A0A2K6A6A9_MANLE Loading...

WD repeat domain phosphoinositide-interacting protein 1

AlphaFold DB , UniProt , Accession A0A2K6A6A9, Species MANLE (Mandrillus leucophaeus, Drill), Gene WIPI1, Length 446 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.2	Very low	33.4	Very low	243 Å²	243	133.3 Å²	133.3	100%	1.197	84%	0.837	S	S	*	*				0	97.9	0	-77.7	173.1	168	0	0	106.2
2	E	32.4	Very low	33.3	Very low	187 Å²	187	127.9 Å²	127.9	87%	0.874	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-64.8	149	161.6	-66.6	113.8	141	0	0	109.5
3	A	33.9	Very low	34	Very low	98 Å²	98	126.2 Å²	126.2	81%	0.81	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-101.6	127.8	168.2	0	0	0	0	0	107.6	A5	A3-A5 PolarHBondContact O-N 2.89Å
4	E	33.3	Very low	35	Very low	196 Å²	196	130 Å²	130	92%	0.916	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-63	131.1	-177.6	-67.6	171.5	106.8	0	0	111.1	A6	E4-A6 PolarHBondContact O-N 3.2Å
5	A	33.3	Very low	36.8	Very low	101 Å²	101	125.5 Å²	125.5	84%	0.835	79%	0.789	S	S	*	*			trans	-74.8	105.7	165.1	0	0	0	0	0	108	A3 D7	A3-A5 PolarHBondContact O-N 2.89Å; A5-D7 PolarHBondContact O-N 3.01Å
6	A	36.2	Very low	39.7	Very low	98 Å²	98	121.1 Å²	121.1	81%	0.81	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-64.1	116.5	174.8	0	0	0	0	0	109.8	E4 A8	E4-A6 PolarHBondContact O-N 3.2Å; A6-A8 PolarHBondContact O-N 3.45Å
7	D	31.3	Very low	42.8	Very low	154 Å²	154	115.1 Å²	115.1	82%	0.824	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-65.4	125.4	-177.5	-168.2	25.3	0	0	0	110.7	A5	A5-D7 PolarHBondContact O-N 3.01Å
8	A	31	Very low	45.7	Very low	77 Å²	77	110.7 Å²	110.7	64%	0.636	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-90.3	122.7	-179.8	0	0	0	0	0	108.6	A6	A6-A8 PolarHBondContact O-N 3.45Å
9	P	33.3	Very low	48.3	Very low	112 Å²	112	105.5 Å²	105.5	73%	0.727	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-59.3	138.7	-175.8	24.7	-34.2	0	0	0	110.4	G11	P9-G11 PolarHBondContact O-N 3.39Å
10	P	35.3	Very low	50.8	Low	128 Å²	128	100.8 Å²	100.8	83%	0.831	64%	0.638	S	S	*	*			trans	-61.4	111.4	-175.8	24.1	-33.5	0	0	0	109.8	G12	P10-G12 VanDerWaalsContact C-N 3.3Å; P10-G12 PolarHBondContact O-N 3.5Å
11	G	30	Very low	53	Low	72 Å²	72	96.8 Å²	96.8	74%	0.742	61%	0.613	S	S	*	*			trans	-67.2	83	-176.5	0	0	0	0	0	112.1	P9 V13	P9-G11 PolarHBondContact O-N 3.39Å; G11-V13 PolarHBondContact O-N 2.87Å
12	G	32.3	Very low	55.9	Low	69 Å²	69	86.5 Å²	86.5	71%	0.711	56%	0.562	S	S	*	*			trans	-57.6	109.5	167.3	0	0	0	0	0	109.1	P10 E14	P10-G12 VanDerWaalsContact C-N 3.3Å; P10-G12 PolarHBondContact O-N 3.5Å; G12-E14 PolarHBondContact O-N 2.66Å
13	V	42.3	Very low	59	Low	106 Å²	106	78 Å²	78	64%	0.642	52%	0.522	S	S	*	.			trans	-67.3	104.3	179.7	-179.2	0	0	0	0	108	G11 S15	G11-V13 PolarHBondContact O-N 2.87Å; V13-S15 PolarHBondContact O-N 3.04Å; V13-S15 VanDerWaalsContact O-N 3.08Å; V13-S15 PolarHBondContact O-OG 2.62Å
