondContact O-CA 3.33Å; V243-W247 PolarHBondContact O-N 3.42Å; K245-W247 VanDerWaalsContact C-N 3.29Å; W247-F249 AromaticContact CD1-CD2 3.75Å; W247-F249 AromaticContact CD1-CE2 3.7Å; W247-F249 AromaticContact CD1-CG 3.99Å; W247-F249 AromaticContact CD1-CZ 3.9Å; W247-F287 HydrophobicContact CB-CE2 4.18Å; W247-F287 AromaticContact CD1-CD2 3.64Å; W247-F287 AromaticContact CD2-CD2 3.4Å; W247-F287 HydrophobicContact CD2-CD2 3.4Å; W247-F287 AromaticContact CD2-CE2 3.61Å; W247-F287 HydrophobicContact CD2-CE2 3.61Å; W247-F287 HydrophobicContact CD2-CG 4.47Å; W247-F287 AromaticContact CE2-CD2 3.33Å; W247-F287 AromaticContact CE3-CD2 3.99Å; W247-F287 HydrophobicContact CE3-CD2 3.99Å; W247-F287 AromaticContact CE3-CE2 3.95Å; W247-F287 HydrophobicContact CE3-CE2 3.95Å; W247-F287 AromaticContact CG-CD2 3.63Å; W247-F287 HydrophobicContact CG-CD2 3.63Å; W247-F287 AromaticContact CG-CE2 3.68Å; W247-F287 HydrophobicContact CG-CE2 3.68Å; W247-F287 HydrophobicContact CG-CG 4.46Å; W247-F287 HydrophobicContact CH2-CD2 4.45Å; W247-F287 AromaticContact CZ2-CD2 3.9Å; W247-F287 HydrophobicContact CZ2-CD2 3.9Å; W247-F287 HydrophobicContact CZ3-CD2 4.46Å; W247-F287 AromaticContact NE1-CD2 3.47Å; W247-F287 AromaticContact NE1-CG 3.87Å
248	N	87.6	Confident	88.5	Confident	102 Å²	102	55.8 Å²	55.8	55%	0.545	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-94.8	122.7	172.8	-169.7	21.5	0	0	0	109.8	N63 G246	N63-N248 PolarHBondContact ND2-O 3.45Å; G246-N248 PolarHBondContact O-N 2.91Å; G246-N248 VanDerWaalsContact O-N 3.17Å
249	F	89.9	Confident	88.2	Confident	28 Å²	28	59.7 Å²	59.7	12%	0.123	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-80.1	127.9	176.7	-70.1	-97.8	0	0	0	109.3	W247 L253 I256 W273 P285 F287	W247-F249 AromaticContact CD1-CD2 3.75Å; W247-F249 AromaticContact CD1-CE2 3.7Å; W247-F249 AromaticContact CD1-CG 3.99Å; W247-F249 AromaticContact CD1-CZ 3.9Å; F249-L253 HydrophobicContact CB-CD1 4.41Å; F249-L253 HydrophobicContact CD1-CD1 3.76Å; F249-L253 HydrophobicContact CE1-CD1 4.3Å; F249-L253 HydrophobicContact CG-CD1 4.23Å; F249-I256 HydrophobicContact CB-CD1 3.61Å; F249-I256 HydrophobicContact CD1-CD1 4.21Å; F249-I256 HydrophobicContact CD2-CD1 3.38Å; F249-I256 HydrophobicContact CD2-CG2 4.27Å; F249-I256 HydrophobicContact CE2-CD1 4.06Å; F249-I256 HydrophobicContact CE2-CG2 3.84Å; F249-I256 HydrophobicContact CG-CD1 3.47Å; F249-I256 VanDerWaalsContact CG-CD1 3.47Å; F249-I256 HydrophobicContact CZ-CG2 4.12Å; F249-W273 HydrophobicContact CE1-CH2 4.07Å; F249-W273 HydrophobicContact CE1-CZ2 4.12Å; F249-W273 HydrophobicContact CZ-CH2 4.44Å; F249-W273 HydrophobicContact CZ-CZ2 4.1Å; F249-P285 HydrophobicContact CD1-CB 4.14Å; F249-P285 HydrophobicContact CD1-CG 4.47Å; F249-P285 HydrophobicContact CE1-CB 4.49Å; F249-P285 HydrophobicContact CE1-CG 4.38Å; F249-F287 HydrophobicContact CD1-CB 4.13Å; F249-F287 HydrophobicContact CE1-CB 3.48Å; F249-F287 VanDerWaalsContact CE1-CB 3.48Å; F249-F287 AromaticContact CE1-CD1 3.93Å; F249-F287 HydrophobicContact CE1-CD1 3.93Å; F249-F287 AromaticContact CE1-CG 3.87Å; F249-F287 HydrophobicContact CE1-CG 3.87Å; F249-F287 HydrophobicContact CZ-CB 4.17Å; F249-F287 AromaticContact CZ-CD1 3.84Å; F249-F287 HydrophobicContact CZ-CD1 3.84Å; F249-F287 HydrophobicContact CZ-CE1 4.41Å; F249-F287 HydrophobicContact CZ-CG 4.05Å
250	A	86.9	Confident	87.9	Confident	59 Å²	59	61 Å²	61	49%	0.488	34%	0.342	S	S	.	.	S	Bend	trans	-72.5	-25	176.8	0	0	0	0	0	111.4
251	E	89.4	Confident	87.8	Confident	13 Å²	13	60.8 Å²	60.8	6%	0.061	35%	0.349	C	S	.	.	S	Bend	trans	-82.9	140.3	178.5	-56.3	81.5	-179.5	0	0	111.8	Y25 L253 P285 Q286	Y25-E251 HydrophobicContact CE1-CB 4.21Å; Y25-E251 HydrophobicContact CE1-CG 3.72Å; Y25-E251 WeakPolarHBondContact OH-CG 2.95Å; E251-L253 HydrophobicContact CB-CD1 4.47Å; E251-L253 HydrophobicContact CB-CD2 3.77Å; E251-L253 HydrophobicContact CB-CG 3.85Å; E251-L253 PolarHBondContact O-N 3.44Å; E251-P285 HydrophobicContact CG-CB 4.14Å; E251-P285 WeakPolarHBondContact OE1-CA 3.49Å; E251-P285 WeakPolarHBondContact OE2-CB 3.37Å; E251-Q286 WeakPolarHBondContact OE1-CB 2.86Å; E251-Q286 VanDerWaalsContact OE1-CG 3.3Å; E251-Q286 WeakPolarHBondContact OE1-CG 3.42Å; E251-Q286 PolarHBondContact OE1-N 3.06Å
252	D	86.2	Confident	87.7	Confident	140 Å²	140	62.2 Å²	62.2	75%	0.749	36%	0.361	S	S	*	.			trans	-77.9	90.2	169	-176	8.8	0	0	0	109.5	G254	D252-G254 PolarHBondContact OD1-N 3.5Å
253	L	83.2	Confident	87.8	Confident	52 Å²	52	60 Å²	60	27%	0.272	35%	0.353	S	S	.	.			trans	-97.6	7.6	-179.4	-56.3	177.2	0	0	0	112.6	F249 E251 I256 Y277 P285	F249-L253 HydrophobicContact CB-CD1 4.41Å; F249-L253 HydrophobicContact CD1-CD1 3.76Å; F249-L253 HydrophobicContact CE1-CD1 4.3Å; F249-L253 HydrophobicContact CG-CD1 4.23Å; E251-L253 HydrophobicContact CB-CD1 4.47Å; E251-L253 HydrophobicContact CB-CD2 3.77Å; E251-L253 HydrophobicContact CB-CG 3.85Å; E251-L253 PolarHBondContact O-N 3.44Å; L253-I256 HydrophobicContact CB-CD1 3.82Å; L253-I256 HydrophobicContact CB-CG1 3.55Å; L253-I256 HydrophobicContact CD1-CD1 3.8Å; L253-I256 HydrophobicContact CD1-CG1 4.05Å; L253-I256 HydrophobicContact CG-CD1 4.2Å; L253-I256 HydrophobicContact CG-CG1 4.37Å; L253-Y277 HydrophobicContact CB-CE1 4.45Å; L253-Y277 HydrophobicContact CD1-CD1 4.32Å; L253-P285 HydrophobicContact CD1-CB 3.86Å; L253-P285 HydrophobicContact CD1-CG 3.95Å
254	G	82.9	Confident	87.9	Confident	55 Å²	55	65 Å²	65	57%	0.567	37%	0.372	S	S	*	.	S	Bend	trans	65.9	-138.1	-172.3	0	0	0	0	0	112.9	D252 I256	D252-G254 PolarHBondContact OD1-N 3.5Å; G254-I256 PolarHBondContact O-N 3.3Å; G254-I256 VanDerWaalsContact O-N 3.08Å
255	E	78.6	Confident	88	Confident	196 Å²	196	65.1 Å²	65.1	92%	0.916	37%	0.373	S	S	*	.	S	Bend	trans	-73	100.7	174.1	-68.8	-162.3	158.9	0	0	110.5
256	I	80.8	Confident	88.2	Confident	51 Å²	51	65.1 Å²	65.1	26%	0.262	38%	0.38	S	S	.	.			trans	-78.1	130	177.8	-62	169.3	0	0	0	109.8	F249 L253 G254 A258	F249-I256 HydrophobicContact CB-CD1 3.61Å; F249-I256 HydrophobicContact CD1-CD1 4.21Å; F249-I256 HydrophobicContact CD2-CD1 3.38Å; F249-I256 HydrophobicContact CD2-CG2 4.27Å; F249-I256 HydrophobicContact CE2-CD1 4.06Å; F249-I256 HydrophobicContact CE2-CG2 3.84Å; F249-I256 HydrophobicContact CG-CD1 3.47Å; F249-I256 VanDerWaalsContact CG-CD1 3.47Å; F249-I256 HydrophobicContact CZ-CG2 4.12Å; L253-I256 HydrophobicContact CB-CD1 3.82Å; L253-I256 HydrophobicContact CB-CG1 3.55Å; L253-I256 HydrophobicContact CD1-CD1 3.8Å; L253-I256 HydrophobicContact CD1-CG1 4.05Å; L253-I256 HydrophobicContact CG-CD1 4.2Å; L253-I256 HydrophobicContact CG-CG1 4.37Å; G254-I256 PolarHBondContact O-N 3.3Å; G254-I256 VanDerWaalsContact O-N 3.08Å; I256-A258 PolarHBondContact O-N 2.89Å
257	D	82.4	Confident	88.6	Confident	65 Å²	65	65.1 Å²	65.1	35%	0.348	37%	0.372	S	S	.	.			trans	-76.4	99.9	165.9	-171	-8.7	0	0	0	108.5	D259 W273 K276 Y277	D257-D259 PolarHBondContact O-N 3.46Å; D257-D259 VanDerWaalsContact OD1-CB 3.32Å; D257-D259 WeakPolarHBondContact OD1-CB 3.32Å; D257-D259 PolarHBondContact OD1-N 3.01Å; D257-W273 PolarHBondContact O-NE1 3.35Å; D257-K276 VanDerWaalsContact CB-NZ 3.31Å; D257-K276 IonicContact OD2-NZ 3.6Å; D257-K276 PolarHBondContact OD2-NZ 3.19Å; D257-Y277 HydrophobicContact CB-CE2 4.28Å; D257-Y277 WeakPolarHBondContact CB-OH 3.18Å; D257-Y277 PolarHBondContact N-OH 3.27Å
258	A	80.7	Confident	88.9	Confident	75 Å²	75	68.2 Å²	68.2	62%	0.62	40%	0.395	S	S	*	.			trans	-70.4	-3.5	177.9	0	0	0	0	0	112.7	I256 Y260	I256-A258 PolarHBondContact O-N 2.89Å; A258-Y260 VanDerWaalsContact O-CD1 3.32Å; A258-Y260 WeakPolarHBondContact O-CD1 3.39Å; A258-Y260 VanDerWaalsContact O-CE1 3.22Å; A258-Y260 WeakPolarHBondContact O-CE1 3.17Å; A258-Y260 PolarHBondContact O-N 2.97Å
259	D	88.3	Confident	89.3	Confident	85 Å²	85	67 Å²	67	46%	0.455	39%	0.385	S	S	.	.			trans	-97.5	68.2	-178.8	-163.7	-7.2	0	0	0	111.2	D257 G261 K269	D257-D259 PolarHBondContact O-N 3.46Å; D257-D259 VanDerWaalsContact OD1-CB 3.32Å; D257-D259 WeakPolarHBondContact OD1-CB 3.32Å; D257-D259 PolarHBondContact OD1-N 3.01Å; D259-G261 PolarHBondContact O-N 3.21Å; D259-K269 WeakPolarHBondContact O-CE 3.27Å; D259-K269 WeakPolarHBondContact OD1-CE 3.39Å; D259-K269 IonicContact OD1-NZ 2.59Å; D259-K269 PolarHBondContact OD1-NZ 3.24Å; D259-K269 WeakPolarHBondContact OD2-CE 3.35Å; D259-K269 IonicContact OD2-NZ 2.9Å; D259-K269 PolarHBondContact OD2-NZ 3.49Å
260	Y	90.8	Very high	89.7	Confident	29 Å²	29	65.7 Å²	65.7	11%	0.114	38%	0.379	C	S	.	.			trans	-82	11.9	178.6	45	-101.8	0	0	0	114.1	L95 V244 A258 T270 F287	L95-Y260 HydrophobicContact CD1-CD2 3.95Å; L95-Y260 HydrophobicContact CD1-CG 3.87Å; V244-Y260 HydrophobicContact CG1-CE2 4.07Å; V244-Y260 WeakPolarHBondContact CG1-OH 3.26Å; V244-Y260 PolarHBondContact O-OH 2.77Å; V244-Y260 VanDerWaalsContact O-OH 3.09Å; A258-Y260 VanDerWaalsContact O-CD1 3.32Å; A258-Y260 WeakPolarHBondContact O-CD1 3.39Å; A258-Y260 VanDerWaalsContact O-CE1 3.22Å; A258-Y260 WeakPolarHBondContact O-CE1 3.17Å; A258-Y260 PolarHBondContact O-N 2.97Å; Y260-T270 VanDerWaalsContact O-CA 3.26Å; Y260-T270 WeakPolarHBondContact O-CA 3.25Å; Y260-T270 PolarHBondContact O-N 3.29Å; Y260-T270 PolarHBondContact O-OG1 3.44Å; Y260-F287 AromaticContact CD1-CE1 3.82Å; Y260-F287 HydrophobicContact CD1-CE1 3.82Å; Y260-F287 HydrophobicContact CD1-CZ 4.49Å; Y260-F287 HydrophobicContact CD2-CE1 4.33Å; Y260-F287 AromaticContact CE1-CE1 3.72Å; Y260-F287 HydrophobicContact CE1-CE1 3.72Å; Y260-F287 AromaticContact CE1-CZ 3.95Å; Y260-F287 HydrophobicContact CE1-CZ 3.95Å; Y260-F287 HydrophobicContact CE2-CE1 4.25Å; Y260-F287 HydrophobicContact CE2-CZ 4.24Å; Y260-F287 HydrophobicContact CG-CE1 4.14Å; Y260-F287 AromaticContact CZ-CE1 3.97Å; Y260-F287 AromaticContact CZ-CZ 3.84Å
261	G	92.7	Very high	90.1	Very high	25 Å²	25	67.2 Å²	67.2	26%	0.258	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.1	-148	-173.3	0	0	0	0	0	113.1	D259 G263	D259-G261 PolarHBondContact O-N 3.21Å; G261-G263 VanDerWaalsContact C-N 3.27Å; G261-G263 PolarHBondContact O-N 3.35Å
262	S	92.7	Very high	90.4	Very high	57 Å²	57	72.7 Å²	72.7	40%	0.399	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-17.7	-177.5	66.3	0	0	0	0	114.1	Y264 D267	S262-Y264 PolarHBondContact O-N 2.81Å; S262-Y264 PolarHBondContact OG-N 2.81Å; S262-D267 VanDerWaalsContact CB-OD2 3.25Å; S262-D267 WeakPolarHBondContact CB-OD2 3.49Å; S262-D267 PolarHBondContact N-OD2 3.27Å; S262-D267 WeakPolarHBondContact OG-CB 3.29Å; S262-D267 PolarHBondContact OG-OD2 2.9Å
263	G	95.5	Very high	90.9	Very high	1 Å²	1	66.4 Å²	66.4	1%	0.01	37%	0.366	C	S	.	.			trans	78.3	2.1	-172.8	0	0	0	0	0	114	P93 V94 L95 G261 T270	P93-G263 CarbonylContact C-O 3.57Å; P93-G263 VanDerWaalsContact CA-O 3.25Å; P93-G263 WeakPolarHBondContact CA-O 3.37Å; P93-G263 WeakPolarHBondContact CB-O 3.42Å; V94-G263 WeakPolarHBondContact CG1-O 3.4Å; V94-G263 PolarHBondContact N-O 3.36Å; L95-G263 PolarHBondContact N-O 2.95Å; G261-G263 VanDerWaalsContact C-N 3.27Å; G261-G263 PolarHBondContact O-N 3.35Å; G263-T270 WeakPolarHBondContact CA-OG1 3.47Å; G263-T270 PolarHBondContact N-OG1 2.84Å
264	Y	96.5	Very high	91.5	Very high	110 Å²	110	63.9 Å²	63.9	43%	0.431	35%	0.353	S	S	.	.			trans	-84.9	145.7	177.6	-77.6	-94.6	0	0	0	112.3	P93 S262 N266 D267	P93-Y264 HydrophobicContact CG-CD1 4.3Å; P93-Y264 HydrophobicContact CG-CD2 4.11Å; P93-Y264 HydrophobicContact CG-CE1 3.93Å; P93-Y264 HydrophobicContact CG-CE2 3.72Å; P93-Y264 HydrophobicContact CG-CG 4.39Å; S262-Y264 PolarHBondContact O-N 2.81Å; S262-Y264 PolarHBondContact OG-N 2.81Å; Y264-N266 PolarHBondContact O-N 2.69Å; Y264-D267 WeakPolarHBondContact O-CB 3.45Å; Y264-D267 PolarHBondContact O-N 3.09Å; Y264-D267 VanDerWaalsContact O-N 3.08Å
265	P	95	Very high	92.1	Very high	22 Å²	22	64.8 Å²	64.8	14%	0.143	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-26.3	-178.6	-28.6	35.1	0	0	0	116	V94 K271	V94-P265 HydrophobicContact CB-CG 4.19Å; V94-P265 HydrophobicContact CG1-CG 4.31Å; P265-K271 WeakPolarHBondContact O-CE 3.47Å
266	N	94.4	Very high	92.8	Very high	142 Å²	142	61.3 Å²	61.3	76%	0.759	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-9.5	-176.3	-68.9	-26.6	0	0	0	113.6	Y264 P268	Y264-N266 PolarHBondContact O-N 2.69Å; N266-P268 WeakPolarHBondContact O-CD 3.43Å
267	D	96.6	Very high	93.5	Very high	36 Å²	36	60.2 Å²	60.2	19%	0.193	32%	0.319	C	S	.	.			trans	-75.5	122.2	179.6	-178.5	-9.1	0	0	0	110.6	S262 Y264 K269 T270 K271	S262-D267 VanDerWaalsContact CB-OD2 3.25Å; S262-D267 WeakPolarHBondContact CB-OD2 3.49Å; S262-D267 PolarHBondContact N-OD2 3.27Å; S262-D267 WeakPolarHBondContact OG-CB 3.29Å; S262-D267 PolarHBondContact OG-OD2 2.9Å; Y264-D267 WeakPolarHBondContact O-CB 3.45Å; Y264-D267 PolarHBondContact O-N 3.09Å; Y264-D267 VanDerWaalsContact O-N 3.08Å; D267-K269 PolarHBondContact O-N 3.43Å; D267-K269 WeakPolarHBondContact OD1-CB 3.45Å; D267-K269 PolarHBondContact OD1-N 2.96Å; D267-T270 PolarHBondContact O-N 3Å; D267-T270 PolarHBondContact OD2-OG1 3.1Å; D267-K271 PolarHBondContact O-N 3.13Å; D267-K271 VanDerWaalsContact O-N 3.07Å
268	P	96.1	Very high	94.1	Very high	89 Å²	89	58.4 Å²	58.4	58%	0.578	31%	0.309	S	S	*	.	H	α-helix	trans	-52.9	-41.1	176.8	-26.4	35.3	0	0	0	113.2	N266 T270 K271 E272	N266-P268 WeakPolarHBondContact O-CD 3.43Å; P268-T270 PolarHBondContact O-N 3.4Å; P268-K271 WeakPolarHBondContact O-CB 3.38Å; P268-K271 PolarHBondContact O-N 3.29Å; P268-E272 WeakPolarHBondContact O-CG 3.41Å; P268-E272 PolarHBondContact O-N 3.09Å
269	K	96.4	Very high	94.8	Very high	78 Å²	78	58.1 Å²	58.1	34%	0.339	30%	0.297	S	S	.	.	H	α-helix	trans	-69.1	-38.2	-177.3	-167.9	170.8	-164.8	174.2	0	112.1	D259 D267 K271 E272 W273	D259-K269 WeakPolarHBondContact O-CE 3.27Å; D259-K269 WeakPolarHBondContact OD1-CE 3.39Å; D259-K269 IonicContact OD1-NZ 2.59Å; D259-K269 PolarHBondContact OD1-NZ 3.24Å; D259-K269 WeakPolarHBondContact OD2-CE 3.35Å; D259-K269 IonicContact OD2-NZ 2.9Å; D259-K269 PolarHBondContact OD2-NZ 3.49Å; D267-K269 PolarHBondContact O-N 3.43Å; D267-K269 WeakPolarHBondContact OD1-CB 3.45Å; D267-K269 PolarHBondContact OD1-N 2.96Å; K269-K271 VanDerWaalsContact C-N 3.34Å; K269-E272 PolarHBondContact O-N 3.09Å; K269-W273 WeakPolarHBondContact O-CB 3.42Å; K269-W273 PolarHBondContact O-N 3.33Å