14	E	48.8	Very low	62	Low	179 Å²	179	74.5 Å²	74.5	84%	0.836	49%	0.489	S	S	*	.			trans	-49.5	120.8	171.8	-71.8	-167.4	135.4	0	0	108.8	G12 A16	G12-E14 PolarHBondContact O-N 2.66Å; E14-A16 PolarHBondContact O-N 3.11Å
15	S	61.7	Low	65	Low	63 Å²	63	66.7 Å²	66.7	44%	0.441	45%	0.454	S	S	.	.			trans	-80.1	58.6	-168.5	-67.9	0	0	0	0	111.4	V13 L360	V13-S15 PolarHBondContact O-N 3.04Å; V13-S15 VanDerWaalsContact O-N 3.08Å; V13-S15 PolarHBondContact O-OG 2.62Å; S15-L360 VanDerWaalsContact O-CD1 3.27Å; S15-L360 WeakPolarHBondContact O-CD1 3.5Å; S15-L360 WeakPolarHBondContact O-CD2 3.25Å
16	A	83.3	Confident	67.9	Low	55 Å²	55	62.4 Å²	62.4	46%	0.455	42%	0.418	S	S	.	.			trans	-51.2	141.2	-175.3	0	0	0	0	0	112.7	E14 S18	E14-A16 PolarHBondContact O-N 3.11Å; A16-S18 PolarHBondContact O-N 2.84Å
17	L	92.6	Very high	70.8	Confident	19 Å²	19	60.2 Å²	60.2	10%	0.099	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	114.4	174.8	-71.2	-179.8	0	0	0	110.3	F20 I31 T33 S333 L359 L360	L17-F20 HydrophobicContact CB-CD1 4.06Å; L17-F20 HydrophobicContact CB-CE1 4.41Å; L17-F20 HydrophobicContact CD1-CD1 3.8Å; L17-F20 HydrophobicContact CD1-CE1 4.28Å; L17-F20 HydrophobicContact CD1-CG 4.39Å; L17-I31 HydrophobicContact CD2-CB 3.84Å; L17-I31 HydrophobicContact CD2-CD1 3.69Å; L17-I31 HydrophobicContact CD2-CG1 4.34Å; L17-I31 HydrophobicContact CD2-CG2 4.16Å; L17-T33 HydrophobicContact CD2-CG2 4.17Å; L17-S333 WeakPolarHBondContact CD1-O 3.3Å; L17-L359 HydrophobicContact CD1-CD1 4.17Å; L17-L360 HydrophobicContact CD2-CD2 3.54Å; L17-L360 HydrophobicContact CG-CD2 3.9Å
18	S	94	Very high	73.9	Confident	35 Å²	35	52.9 Å²	52.9	25%	0.245	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	-39	170	-60.4	0	0	0	0	110.8	A16 G32 V60	A16-S18 PolarHBondContact O-N 2.84Å; S18-G32 PolarHBondContact N-O 2.94Å; S18-V60 WeakPolarHBondContact CB-O 3.22Å
19	C	95.9	Very high	77.1	Confident	12 Å²	12	49.2 Å²	49.2	8%	0.081	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	162.6	174.5	66.5	0	0	0	0	113	I31 G32 Y61	C19-I31 WeakPolarHBondContact O-CA 3.32Å; C19-G32 PolarHBondContact N-O 2.76Å; C19-G32 VanDerWaalsContact N-O 3.15Å; C19-G32 PolarHBondContact O-N 2.94Å; C19-G32 VanDerWaalsContact SG-CA 3.56Å; C19-Y61 WeakPolarHBondContact CB-O 3.38Å; C19-Y61 PolarHBondContact SG-O 2.82Å; C19-Y61 VanDerWaalsContact SG-O 3.37Å