270	T	96.9	Very high	95.2	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-64.2	-39.6	173.1	-61.1	0	0	0	0	111.6	V94 L95 Y260 G263 D267 P268 W273 L274	V94-T270 HydrophobicContact CG1-CG2 3.76Å; L95-T270 HydrophobicContact CD1-CG2 3.83Å; L95-T270 HydrophobicContact CG-CG2 4.02Å; Y260-T270 VanDerWaalsContact O-CA 3.26Å; Y260-T270 WeakPolarHBondContact O-CA 3.25Å; Y260-T270 PolarHBondContact O-N 3.29Å; Y260-T270 PolarHBondContact O-OG1 3.44Å; G263-T270 WeakPolarHBondContact CA-OG1 3.47Å; G263-T270 PolarHBondContact N-OG1 2.84Å; D267-T270 PolarHBondContact O-N 3Å; D267-T270 PolarHBondContact OD2-OG1 3.1Å; P268-T270 PolarHBondContact O-N 3.4Å; T270-W273 PolarHBondContact O-N 3.02Å; T270-L274 HydrophobicContact CG2-CD1 4.48Å; T270-L274 WeakPolarHBondContact O-CG 3.39Å; T270-L274 PolarHBondContact O-N 2.72Å
271	K	95.8	Very high	95.4	Very high	91 Å²	91	60.8 Å²	60.8	40%	0.396	32%	0.321	S	S	.	.	H	α-helix	trans	-65.3	-42.7	175.3	-67.8	176.7	-174.3	176.6	0	112.1	P265 D267 P268 K269 W273 L274 L275	P265-K271 WeakPolarHBondContact O-CE 3.47Å; D267-K271 PolarHBondContact O-N 3.13Å; D267-K271 VanDerWaalsContact O-N 3.07Å; P268-K271 WeakPolarHBondContact O-CB 3.38Å; P268-K271 PolarHBondContact O-N 3.29Å; K269-K271 VanDerWaalsContact C-N 3.34Å; K271-W273 VanDerWaalsContact C-N 3.33Å; K271-L274 PolarHBondContact O-N 2.99Å; K271-L275 WeakPolarHBondContact O-CG 3.49Å; K271-L275 PolarHBondContact O-N 3Å
272	E	95.8	Very high	95.5	Very high	128 Å²	128	63.8 Å²	63.8	60%	0.598	33%	0.327	S	S	*	.	H	α-helix	trans	-60.9	-43.8	175.1	-74.1	171.8	-171.6	0	0	111.3	P268 K269 L275 K276	P268-E272 WeakPolarHBondContact O-CG 3.41Å; P268-E272 PolarHBondContact O-N 3.09Å; K269-E272 PolarHBondContact O-N 3.09Å; E272-L275 PolarHBondContact O-N 2.95Å; E272-K276 WeakPolarHBondContact O-CB 3.47Å; E272-K276 PolarHBondContact O-N 2.91Å
273	W	96.3	Very high	95.6	Very high	7 Å²	7	61.3 Å²	61.3	3%	0.027	31%	0.31	C	S	.	.	H	α-helix	trans	-61	-46.4	175.9	-167.2	97.1	0	0	0	111.8	L95 F249 D257 K269 T270 K271 L275 K276 Y277 P285 F287 V288	L95-W273 HydrophobicContact CD1-CD2 4.46Å; L95-W273 HydrophobicContact CD1-CE3 4.06Å; L95-W273 HydrophobicContact CD1-CZ3 4.47Å; L95-W273 HydrophobicContact CD2-CE3 4.22Å; L95-W273 HydrophobicContact CD2-CZ3 4.05Å; F249-W273 HydrophobicContact CE1-CH2 4.07Å; F249-W273 HydrophobicContact CE1-CZ2 4.12Å; F249-W273 HydrophobicContact CZ-CH2 4.44Å; F249-W273 HydrophobicContact CZ-CZ2 4.1Å; D257-W273 PolarHBondContact O-NE1 3.35Å; K269-W273 WeakPolarHBondContact O-CB 3.42Å; K269-W273 PolarHBondContact O-N 3.33Å; T270-W273 PolarHBondContact O-N 3.02Å; K271-W273 VanDerWaalsContact C-N 3.33Å; W273-L275 VanDerWaalsContact C-N 3.32Å; W273-L275 PolarHBondContact O-N 2.84Å; W273-K276 PolarHBondContact O-N 3.31Å; W273-K276 VanDerWaalsContact O-N 3.16Å; W273-Y277 AromaticContact CD1-CD2 3.92Å; W273-Y277 AromaticContact CD1-CE2 3.69Å; W273-Y277 AromaticContact CD2-CD2 3.55Å; W273-Y277 HydrophobicContact CD2-CD2 3.55Å; W273-Y277 HydrophobicContact CD2-CE2 4.09Å; W273-Y277 HydrophobicContact CD2-CG 4.49Å; W273-Y277 AromaticContact CE2-CD2 3.3Å; W273-Y277 AromaticContact CE2-CE2 3.52Å; W273-Y277 HydrophobicContact CE3-CD2 4.07Å; W273-Y277 AromaticContact CG-CD2 3.95Å; W273-Y277 HydrophobicContact CG-CD2 3.95Å; W273-Y277 HydrophobicContact CG-CE2 4.19Å; W273-Y277 HydrophobicContact CH2-CD2 4.12Å; W273-Y277 HydrophobicContact CH2-CG 4.23Å; W273-Y277 AromaticContact CZ2-CD2 3.62Å; W273-Y277 HydrophobicContact CZ2-CD2 3.62Å; W273-Y277 AromaticContact CZ2-CE2 3.97Å; W273-Y277 HydrophobicContact CZ2-CE2 3.97Å; W273-Y277 HydrophobicContact CZ2-CG 4.07Å; W273-Y277 HydrophobicContact CZ3-CD2 4.32Å; W273-Y277 AromaticContact NE1-CD2 3.57Å; W273-Y277 AromaticContact NE1-CE2 3.27Å; W273-Y277 VanDerWaalsContact NE1-CE2 3.27Å; W273-Y277 WeakPolarHBondContact O-CD2 3.25Å; W273-Y277 PolarHBondContact O-N 3.22Å; W273-P285 HydrophobicContact CH2-CG 3.87Å; W273-P285 HydrophobicContact CZ3-CG 4.44Å; W273-F287 HydrophobicContact CH2-CD1 4.27Å; W273-V288 HydrophobicContact CZ3-CG2 3.83Å
274	L	96.6	Very high	95.7	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-57.8	-44.5	173.8	-73.2	170.2	0	0	0	111.2	V94 L95 T270 K271 K276 Y277 L278 Y284 V288 T294 L298	V94-L274 HydrophobicContact CG1-CD1 4.03Å; V94-L274 HydrophobicContact CG2-CD1 4.37Å; L95-L274 HydrophobicContact CD2-CD2 3.9Å; T270-L274 HydrophobicContact CG2-CD1 4.48Å; T270-L274 WeakPolarHBondContact O-CG 3.39Å; T270-L274 PolarHBondContact O-N 2.72Å; K271-L274 PolarHBondContact O-N 2.99Å; L274-K276 VanDerWaalsContact C-N 3.29Å; L274-K276 PolarHBondContact O-N 3.16Å; L274-Y277 PolarHBondContact O-N 3.31Å; L274-L278 PolarHBondContact O-N 3.36Å; L274-Y284 HydrophobicContact CB-CE1 4.22Å; L274-Y284 HydrophobicContact CD2-CD1 4.24Å; L274-Y284 HydrophobicContact CD2-CE1 3.91Å; L274-Y284 HydrophobicContact CD2-CE2 4.49Å; L274-Y284 VanDerWaalsContact O-CE1 3.23Å; L274-Y284 WeakPolarHBondContact O-CE1 3.23Å; L274-V288 HydrophobicContact CD2-CB 4.48Å; L274-V288 HydrophobicContact CD2-CG1 3.71Å; L274-V288 HydrophobicContact CD2-CG2 3.87Å; L274-T294 HydrophobicContact CD1-CG2 4.28Å; L274-L298 HydrophobicContact CB-CD1 3.93Å; L274-L298 HydrophobicContact CD1-CD1 4.22Å
275	L	94.9	Very high	95.6	Very high	74 Å²	74	56.7 Å²	56.7	39%	0.387	29%	0.292	S	S	.	.	H	α-helix	trans	-64	-35.3	178.1	-73.9	175.5	0	0	0	113.2	K271 E272 W273 L298 K302	K271-L275 WeakPolarHBondContact O-CG 3.49Å; K271-L275 PolarHBondContact O-N 3Å; E272-L275 PolarHBondContact O-N 2.95Å; W273-L275 VanDerWaalsContact C-N 3.32Å; W273-L275 PolarHBondContact O-N 2.84Å; L275-L298 HydrophobicContact CD2-CD1 4.44Å; L275-L298 HydrophobicContact CD2-CD2 3.75Å; L275-K302 HydrophobicContact CD2-CD 3.69Å; L275-K302 VanDerWaalsContact CD2-NZ 3.29Å
276	K	94.7	Very high	95.6	Very high	123 Å²	123	58.2 Å²	58.2	54%	0.535	30%	0.298	S	S	.	.	H	α-helix	trans	-70.1	-38.6	-179.6	-177.5	-178	176.3	-169.3	0	112.7	D257 E272 W273 L274	D257-K276 VanDerWaalsContact CB-NZ 3.31Å; D257-K276 IonicContact OD2-NZ 3.6Å; D257-K276 PolarHBondContact OD2-NZ 3.19Å; E272-K276 WeakPolarHBondContact O-CB 3.47Å; E272-K276 PolarHBondContact O-N 2.91Å; W273-K276 PolarHBondContact O-N 3.31Å; W273-K276 VanDerWaalsContact O-N 3.16Å; L274-K276 VanDerWaalsContact C-N 3.29Å; L274-K276 PolarHBondContact O-N 3.16Å
277	Y	94.9	Very high	95.7	Very high	28 Å²	28	51.5 Å²	51.5	11%	0.11	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	20.5	-175.2	-68.2	-78.4	0	0	0	113.7	L253 D257 W273 L274 D279	L253-Y277 HydrophobicContact CB-CE1 4.45Å; L253-Y277 HydrophobicContact CD1-CD1 4.32Å; D257-Y277 HydrophobicContact CB-CE2 4.28Å; D257-Y277 WeakPolarHBondContact CB-OH 3.18Å; D257-Y277 PolarHBondContact N-OH 3.27Å; W273-Y277 AromaticContact CD1-CD2 3.92Å; W273-Y277 AromaticContact CD1-CE2 3.69Å; W273-Y277 AromaticContact CD2-CD2 3.55Å; W273-Y277 HydrophobicContact CD2-CD2 3.55Å; W273-Y277 HydrophobicContact CD2-CE2 4.09Å; W273-Y277 HydrophobicContact CD2-CG 4.49Å; W273-Y277 AromaticContact CE2-CD2 3.3Å; W273-Y277 AromaticContact CE2-CE2 3.52Å; W273-Y277 HydrophobicContact CE3-CD2 4.07Å; W273-Y277 AromaticContact CG-CD2 3.95Å; W273-Y277 HydrophobicContact CG-CD2 3.95Å; W273-Y277 HydrophobicContact CG-CE2 4.19Å; W273-Y277 HydrophobicContact CH2-CD2 4.12Å; W273-Y277 HydrophobicContact CH2-CG 4.23Å; W273-Y277 AromaticContact CZ2-CD2 3.62Å; W273-Y277 HydrophobicContact CZ2-CD2 3.62Å; W273-Y277 AromaticContact CZ2-CE2 3.97Å; W273-Y277 HydrophobicContact CZ2-CE2 3.97Å; W273-Y277 HydrophobicContact CZ2-CG 4.07Å; W273-Y277 HydrophobicContact CZ3-CD2 4.32Å; W273-Y277 AromaticContact NE1-CD2 3.57Å; W273-Y277 AromaticContact NE1-CE2 3.27Å; W273-Y277 VanDerWaalsContact NE1-CE2 3.27Å; W273-Y277 WeakPolarHBondContact O-CD2 3.25Å; W273-Y277 PolarHBondContact O-N 3.22Å; L274-Y277 PolarHBondContact O-N 3.31Å; Y277-D279 PolarHBondContact O-N 3.25Å
278	L	95.5	Very high	95.7	Very high	27 Å²	27	49.8 Å²	49.8	14%	0.141	25%	0.252	C	S	.	.			trans	-84	107.2	171	-179.7	63.8	0	0	0	110.1	L274 G283 Y284 M299 K302 A303	L274-L278 PolarHBondContact O-N 3.36Å; L278-G283 CarbonylContact C-O 3.56Å; L278-Y284 HydrophobicContact CB-CD1 4.45Å; L278-Y284 HydrophobicContact CB-CE1 3.72Å; L278-Y284 HydrophobicContact CD1-CD1 4.24Å; L278-Y284 HydrophobicContact CD1-CD2 4.48Å; L278-Y284 HydrophobicContact CD1-CE1 3.72Å; L278-Y284 HydrophobicContact CD1-CE2 4.04Å; L278-Y284 HydrophobicContact CG-CE1 4.28Å; L278-M299 HydrophobicContact CD1-CG 3.86Å; L278-K302 HydrophobicContact CD2-CB 3.52Å; L278-K302 HydrophobicContact CD2-CD 4.37Å; L278-A303 HydrophobicContact CD1-CB 4.41Å
279	D	95.5	Very high	95.8	Very high	68 Å²	68	45.6 Å²	45.6	36%	0.364	23%	0.225	S	C	.	.	B	Isolated β-bridge	trans	-77.2	135.5	167.5	-176.6	-91.4	0	0	0	110.7	Y277 V281 F282 G283	Y277-D279 PolarHBondContact O-N 3.25Å; D279-V281 VanDerWaalsContact C-N 3.27Å; D279-V281 PolarHBondContact O-N 3.41Å; D279-V281 WeakPolarHBondContact OD1-CA 3.08Å; D279-V281 PolarHBondContact OD1-N 3.26Å; D279-F282 HydrophobicContact CB-CB 4.33Å; D279-F282 WeakPolarHBondContact OD1-CD2 3.36Å; D279-F282 PolarHBondContact OD1-N 2.99Å; D279-G283 PolarHBondContact N-O 3.47Å; D279-G283 WeakPolarHBondContact O-CA 3.27Å; D279-G283 PolarHBondContact O-N 3.17Å
280	P	94.8	Very high	95.8	Very high	73 Å²	73	44.1 Å²	44.1	47%	0.474	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-27	-178.3	-24.8	34.4	0	0	0	115	V304	P280-V304 HydrophobicContact CB-CG2 4.45Å; P280-V304 WeakPolarHBondContact O-CB 3.25Å; P280-V304 WeakPolarHBondContact O-CG2 3.37Å; P280-V304 PolarHBondContact O-N 2.71Å
281	V	95.1	Very high	95.8	Very high	98 Å²	98	44.8 Å²	44.8	59%	0.594	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.3	-46.2	-175.2	178.3	0	0	0	0	111	D279	D279-V281 VanDerWaalsContact C-N 3.27Å; D279-V281 PolarHBondContact O-N 3.41Å; D279-V281 WeakPolarHBondContact OD1-CA 3.08Å; D279-V281 PolarHBondContact OD1-N 3.26Å
282	F	94.8	Very high	95.9	Very high	87 Å²	87	41.8 Å²	41.8	38%	0.382	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-12.9	-173.5	-63.2	-71.9	0	0	0	113.5	I24 Y25 D279 Y284	I24-F282 HydrophobicContact CG2-CE1 4.09Å; I24-F282 HydrophobicContact CG2-CZ 4.34Å; Y25-F282 HydrophobicContact CE2-CD1 4.27Å; D279-F282 HydrophobicContact CB-CB 4.33Å; D279-F282 WeakPolarHBondContact OD1-CD2 3.36Å; D279-F282 PolarHBondContact OD1-N 2.99Å; F282-Y284 PolarHBondContact O-N 3.18Å
283	G	96.1	Very high	95.9	Very high	5 Å²	5	39.6 Å²	39.6	5%	0.052	21%	0.208	C	C	.	.	B	Isolated β-bridge	trans	76.2	-109	-175	0	0	0	0	0	111	L278 D279	L278-G283 CarbonylContact C-O 3.56Å; D279-G283 PolarHBondContact N-O 3.47Å; D279-G283 WeakPolarHBondContact O-CA 3.27Å; D279-G283 PolarHBondContact O-N 3.17Å
284	Y	96.3	Very high	95.9	Very high	11 Å²	11	40.9 Å²	40.9	4%	0.043	22%	0.217	C	C	.	.	S	Bend	trans	-116.9	160.4	-170.6	-68	-60.8	0	0	0	113.8	L274 L278 F282 V288 F290 A295 L298 M299	L274-Y284 HydrophobicContact CB-CE1 4.22Å; L274-Y284 HydrophobicContact CD2-CD1 4.24Å; L274-Y284 HydrophobicContact CD2-CE1 3.91Å; L274-Y284 HydrophobicContact CD2-CE2 4.49Å; L274-Y284 VanDerWaalsContact O-CE1 3.23Å; L274-Y284 WeakPolarHBondContact O-CE1 3.23Å; L278-Y284 HydrophobicContact CB-CD1 4.45Å; L278-Y284 HydrophobicContact CB-CE1 3.72Å; L278-Y284 HydrophobicContact CD1-CD1 4.24Å; L278-Y284 HydrophobicContact CD1-CD2 4.48Å; L278-Y284 HydrophobicContact CD1-CE1 3.72Å; L278-Y284 HydrophobicContact CD1-CE2 4.04Å; L278-Y284 HydrophobicContact CG-CE1 4.28Å; F282-Y284 PolarHBondContact O-N 3.18Å; Y284-V288 HydrophobicContact CD1-CG2 4.05Å; Y284-V288 HydrophobicContact CD2-CB 4.3Å; Y284-V288 HydrophobicContact CD2-CG1 3.77Å; Y284-V288 HydrophobicContact CE2-CG1 4.37Å; Y284-V288 HydrophobicContact CG-CB 3.94Å; Y284-V288 HydrophobicContact CG-CG1 3.87Å; Y284-V288 HydrophobicContact CG-CG2 3.82Å; Y284-F290 HydrophobicContact CD2-CE1 4.43Å; Y284-F290 VanDerWaalsContact O-CZ 3.25Å; Y284-F290 WeakPolarHBondContact O-CZ 3.34Å; Y284-A295 HydrophobicContact CD2-CB 4.3Å; Y284-A295 HydrophobicContact CE2-CB 3.9Å; Y284-L298 VanDerWaalsContact OH-CB 3.24Å; Y284-L298 WeakPolarHBondContact OH-CB 3.33Å; Y284-M299 HydrophobicContact CD2-CG 4.07Å; Y284-M299 HydrophobicContact CD2-SD 3.9Å; Y284-M299 HydrophobicContact CE2-CG 3.63Å; Y284-M299 HydrophobicContact CE2-SD 4.05Å
285	P	95.1	Very high	95.9	Very high	4 Å²	4	40.9 Å²	40.9	3%	0.026	22%	0.217	C	C	.	.			trans	-64.5	156.4	162.5	28.9	-34.8	0	0	0	111.4	F249 E251 L253 W273 F287 V288	F249-P285 HydrophobicContact CD1-CB 4.14Å; F249-P285 HydrophobicContact CD1-CG 4.47Å; F249-P285 HydrophobicContact CE1-CB 4.49Å; F249-P285 HydrophobicContact CE1-CG 4.38Å; E251-P285 HydrophobicContact CG-CB 4.14Å; E251-P285 WeakPolarHBondContact OE1-CA 3.49Å; E251-P285 WeakPolarHBondContact OE2-CB 3.37Å; L253-P285 HydrophobicContact CD1-CB 3.86Å; L253-P285 HydrophobicContact CD1-CG 3.95Å; W273-P285 HydrophobicContact CH2-CG 3.87Å; W273-P285 HydrophobicContact CZ3-CG 4.44Å; P285-F287 PolarHBondContact O-N 2.68Å; P285-V288 HydrophobicContact CG-CG2 4.39Å; P285-V288 PolarHBondContact O-N 3.43Å
286	Q	95	Very high	95.9	Very high	54 Å²	54	40.6 Å²	40.6	25%	0.252	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-10.9	-177.9	-76.9	-176.4	17.6	0	0	114.7	P152 N153 E251 V288	P152-Q286 WeakPolarHBondContact CB-O 3.45Å; P152-Q286 WeakPolarHBondContact CG-O 3.45Å; N153-Q286 HydrophobicContact CB-CB 4.32Å; N153-Q286 HydrophobicContact CB-CG 4.34Å; E251-Q286 WeakPolarHBondContact OE1-CB 2.86Å; E251-Q286 VanDerWaalsContact OE1-CG 3.3Å; E251-Q286 WeakPolarHBondContact OE1-CG 3.42Å; E251-Q286 PolarHBondContact OE1-N 3.06Å; Q286-V288 PolarHBondContact O-N 3.04Å
287	F	95.9	Very high	95.9	Very high	1 Å²	1	39 Å²	39	0%	0.004	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-23.8	171.2	-169.2	-127.5	0	0	0	113.4	L95 G96 P152 W247 F249 Y260 W273 P285	L95-F287 HydrophobicContact CB-CD1 4.19Å; L95-F287 HydrophobicContact CB-CE1 3.82Å; L95-F287 HydrophobicContact CB-CZ 4.33Å; L95-F287 HydrophobicContact CD1-CE1 4.28Å; L95-F287 HydrophobicContact CD2-CD1 4.46Å; G96-F287 PolarHBondContact N-O 2.8Å; P152-F287 WeakPolarHBondContact CB-O 3.5Å; P152-F287 HydrophobicContact CG-CD2 4.42Å; P152-F287 VanDerWaalsContact CG-O 3.32Å; P152-F287 WeakPolarHBondContact CG-O 3.41Å; W247-F287 HydrophobicContact CB-CE2 4.18Å; W247-F287 AromaticContact CD1-CD2 3.64Å; W247-F287 AromaticContact CD2-CD2 3.4Å; W247-F287 HydrophobicContact CD2-CD2 3.4Å; W247-F287 AromaticContact CD2-CE2 3.61Å; W247-F287 HydrophobicContact CD2-CE2 3.61Å; W247-F287 HydrophobicContact CD2-CG 4.47Å; W247-F287 AromaticContact CE2-CD2 3.33Å; W247-F287 AromaticContact CE3-CD2 3.99Å; W247-F287 HydrophobicContact CE3-CD2 3.99Å; W247-F287 AromaticContact CE3-CE2 3.95Å; W247-F287 HydrophobicContact CE3-CE2 3.95Å; W247-F287 AromaticContact CG-CD2 3.63Å; W247-F287 HydrophobicContact CG-CD2 3.63Å; W247-F287 AromaticContact CG-CE2 3.68Å; W247-F287 HydrophobicContact CG-CE2 3.68Å; W247-F287 HydrophobicContact CG-CG 4.46Å; W247-F287 HydrophobicContact CH2-CD2 4.45Å; W247-F287 AromaticContact CZ2-CD2 3.9Å; W247-F287 HydrophobicContact CZ2-CD2 3.9Å; W247-F287 HydrophobicContact CZ3-CD2 4.46Å; W247-F287 AromaticContact NE1-CD2 3.47Å; W247-F287 AromaticContact NE1-CG 3.87Å; F249-F287 HydrophobicContact CD1-CB 4.13Å; F249-F287 HydrophobicContact CE1-CB 3.48Å; F249-F287 VanDerWaalsContact CE1-CB 3.48Å; F249-F287 AromaticContact CE1-CD1 3.93Å; F249-F287 HydrophobicContact CE1-CD1 3.93Å; F249-F287 AromaticContact CE1-CG 3.87Å; F249-F287 HydrophobicContact CE1-CG 3.87Å; F249-F287 HydrophobicContact CZ-CB 4.17Å; F249-F287 AromaticContact CZ-CD1 3.84Å; F249-F287 HydrophobicContact CZ-CD1 3.84Å; F249-F287 HydrophobicContact CZ-CE1 4.41Å; F249-F287 HydrophobicContact CZ-CG 4.05Å; Y260-F287 AromaticContact CD1-CE1 3.82Å; Y260-F287 HydrophobicContact CD1-CE1 3.82Å; Y260-F287 HydrophobicContact CD1-CZ 4.49Å; Y260-F287 HydrophobicContact CD2-CE1 4.33Å; Y260-F287 AromaticContact CE1-CE1 3.72Å; Y260-F287 HydrophobicContact CE1-CE1 3.72Å; Y260-F287 AromaticContact CE1-CZ 3.95Å; Y260-F287 HydrophobicContact CE1-CZ 3.95Å; Y260-F287 HydrophobicContact CE2-CE1 4.25Å; Y260-F287 HydrophobicContact CE2-CZ 4.24Å; Y260-F287 HydrophobicContact CG-CE1 4.14Å; Y260-F287 AromaticContact CZ-CE1 3.97Å; Y260-F287 AromaticContact CZ-CZ 3.84Å; W273-F287 HydrophobicContact CH2-CD1 4.27Å; P285-F287 PolarHBondContact O-N 2.68Å
288	V	97.4	Very high	95.9	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	-88.1	138.1	179.8	-174.7	0	0	0	0	110.5	V94 L95 W273 L274 Y284 P285 Q286 F290 A295	V94-V288 HydrophobicContact CG2-CG1 4.19Å; L95-V288 HydrophobicContact CD2-CB 4.25Å; L95-V288 HydrophobicContact CD2-CG1 4.31Å; L95-V288 HydrophobicContact CD2-CG2 3.65Å; W273-V288 HydrophobicContact CZ3-CG2 3.83Å; L274-V288 HydrophobicContact CD2-CB 4.48Å; L274-V288 HydrophobicContact CD2-CG1 3.71Å; L274-V288 HydrophobicContact CD2-CG2 3.87Å; Y284-V288 HydrophobicContact CD1-CG2 4.05Å; Y284-V288 HydrophobicContact CD2-CB 4.3Å; Y284-V288 HydrophobicContact CD2-CG1 3.77Å; Y284-V288 HydrophobicContact CE2-CG1 4.37Å; Y284-V288 HydrophobicContact CG-CB 3.94Å; Y284-V288 HydrophobicContact CG-CG1 3.87Å; Y284-V288 HydrophobicContact CG-CG2 3.82Å; P285-V288 HydrophobicContact CG-CG2 4.39Å; P285-V288 PolarHBondContact O-N 3.43Å; Q286-V288 PolarHBondContact O-N 3.04Å; V288-F290 WeakPolarHBondContact O-CD2 3.31Å; V288-F290 PolarHBondContact O-N 2.82Å; V288-A295 HydrophobicContact CG1-CB 4.08Å
289	R	98.1	Very high	95.9	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.217	C	C	.	.			trans	-85.4	98.3	172.5	-55.9	-179.9	-167.6	179.9	-0.4	110.4	G90 R91 P93 V94 G96 P97 P152 S156 S291 W292	G90-R289 VanDerWaalsContact O-CZ 3.3Å; G90-R289 PolarHBondContact O-NH1 2.57Å; G90-R289 PolarHBondContact O-NH2 2.91Å; R91-R289 PolarHBondContact O-NH1 3.39Å; R91-R289 VanDerWaalsContact O-NH1 3.14Å; P93-R289 WeakPolarHBondContact O-CD 3.5Å; P93-R289 PolarHBondContact O-NE 2.65Å; P93-R289 PolarHBondContact O-NH1 3.31Å; V94-R289 WeakPolarHBondContact O-CB 3.35Å; V94-R289 WeakPolarHBondContact O-CG 3.49Å; V94-R289 PolarHBondContact O-N 3.24Å; G96-R289 VanDerWaalsContact O-CZ 3.24Å; G96-R289 PolarHBondContact O-NE 3.49Å; G96-R289 PolarHBondContact O-NH2 3.05Å; P97-R289 PolarHBondContact O-NH2 3.48Å; P152-R289 HydrophobicContact CB-CG 3.66Å; S156-R289 WeakPolarHBondContact OG-CA 3.43Å; R289-S291 PolarHBondContact O-N 2.92Å; R289-S291 VanDerWaalsContact O-N 3.13Å; R289-W292 HydrophobicContact CB-CD2 3.86Å; R289-W292 HydrophobicContact CB-CE3 3.22Å; R289-W292 HydrophobicContact CB-CH2 4.46Å; R289-W292 HydrophobicContact CB-CZ3 3.6Å; R289-W292 HydrophobicContact CG-CE3 4.06Å; R289-W292 HydrophobicContact CG-CH2 4.47Å; R289-W292 HydrophobicContact CG-CZ3 4Å; R289-W292 WeakPolarHBondContact O-CB 3.27Å; R289-W292 PolarHBondContact O-N 3.09Å; R289-W292 VanDerWaalsContact O-N 3.09Å
290	F	97.4	Very high	95.7	Very high	48 Å²	48	42.5 Å²	42.5	21%	0.211	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-22.7	-179.8	-73.3	-109.5	0	0	0	113.1	S156 L160 Y284 V288 W292 Q296 M299	S156-F290 PolarHBondContact OG-N 3.11Å; L160-F290 HydrophobicContact CD1-CB 3.77Å; Y284-F290 HydrophobicContact CD2-CE1 4.43Å; Y284-F290 VanDerWaalsContact O-CZ 3.25Å; Y284-F290 WeakPolarHBondContact O-CZ 3.34Å; V288-F290 WeakPolarHBondContact O-CD2 3.31Å; V288-F290 PolarHBondContact O-N 2.82Å; F290-W292 PolarHBondContact O-N 2.74Å; F290-Q296 VanDerWaalsContact O-CG 3.29Å; F290-Q296 WeakPolarHBondContact O-CG 3.31Å; F290-Q296 PolarHBondContact O-NE2 3.02Å; F290-Q296 VanDerWaalsContact O-NE2 3.09Å; F290-M299 HydrophobicContact CD1-CE 3.74Å; F290-M299 HydrophobicContact CD1-SD 3.54Å; F290-M299 VanDerWaalsContact CD1-SD 3.54Å; F290-M299 HydrophobicContact CE1-CE 4.44Å; F290-M299 HydrophobicContact CE1-SD 3.64Å
291	S	96.5	Very high	95.7	Very high	14 Å²	14	42.8 Å²	42.8	10%	0.098	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-4.3	177.3	56.7	0	0	0	0	114.6	M159 R289 Q296	M159-S291 VanDerWaalsContact CB-CB 3.5Å; M159-S291 PolarHBondContact SD-OG 2.98Å; M159-S291 VanDerWaalsContact SD-OG 3.42Å; R289-S291 PolarHBondContact O-N 2.92Å; R289-S291 VanDerWaalsContact O-N 3.13Å; S291-Q296 VanDerWaalsContact C-NE2 3.25Å; S291-Q296 PolarHBondContact O-NE2 3.39Å
292	W	97.6	Very high	95.6	Very high	28 Å²	28	44.1 Å²	44.1	11%	0.106	24%	0.236	C	C	.	.	S	Bend	trans	-83.1	136.1	175.9	-92	-120.2	0	0	0	111	R91 G92 P93 V94 I155 M159 L167 R289 F290 T294 A295 Q296	R91-W292 WeakPolarHBondContact O-CZ2 3.42Å; G92-W292 PolarHBondContact O-NE1 3.27Å; P93-W292 VanDerWaalsContact O-CE2 3.29Å; P93-W292 WeakPolarHBondContact O-CZ2 3.34Å; P93-W292 PolarHBondContact O-NE1 3.18Å; V94-W292 HydrophobicContact CB-CB 4.28Å; V94-W292 HydrophobicContact CB-CG 4.08Å; V94-W292 HydrophobicContact CG2-CB 3.79Å; V94-W292 HydrophobicContact CG2-CG 4.09Å; I155-W292 HydrophobicContact CG2-CH2 3.87Å; I155-W292 HydrophobicContact CG2-CZ3 3.5Å; M159-W292 HydrophobicContact SD-CZ3 4.19Å; L167-W292 HydrophobicContact CD1-CH2 4.33Å; L167-W292 HydrophobicContact CD2-CH2 4.08Å; L167-W292 HydrophobicContact CD2-CZ2 4.34Å; R289-W292 HydrophobicContact CB-CD2 3.86Å; R289-W292 HydrophobicContact CB-CE3 3.22Å; R289-W292 HydrophobicContact CB-CH2 4.46Å; R289-W292 HydrophobicContact CB-CZ3 3.6Å; R289-W292 HydrophobicContact CG-CE3 4.06Å; R289-W292 HydrophobicContact CG-CH2 4.47Å; R289-W292 HydrophobicContact CG-CZ3 4Å; R289-W292 WeakPolarHBondContact O-CB 3.27Å; R289-W292 PolarHBondContact O-N 3.09Å; R289-W292 VanDerWaalsContact O-N 3.09Å; F290-W292 PolarHBondContact O-N 2.74Å; W292-T294 PolarHBondContact O-N 3.48Å; W292-T294 VanDerWaalsContact O-N 3.16Å; W292-A295 WeakPolarHBondContact O-CB 3.32Å; W292-A295 PolarHBondContact O-N 2.83Å; W292-Q296 PolarHBondContact O-N 2.83Å
293	S	95.9	Very high	95.7	Very high	81 Å²	81	41 Å²	41	57%	0.566	23%	0.226	S	C	*	.	H	α-helix	trans	-58.6	-30.8	179.3	56.6	0	0	0	0	113.6	T297	S293-T297 VanDerWaalsContact O-CB 3.31Å; S293-T297 WeakPolarHBondContact O-CB 3.22Å; S293-T297 PolarHBondContact O-N 3.06Å; S293-T297 PolarHBondContact O-OG1 3.15Å
294	T	95.1	Very high	95.6	Very high	34 Å²	34	44.8 Å²	44.8	21%	0.209	25%	0.248	C	C	.	.	H	α-helix	trans	-66.3	-40.5	174.9	-54.5	0	0	0	0	111.9	L274 W292 L298	L274-T294 HydrophobicContact CD1-CG2 4.28Å; W292-T294 PolarHBondContact O-N 3.48Å; W292-T294 VanDerWaalsContact O-N 3.16Å; T294-L298 VanDerWaalsContact O-CG 3.31Å; T294-L298 WeakPolarHBondContact O-CG 3.38Å; T294-L298 PolarHBondContact O-N 3.28Å
295	A	96.7	Very high	95.4	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-69.4	-45.4	175.5	0	0	0	0	0	110.7	V94 Y284 V288 W292 L298 M299	V94-A295 HydrophobicContact CG2-CB 4.19Å; Y284-A295 HydrophobicContact CD2-CB 4.3Å; Y284-A295 HydrophobicContact CE2-CB 3.9Å; V288-A295 HydrophobicContact CG1-CB 4.08Å; W292-A295 WeakPolarHBondContact O-CB 3.32Å; W292-A295 PolarHBondContact O-N 2.83Å; A295-L298 PolarHBondContact O-N 2.99Å; A295-M299 WeakPolarHBondContact O-CG 3.41Å; A295-M299 PolarHBondContact O-N 2.98Å
296	Q	95.1	Very high	95.3	Very high	68 Å²	68	52.9 Å²	52.9	32%	0.318	30%	0.3	S	S	.	.	H	α-helix	trans	-58.7	-53.2	178.2	-70.9	168.7	29.7	0	0	112.1	F290 S291 W292 L298 M299 D300	F290-Q296 VanDerWaalsContact O-CG 3.29Å; F290-Q296 WeakPolarHBondContact O-CG 3.31Å; F290-Q296 PolarHBondContact O-NE2 3.02Å; F290-Q296 VanDerWaalsContact O-NE2 3.09Å; S291-Q296 VanDerWaalsContact C-NE2 3.25Å; S291-Q296 PolarHBondContact O-NE2 3.39Å; W292-Q296 PolarHBondContact O-N 2.83Å; Q296-L298 PolarHBondContact O-N 3.27Å; Q296-L298 VanDerWaalsContact O-N 3.15Å; Q296-M299 HydrophobicContact CG-CE 4.31Å; Q296-M299 PolarHBondContact O-N 3.4Å; Q296-D300 WeakPolarHBondContact O-CB 3.24Å; Q296-D300 PolarHBondContact O-N 3.49Å
297	T	95.1	Very high	95.1	Very high	89 Å²	89	58 Å²	58	55%	0.546	32%	0.324	S	S	.	.	H	α-helix	trans	-56.2	-37.1	179.4	-54.4	0	0	0	0	112.5	S293 S301	S293-T297 VanDerWaalsContact O-CB 3.31Å; S293-T297 WeakPolarHBondContact O-CB 3.22Å; S293-T297 PolarHBondContact O-N 3.06Å; S293-T297 PolarHBondContact O-OG1 3.15Å; T297-S301 WeakPolarHBondContact O-CB 3.36Å; T297-S301 PolarHBondContact O-N 3.15Å; T297-S301 PolarHBondContact O-OG 3.36Å
298	L	94.3	Very high	94.7	Very high	30 Å²	30	64.8 Å²	64.8	16%	0.157	35%	0.349	C	S	.	.	H	α-helix	trans	-72.7	-41	178	-73.1	177.4	0	0	0	112.1	L274 L275 Y284 T294 A295 Q296 S301 K302	L274-L298 HydrophobicContact CB-CD1 3.93Å; L274-L298 HydrophobicContact CD1-CD1 4.22Å; L275-L298 HydrophobicContact CD2-CD1 4.44Å; L275-L298 HydrophobicContact CD2-CD2 3.75Å; Y284-L298 VanDerWaalsContact OH-CB 3.24Å; Y284-L298 WeakPolarHBondContact OH-CB 3.33Å; T294-L298 VanDerWaalsContact O-CG 3.31Å; T294-L298 WeakPolarHBondContact O-CG 3.38Å; T294-L298 PolarHBondContact O-N 3.28Å; A295-L298 PolarHBondContact O-N 2.99Å; Q296-L298 PolarHBondContact O-N 3.27Å; Q296-L298 VanDerWaalsContact O-N 3.15Å; L298-S301 PolarHBondContact O-N 3.45Å; L298-S301 PolarHBondContact O-OG 3.3Å; L298-K302 WeakPolarHBondContact O-CB 3.4Å; L298-K302 PolarHBondContact O-N 2.91Å; L298-K302 VanDerWaalsContact O-N 3.08Å
299	M	95.2	Very high	94.3	Very high	32 Å²	32	71.7 Å²	71.7	16%	0.158	39%	0.387	C	S	.	.	H	α-helix	trans	-63	-48.3	173.8	-69.3	-176.7	-58.2	0	0	111	L278 Y284 F290 A295 Q296 S301 K302 A303	L278-M299 HydrophobicContact CD1-CG 3.86Å; Y284-M299 HydrophobicContact CD2-CG 4.07Å; Y284-M299 HydrophobicContact CD2-SD 3.9Å; Y284-M299 HydrophobicContact CE2-CG 3.63Å; Y284-M299 HydrophobicContact CE2-SD 4.05Å; F290-M299 HydrophobicContact CD1-CE 3.74Å; F290-M299 HydrophobicContact CD1-SD 3.54Å; F290-M299 VanDerWaalsContact CD1-SD 3.54Å; F290-M299 HydrophobicContact CE1-CE 4.44Å; F290-M299 HydrophobicContact CE1-SD 3.64Å; A295-M299 WeakPolarHBondContact O-CG 3.41Å; A295-M299 PolarHBondContact O-N 2.98Å; Q296-M299 HydrophobicContact CG-CE 4.31Å; Q296-M299 PolarHBondContact O-N 3.4Å; M299-S301 PolarHBondContact O-N 3.13Å; M299-S301 VanDerWaalsContact O-N 3.15Å; M299-K302 PolarHBondContact O-N 2.77Å; M299-A303 HydrophobicContact CB-CB 4.39Å; M299-A303 WeakPolarHBondContact O-CA 3.41Å; M299-A303 VanDerWaalsContact O-CB 3.27Å; M299-A303 WeakPolarHBondContact O-CB 3.26Å; M299-A303 PolarHBondContact O-N 3.47Å
300	D	92.8	Very high	93.6	Very high	135 Å²	135	74.4 Å²	74.4	72%	0.722	40%	0.401	S	S	*	.	H	α-helix	trans	-59.7	-30.4	-179.3	-63.9	-17.8	0	0	0	112.9	Q296	Q296-D300 WeakPolarHBondContact O-CB 3.24Å; Q296-D300 PolarHBondContact O-N 3.49Å
301	S	93.5	Very high	92.4	Very high	79 Å²	79	75.2 Å²	75.2	55%	0.552	41%	0.407	S	S	*	.	H	α-helix	trans	-92.8	-21.6	-177.3	58.6	0	0	0	0	114.8	T297 L298 M299	T297-S301 WeakPolarHBondContact O-CB 3.36Å; T297-S301 PolarHBondContact O-N 3.15Å; T297-S301 PolarHBondContact O-OG 3.36Å; L298-S301 PolarHBondContact O-N 3.45Å; L298-S301 PolarHBondContact O-OG 3.3Å; M299-S301 PolarHBondContact O-N 3.13Å; M299-S301 VanDerWaalsContact O-N 3.15Å
302	K	94.3	Very high	90.6	Very high	126 Å²	126	82.4 Å²	82.4	55%	0.548	44%	0.44	S	S	.	.	H	α-helix	trans	-132.9	-16.6	-169.3	-63.5	-171.4	178.4	-147.1	0	115.4	L275 L278 L298 M299	L275-K302 HydrophobicContact CD2-CD 3.69Å; L275-K302 VanDerWaalsContact CD2-NZ 3.29Å; L278-K302 HydrophobicContact CD2-CB 3.52Å; L278-K302 HydrophobicContact CD2-CD 4.37Å; L298-K302 WeakPolarHBondContact O-CB 3.4Å; L298-K302 PolarHBondContact O-N 2.91Å; L298-K302 VanDerWaalsContact O-N 3.08Å; M299-K302 PolarHBondContact O-N 2.77Å
303	A	95.6	Very high	88.4	Confident	21 Å²	21	88.8 Å²	88.8	17%	0.174	47%	0.471	C	S	.	.	S	Bend	trans	-97.1	170.9	175.7	0	0	0	0	0	111.3	L278 M299	L278-A303 HydrophobicContact CD1-CB 4.41Å; M299-A303 HydrophobicContact CB-CB 4.39Å; M299-A303 WeakPolarHBondContact O-CA 3.41Å; M299-A303 VanDerWaalsContact O-CB 3.27Å; M299-A303 WeakPolarHBondContact O-CB 3.26Å; M299-A303 PolarHBondContact O-N 3.47Å
304	V	95.5	Very high	86.2	Confident	85 Å²	85	90.5 Å²	90.5	52%	0.515	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-67.4	131.7	174.5	176.3	0	0	0	0	108.8	P280 V306	P280-V304 HydrophobicContact CB-CG2 4.45Å; P280-V304 WeakPolarHBondContact O-CB 3.25Å; P280-V304 WeakPolarHBondContact O-CG2 3.37Å; P280-V304 PolarHBondContact O-N 2.71Å; V304-V306 PolarHBondContact O-N 3.08Å
305	P	92.3	Very high	83.9	Confident	103 Å²	103	90.4 Å²	90.4	67%	0.669	48%	0.479	S	S	*	.	P	Polyproline II helix	trans	-59.8	131.9	175.9	-24.2	33.9	0	0	0	111.9
306	V	92.1	Very high	81.2	Confident	83 Å²	83	97.8 Å²	97.8	50%	0.503	51%	0.514	S	S	.	.			trans	-117.4	135.8	173.6	-179.1	0	0	0	0	108.1	V304 W308	V304-V306 PolarHBondContact O-N 3.08Å; V306-W308 HydrophobicContact CG1-CZ2 4.03Å
307	H	89.9	Confident	78.8	Confident	162 Å²	162	100.9 Å²	100.9	75%	0.75	53%	0.526	S	S	*	.			trans	-114.9	127.3	176.5	-64.2	-65.8	0	0	0	110	D311	H307-D311 VanDerWaalsContact CA-OD2 3.31Å; H307-D311 WeakPolarHBondContact CA-OD2 3.32Å
308	W	88.8	Confident	76.2	Confident	142 Å²	142	99.4 Å²	99.4	54%	0.538	52%	0.523	S	S	.	.			trans	-102.9	152.2	175.5	-57.1	94.4	0	0	0	110.9	V21 V306 D310 D311	V21-W308 HydrophobicContact CG2-CH2 4.07Å; V306-W308 HydrophobicContact CG1-CZ2 4.03Å; W308-D310 WeakPolarHBondContact CB-OD1 3.21Å; W308-D310 PolarHBondContact O-N 3.39Å; W308-D310 VanDerWaalsContact O-N 3.1Å; W308-D311 PolarHBondContact N-OD2 3.12Å; W308-D311 WeakPolarHBondContact O-CB 2.82Å; W308-D311 PolarHBondContact O-N 3.03Å; W308-D311 VanDerWaalsContact O-N 3.09Å
309	D	88.3	Confident	73.7	Confident	146 Å²	146	101.1 Å²	101.1	78%	0.781	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-22.5	-177.2	-65.6	-32.2	0	0	0	113.3
310	D	83.9	Confident	71.3	Confident	56 Å²	56	107.3 Å²	107.3	30%	0.299	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100.6	1.1	-179.1	52	-34.5	0	0	0	114	R162 W308 E312 E313	R162-D310 WeakPolarHBondContact CG-OD2 3.34Å; W308-D310 WeakPolarHBondContact CB-OD1 3.21Å; W308-D310 PolarHBondContact O-N 3.39Å; W308-D310 VanDerWaalsContact O-N 3.1Å; D310-E312 PolarHBondContact O-N 3.31Å; D310-E313 PolarHBondContact O-N 3.4Å
311	D	72.4	Confident	69.1	Low	65 Å²	65	111.8 Å²	111.8	35%	0.348	58%	0.577	S	S	.	*	H	α-helix	trans	-61.5	-26.2	175.9	-74.1	-15.3	0	0	0	112.3	H307 W308 D314 G315	H307-D311 VanDerWaalsContact CA-OD2 3.31Å; H307-D311 WeakPolarHBondContact CA-OD2 3.32Å; W308-D311 PolarHBondContact N-OD2 3.12Å; W308-D311 WeakPolarHBondContact O-CB 2.82Å; W308-D311 PolarHBondContact O-N 3.03Å; W308-D311 VanDerWaalsContact O-N 3.09Å; D311-D314 PolarHBondContact O-N 3.2Å; D311-G315 WeakPolarHBondContact O-CA 3.46Å; D311-G315 PolarHBondContact O-N 3.07Å
312	E	57.2	Low	66.8	Low	166 Å²	166	114.6 Å²	114.6	78%	0.776	58%	0.581	S	S	*	*	H	α-helix	trans	-72.5	-26.6	-179.3	-66.5	-172.1	172.7	0	0	113.3	D310 D314	D310-E312 PolarHBondContact O-N 3.31Å; E312-D314 VanDerWaalsContact C-N 3.32Å
313	E	53.1	Low	64.4	Low	162 Å²	162	116.4 Å²	116.4	76%	0.757	60%	0.597	S	S	*	*	H	α-helix	trans	-72	-26	175	-94	-172.9	167.2	0	0	112.6	D310	D310-E313 PolarHBondContact O-N 3.4Å
314	D	50.1	Low	61.9	Low	117 Å²	117	121.6 Å²	121.6	63%	0.626	62%	0.622	S	S	*	*	H	α-helix	trans	-99.2	-23.7	175.1	-92.2	-24.1	0	0	0	113.1	D311 E312 E316 K317 A318	D311-D314 PolarHBondContact O-N 3.2Å; E312-D314 VanDerWaalsContact C-N 3.32Å; D314-E316 PolarHBondContact O-N 2.77Å; D314-K317 PolarHBondContact O-N 3.08Å; D314-K317 VanDerWaalsContact O-N 3.14Å; D314-A318 PolarHBondContact O-N 3.21Å
315	G	45.4	Very low	59.2	Low	32 Å²	32	128.9 Å²	128.9	33%	0.33	64%	0.64	S	S	.	*	H	α-helix	trans	-63.9	-37.5	-178.4	0	0	0	0	0	114.3	D311 K317 A318 A319	D311-G315 WeakPolarHBondContact O-CA 3.46Å; D311-G315 PolarHBondContact O-N 3.07Å; G315-K317 PolarHBondContact O-N 3.06Å; G315-A318 PolarHBondContact O-N 2.84Å; G315-A319 VanDerWaalsContact O-CB 3.27Å; G315-A319 WeakPolarHBondContact O-CB 3.44Å; G315-A319 PolarHBondContact O-N 3.35Å
316	E	41.3	Very low	56.9	Low	154 Å²	154	127.4 Å²	127.4	72%	0.72	63%	0.632	S	S	*	*	H	α-helix	trans	-61.4	-30.5	174.5	-72.7	-169.1	156.9	0	0	112.3	D314 Q320	D314-E316 PolarHBondContact O-N 2.77Å; E316-Q320 WeakPolarHBondContact O-CG 3.21Å; E316-Q320 PolarHBondContact O-N 3.47Å
317	K	43.7	Very low	54.6	Low	133 Å²	133	130.9 Å²	130.9	58%	0.578	65%	0.645	S	S	*	*	H	α-helix	trans	-87.4	-32.9	178.5	-68	174.1	-172.8	152.7	0	112.7	D314 G315 Q320 R321	D314-K317 PolarHBondContact O-N 3.08Å; D314-K317 VanDerWaalsContact O-N 3.14Å; G315-K317 PolarHBondContact O-N 3.06Å; K317-Q320 PolarHBondContact O-N 3.05Å; K317-R321 PolarHBondContact O-N 3.47Å
318	A	39.8	Very low	52.5	Low	58 Å²	58	129.8 Å²	129.8	48%	0.479	64%	0.643	S	S	.	*	H	α-helix	trans	-67	-41.6	173.5	0	0	0	0	0	111.4	D314 G315 Q320 R321 Q322	D314-A318 PolarHBondContact O-N 3.21Å; G315-A318 PolarHBondContact O-N 2.84Å; A318-Q320 VanDerWaalsContact C-N 3.29Å; A318-Q320 PolarHBondContact O-N 3.37Å; A318-R321 PolarHBondContact O-N 3.24Å; A318-Q322 PolarHBondContact O-N 3.16Å
319	A	42.1	Very low	50.3	Low	66 Å²	66	127 Å²	127	55%	0.545	65%	0.645	S	S	.	*	H	α-helix	trans	-67.8	-23.1	175.5	0	0	0	0	0	113.8	G315	G315-A319 VanDerWaalsContact O-CB 3.27Å; G315-A319 WeakPolarHBondContact O-CB 3.44Å; G315-A319 PolarHBondContact O-N 3.35Å
320	Q	44.3	Very low	48.1	Very low	162 Å²	162	129.7 Å²	129.7	76%	0.757	65%	0.646	S	S	*	*	H	α-helix	trans	-77.8	-22.7	172.5	-81.3	175.8	-4.2	0	0	113.6	E316 K317 A318	E316-Q320 WeakPolarHBondContact O-CG 3.21Å; E316-Q320 PolarHBondContact O-N 3.47Å; K317-Q320 PolarHBondContact O-N 3.05Å; A318-Q320 VanDerWaalsContact C-N 3.29Å; A318-Q320 PolarHBondContact O-N 3.37Å
321	R	48.6	Very low	46.3	Very low	229 Å²	229	135.8 Å²	135.8	86%	0.864	67%	0.67	S	S	*	*	H	α-helix	trans	-83.6	-28.6	-179.9	-78.1	178.8	175.5	170.2	0.2	113.5	K317 A318	K317-R321 PolarHBondContact O-N 3.47Å; A318-R321 PolarHBondContact O-N 3.24Å
322	Q	44.6	Very low	44.9	Very low	139 Å²	139	137.3 Å²	137.3	65%	0.65	69%	0.686	S	S	*	*	S	Bend	trans	-97.9	111.7	169.3	-68.1	-178.1	-5.9	0	0	106.9	A318 N324	A318-Q322 PolarHBondContact O-N 3.16Å; Q322-N324 PolarHBondContact O-N 3.39Å
323	N	43.9	Very low	44.3	Very low	164 Å²	164	133.6 Å²	133.6	88%	0.877	68%	0.684	S	S	*	*			trans	-70	47.4	-176	-158.3	19.1	0	0	0	112.9
324	N	42	Very low	43.5	Very low	130 Å²	130	132 Å²	132	70%	0.695	69%	0.691	S	S	*	*			trans	-102.7	108.8	176.4	-79.6	-9.8	0	0	0	107.7	Q322 S326	Q322-N324 PolarHBondContact O-N 3.39Å; N324-S326 PolarHBondContact O-N 3.3Å
325	R	40	Very low	43.3	Very low	238 Å²	238	131.6 Å²	131.6	90%	0.898	70%	0.704	S	S	*	*			trans	-49.9	123.1	166.8	-84.1	176.6	150.4	178	-7.6	109.3
326	S	43.1	Very low	43	Very low	72 Å²	72	139.2 Å²	139.2	50%	0.503	73%	0.731	S	S	.	*			trans	-55.8	135.2	174.4	169.1	0	0	0	0	111.1	N324 L328 S329	N324-S326 PolarHBondContact O-N 3.3Å; S326-L328 PolarHBondContact O-N 3.08Å; S326-L328 WeakPolarHBondContact OG-CD1 3.44Å; S326-L328 PolarHBondContact OG-N 3.18Å; S326-S329 PolarHBondContact O-N 3.45Å
327	M	43.4	Very low	43.3	Very low	155 Å²	155	136 Å²	136	76%	0.764	74%	0.739	S	S	*	*	G	3₁₀ helix	trans	-58.4	-9.6	174.5	-121	-167.3	-70.9	0	0	113.5	S329 Y330	M327-S329 PolarHBondContact O-N 3.2Å; M327-Y330 PolarHBondContact O-N 2.96Å
328	L	45.8	Very low	43.2	Very low	139 Å²	139	137 Å²	137	73%	0.728	75%	0.751	S	S	*	*	G	3₁₀ helix	trans	-65.7	-16.7	177.5	-96.8	97	0	0	0	114.4	S326 Y330	S326-L328 PolarHBondContact O-N 3.08Å; S326-L328 WeakPolarHBondContact OG-CD1 3.44Å; S326-L328 PolarHBondContact OG-N 3.18Å; L328-Y330 PolarHBondContact O-N 3.37Å
329	S	42.7	Very low	43.6	Very low	83 Å²	83	146 Å²	146	58%	0.58	77%	0.772	S	S	*	*	G	3₁₀ helix	trans	-74.7	-5.5	177.9	69.5	0	0	0	0	114.1	S326 M327	S326-S329 PolarHBondContact O-N 3.45Å; M327-S329 PolarHBondContact O-N 3.2Å
330	Y	42.4	Very low	44.4	Very low	204 Å²	204	147.2 Å²	147.2	80%	0.8	78%	0.782	S	S	*	*	G	3₁₀ helix	trans	-93.1	-14.9	177.7	-96.8	-85.1	0	0	0	114.2	M327 L328	M327-Y330 PolarHBondContact O-N 2.96Å; L328-Y330 PolarHBondContact O-N 3.37Å
331	F	46	Very low	45.2	Very low	183 Å²	183	148.2 Å²	148.2	80%	0.803	79%	0.786	S	S	*	*	S	Bend	trans	-100.6	0.4	-175.1	-72.8	-77	0	0	0	114.6	A333	F331-A333 PolarHBondContact O-N 2.95Å
332	S	44	Very low	45.9	Very low	97 Å²	97	146.6 Å²	146.6	68%	0.678	79%	0.789	S	S	*	*			trans	-94	79.1	176.3	61.4	0	0	0	0	111.5
333	A	44.2	Very low	47.3	Very low	89 Å²	89	144.9 Å²	144.9	74%	0.736	79%	0.788	S	S	*	*			trans	169.2	97.3	142.3	0	0	0	0	0	110.9	F331	F331-A333 PolarHBondContact O-N 2.95Å
334	S	36.4	Very low	49.4	Very low	128 Å²	128	143.3 Å²	143.3	90%	0.895	78%	0.775	S	S	*	*			trans	-169.4	85.1	145.6	-74	0	0	0	0	107.5	E336	S334-E336 PolarHBondContact O-N 3.21Å
335	A	46.5	Very low	51.8	Low	109 Å²	109	145.5 Å²	145.5	90%	0.901	77%	0.773	S	S	*	*			trans	-83.3	96.6	170.1	0	0	0	0	0	108.3
336	E	38.5	Very low	54.3	Low	192 Å²	192	138.5 Å²	138.5	90%	0.897	75%	0.75	S	S	*	*			trans	-115.6	123.2	156	-85.6	-172.3	157.9	0	0	108.5	S334 D338	S334-E336 PolarHBondContact O-N 3.21Å; E336-D338 PolarHBondContact O-N 3.07Å
337	G	47.7	Very low	56.6	Low	86 Å²	86	139.8 Å²	139.8	89%	0.887	75%	0.746	S	S	*	*			trans	-72.9	117.5	-165.7	0	0	0	0	0	112.5
338	D	41.5	Very low	58.8	Low	155 Å²	155	135.7 Å²	135.7	83%	0.829	73%	0.733	S	S	*	*			trans	-100.8	119.1	153.2	-147.2	0.8	0	0	0	107.2	E336 A340	E336-D338 PolarHBondContact O-N 3.07Å; D338-A340 PolarHBondContact O-N 3.41Å
339	R	48.5	Very low	61.1	Low	247 Å²	247	134.1 Å²	134.1	93%	0.932	72%	0.722	S	S	*	*			trans	-69.2	80.3	173.9	-85.4	-179	172.1	174	-1.3	107.9	Q341	R339-Q341 PolarHBondContact O-N 3.47Å
340	A	58.7	Low	63.5	Low	90 Å²	90	136.5 Å²	136.5	74%	0.744	72%	0.718	S	S	*	*			trans	-57.2	112.8	169.5	0	0	0	0	0	107.8	D338 Q342	D338-A340 PolarHBondContact O-N 3.41Å; A340-Q342 PolarHBondContact O-N 2.74Å
341	Q	60.9	Low	65.7	Low	183 Å²	183	137.5 Å²	137.5	86%	0.855	72%	0.721	S	S	*	*			trans	-46.8	118.8	169	-103.8	171.3	-16.4	0	0	108	R339 T343	R339-Q341 PolarHBondContact O-N 3.47Å; Q341-T343 PolarHBondContact O-N 3.47Å
342	Q	62.1	Low	67.9	Low	196 Å²	196	133 Å²	133	92%	0.916	71%	0.705	S	S	*	*			trans	-58	112.8	175.2	-92.3	-175.6	-12.2	0	0	107.9	A340 H344	A340-Q342 PolarHBondContact O-N 2.74Å; Q342-H344 PolarHBondContact O-N 3.24Å
343	T	75.4	Confident	70	Confident	103 Å²	103	137.5 Å²	137.5	63%	0.632	71%	0.712	S	S	*	*			trans	-62.9	135.7	177.7	53.1	0	0	0	0	108.9	Q341 R345	Q341-T343 PolarHBondContact O-N 3.47Å; T343-R345 PolarHBondContact O-N 2.68Å
344	H	88.1	Confident	72	Confident	130 Å²	130	139 Å²	139	60%	0.602	72%	0.717	S	S	*	*			trans	-58.2	141.6	-178.8	-176.8	-90.8	0	0	0	110.3	Q342 F346 F347	Q342-H344 PolarHBondContact O-N 3.24Å; H344-F346 WeakPolarHBondContact ND1-CB 3.11Å; H344-F346 PolarHBondContact ND1-N 3.5Å; H344-F346 VanDerWaalsContact ND1-N 3.18Å; H344-F346 PolarHBondContact O-N 3.19Å; H344-F347 HydrophobicContact CB-CD2 3.95Å; H344-F347 HydrophobicContact CB-CE2 4.23Å; H344-F347 PolarHBondContact O-N 2.88Å
345	R	92.4	Very high	74.4	Confident	176 Å²	176	139.2 Å²	139.2	66%	0.664	71%	0.707	S	S	*	*	H	α-helix	trans	-47.4	-36.3	-177	-178.3	176.8	172.4	-173.7	-5.2	113.7	T343 F347 S348 E349	T343-R345 PolarHBondContact O-N 2.68Å; R345-F347 VanDerWaalsContact C-N 3.27Å; R345-F347 PolarHBondContact O-N 3.33Å; R345-S348 WeakPolarHBondContact CA-OG 3.42Å; R345-S348 PolarHBondContact O-N 2.71Å; R345-S348 PolarHBondContact O-OG 3.24Å; R345-S348 VanDerWaalsContact O-OG 3.05Å; R345-E349 HydrophobicContact CG-CG 3.97Å; R345-E349 IonicContact CZ-OE1 3.84Å; R345-E349 IonicContact NE-OE1 3.19Å; R345-E349 PolarHBondContact NE-OE1 3.29Å; R345-E349 IonicContact NH2-OE1 3.14Å; R345-E349 PolarHBondContact NH2-OE1 3.21Å; R345-E349 WeakPolarHBondContact O-CB 3.49Å; R345-E349 WeakPolarHBondContact O-CG 3.49Å; R345-E349 PolarHBondContact O-N 2.78Å
346	F	92.4	Very high	76.2	Confident	91 Å²	91	144.2 Å²	144.2	40%	0.399	71%	0.709	S	S	.	*	H	α-helix	trans	-50.4	-42.8	174.5	176.6	-94.5	0	0	0	113.7	H344 R350 L352	H344-F346 WeakPolarHBondContact ND1-CB 3.11Å; H344-F346 PolarHBondContact ND1-N 3.5Å; H344-F346 VanDerWaalsContact ND1-N 3.18Å; H344-F346 PolarHBondContact O-N 3.19Å; F346-R350 VanDerWaalsContact CE2-CZ 3.44Å; F346-R350 VanDerWaalsContact CE2-NE 3.33Å; F346-R350 WeakPolarHBondContact O-CD 3.47Å; F346-R350 PolarHBondContact O-NH1 2.94Å; F346-L352 HydrophobicContact CE1-CD1 4.2Å
347	F	91.9	Very high	78.1	Confident	99 Å²	99	139.5 Å²	139.5	43%	0.434	70%	0.697	S	S	.	*	H	α-helix	trans	-77.4	-42.3	-177.4	-64.2	-77.7	0	0	0	111.9	H344 R345 R350 R351 L352	H344-F347 HydrophobicContact CB-CD2 3.95Å; H344-F347 HydrophobicContact CB-CE2 4.23Å; H344-F347 PolarHBondContact O-N 2.88Å; R345-F347 VanDerWaalsContact C-N 3.27Å; R345-F347 PolarHBondContact O-N 3.33Å; F347-R350 PolarHBondContact O-N 2.94Å; F347-R351 PolarHBondContact O-N 2.56Å; F347-R351 VanDerWaalsContact O-N 3.13Å; F347-L352 HydrophobicContact CB-CB 4.36Å; F347-L352 HydrophobicContact CD1-CB 3.99Å; F347-L352 HydrophobicContact CD1-CD1 4.23Å; F347-L352 PolarHBondContact O-N 2.93Å
348	S	89.2	Confident	79.2	Confident	69 Å²	69	146.2 Å²	146.2	48%	0.483	71%	0.712	S	S	.	*	H	α-helix	trans	-66.3	-43.1	179.5	55.6	0	0	0	0	112.2	R345 R350 R351	R345-S348 WeakPolarHBondContact CA-OG 3.42Å; R345-S348 PolarHBondContact O-N 2.71Å; R345-S348 PolarHBondContact O-OG 3.24Å; R345-S348 VanDerWaalsContact O-OG 3.05Å; S348-R350 PolarHBondContact O-N 2.7Å; S348-R351 PolarHBondContact O-N 3.37Å; S348-R351 VanDerWaalsContact O-N 3.16Å
349	E	92.5	Very high	81.1	Confident	107 Å²	107	145.8 Å²	145.8	50%	0.5	71%	0.706	S	S	.	*	H	α-helix	trans	-62.2	-29.8	176.5	-73.6	-177.2	156.8	0	0	113.3	R345	R345-E349 HydrophobicContact CG-CG 3.97Å; R345-E349 IonicContact CZ-OE1 3.84Å; R345-E349 IonicContact NE-OE1 3.19Å; R345-E349 PolarHBondContact NE-OE1 3.29Å; R345-E349 IonicContact NH2-OE1 3.14Å; R345-E349 PolarHBondContact NH2-OE1 3.21Å; R345-E349 WeakPolarHBondContact O-CB 3.49Å; R345-E349 WeakPolarHBondContact O-CG 3.49Å; R345-E349 PolarHBondContact O-N 2.78Å
350	R	93.7	Very high	82.8	Confident	132 Å²	132	140.5 Å²	140.5	50%	0.498	69%	0.694	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97	6.2	-179.4	-70.6	167.9	179.3	67	4.5	113.1	F346 F347 S348 L352	F346-R350 VanDerWaalsContact CE2-CZ 3.44Å; F346-R350 VanDerWaalsContact CE2-NE 3.33Å; F346-R350 WeakPolarHBondContact O-CD 3.47Å; F346-R350 PolarHBondContact O-NH1 2.94Å; F347-R350 PolarHBondContact O-N 2.94Å; S348-R350 PolarHBondContact O-N 2.7Å; R350-L352 HydrophobicContact CB-CD1 3.86Å; R350-L352 HydrophobicContact CB-CG 3.79Å; R350-L352 PolarHBondContact O-N 2.91Å; R350-L352 VanDerWaalsContact O-N 3.16Å
351	R	89.7	Confident	84.1	Confident	225 Å²	225	143.3 Å²	143.3	85%	0.849	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	51.6	33	-175	-57.6	-174.1	176.4	-168.6	-1	113.1	F347 S348	F347-R351 PolarHBondContact O-N 2.56Å; F347-R351 VanDerWaalsContact O-N 3.13Å; S348-R351 PolarHBondContact O-N 3.37Å; S348-R351 VanDerWaalsContact O-N 3.16Å
352	L	91.8	Very high	85.5	Confident	90 Å²	90	140.9 Å²	140.9	47%	0.471	68%	0.681	S	S	.	*			trans	-87.5	131.2	178.2	-63.7	173.9	0	0	0	110	F346 F347 R350	F346-L352 HydrophobicContact CE1-CD1 4.2Å; F347-L352 HydrophobicContact CB-CB 4.36Å; F347-L352 HydrophobicContact CD1-CB 3.99Å; F347-L352 HydrophobicContact CD1-CD1 4.23Å; F347-L352 PolarHBondContact O-N 2.93Å; R350-L352 HydrophobicContact CB-CD1 3.86Å; R350-L352 HydrophobicContact CB-CG 3.79Å; R350-L352 PolarHBondContact O-N 2.91Å; R350-L352 VanDerWaalsContact O-N 3.16Å
353	K	87.1	Confident	86.9	Confident	191 Å²	191	137.5 Å²	137.5	83%	0.83	67%	0.667	S	S	*	*			trans	-132.1	145.4	177.4	-62	-176.9	-177.5	177.6	0	109.8	L355	K353-L355 PolarHBondContact O-N 3.28Å
354	S	86.9	Confident	87.7	Confident	120 Å²	120	139.8 Å²	139.8	84%	0.839	67%	0.669	S	S	*	*			trans	-69.7	128	171.9	-169.4	0	0	0	0	109.5
355	L	87.9	Confident	87.7	Confident	132 Å²	132	140.5 Å²	140.5	69%	0.691	67%	0.674	S	S	*	*			trans	-78.8	130.7	170.7	-72.1	169	0	0	0	109.1	K353	K353-L355 PolarHBondContact O-N 3.28Å
356	K	83.6	Confident	87.3	Confident	214 Å²	214	137.8 Å²	137.8	93%	0.93	68%	0.675	S	S	*	*	S	Bend	trans	-92.6	-16.5	171.8	-68	-173.2	178.9	-177.8	0	112.2
357	S	79	Confident	86.9	Confident	94 Å²	94	141.7 Å²	141.7	66%	0.657	70%	0.698	S	S	*	*			trans	-156	157.6	174	57.8	0	0	0	0	109.1
358	L	69.4	Low	86.4	Confident	227 Å²	227	145.5 Å²	145.5	100%	1.188	72%	0.722	S	S	*	*			trans	-86.6	0	176.1	-82.1	160.7	0	0	0	111.8

Retrieved 358 of 358 residues in 65.8 ms (Link to these results)

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