20	F	97.2	Very high	80.2	Confident	12 Å²	12	44 Å²	44	5%	0.053	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	141.9	174.3	46.6	-84.4	0	0	0	109.8	L17 L29 A30 I31 R315 I317 A332	L17-F20 HydrophobicContact CB-CD1 4.06Å; L17-F20 HydrophobicContact CB-CE1 4.41Å; L17-F20 HydrophobicContact CD1-CD1 3.8Å; L17-F20 HydrophobicContact CD1-CE1 4.28Å; L17-F20 HydrophobicContact CD1-CG 4.39Å; F20-L29 HydrophobicContact CB-CD1 4.44Å; F20-A30 CarbonylContact C-O 3.4Å; F20-A30 VanDerWaalsContact CA-O 3.24Å; F20-A30 WeakPolarHBondContact CA-O 3.49Å; F20-I31 HydrophobicContact CB-CG2 3.91Å; F20-R315 HydrophobicContact CZ-CB 4.49Å; F20-R315 HydrophobicContact CZ-CG 4.17Å; F20-I317 HydrophobicContact CD2-CD1 3.82Å; F20-I317 HydrophobicContact CD2-CG1 3.77Å; F20-I317 HydrophobicContact CE2-CD1 4.4Å; F20-I317 HydrophobicContact CE2-CG1 3.93Å; F20-I317 HydrophobicContact CE2-CG2 4.22Å; F20-A332 HydrophobicContact CD2-CB 3.88Å; F20-A332 HydrophobicContact CE2-CB 4.34Å; F20-A332 WeakPolarHBondContact CE2-O 2.95Å
21	S	97	Very high	83.2	Confident	16 Å²	16	38 Å²	38	11%	0.112	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	137.6	-175.8	51.6	0	0	0	0	111.3	L29 A30 V63	S21-L29 WeakPolarHBondContact O-CD1 3.15Å; S21-A30 PolarHBondContact N-O 3.42Å; S21-A30 PolarHBondContact O-N 3.18Å; S21-V63 PolarHBondContact OG-O 2.87Å
22	F	98.1	Very high	86.4	Confident	28 Å²	28	34.5 Å²	34.5	12%	0.123	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	142.7	165.4	-67	-64.3	0	0	0	109.4	L29 L42 I317 T319 L330 A332 L338	F22-L29 HydrophobicContact CD1-CB 4.15Å; F22-L29 HydrophobicContact CD1-CD1 4Å; F22-L29 HydrophobicContact CE1-CB 4.15Å; F22-L29 HydrophobicContact CE1-CD1 3.94Å; F22-L29 HydrophobicContact CE1-CD2 4.44Å; F22-L29 HydrophobicContact CE1-CG 4.4Å; F22-L29 HydrophobicContact CZ-CD1 4.48Å; F22-L42 HydrophobicContact CD1-CD1 3.66Å; F22-L42 HydrophobicContact CE1-CD1 3.73Å; F22-I317 HydrophobicContact CD2-CD1 3.74Å; F22-I317 HydrophobicContact CD2-CG1 3.93Å; F22-I317 HydrophobicContact CE2-CD1 4.06Å; F22-I317 HydrophobicContact CE2-CG1 3.78Å; F22-I317 HydrophobicContact CG-CD1 4.45Å; F22-T319 HydrophobicContact CB-CG2 4.42Å; F22-T319 HydrophobicContact CD1-CG2 3.82Å; F22-T319 HydrophobicContact CD2-CG2 3.56Å; F22-T319 HydrophobicContact CE1-CG2 3.88Å; F22-T319 HydrophobicContact CE2-CG2 3.61Å; F22-T319 HydrophobicContact CG-CG2 3.67Å; F22-T319 HydrophobicContact CZ-CG2 3.78Å; F22-L330 HydrophobicContact CE1-CB 4.34Å; F22-L330 HydrophobicContact CE1-CD2 4.4Å; F22-L330 HydrophobicContact CZ-CB 3.96Å; F22-A332 HydrophobicContact CE2-CB 4.4Å; F22-A332 HydrophobicContact CZ-CB 4.05Å; F22-L338 HydrophobicContact CE1-CD1 4.37Å; F22-L338 HydrophobicContact CZ-CD1 4.1Å
23	N	97.4	Very high	89.4	Confident	8 Å²	8	31.9 Å²	31.9	4%	0.043	19%	0.186	C	C	.	.			trans	-73	171.6	173.2	74.2	-20.6	0	0	0	112.2	D25 C26 T27 S28 F67	N23-D25 VanDerWaalsContact C-N 3.28Å; N23-D25 PolarHBondContact ND2-OD1 2.73Å; N23-D25 PolarHBondContact O-N 2.79Å; N23-D25 PolarHBondContact OD1-OD1 3.21Å; N23-D25 VanDerWaalsContact OD1-OD1 3.07Å; N23-C26 PolarHBondContact O-N 3.22Å; N23-C26 WeakPolarHBondContact OD1-CA 3.41Å; N23-C26 PolarHBondContact OD1-N 2.61Å; N23-C26 VanDerWaalsContact OD1-N 3.14Å; N23-T27 PolarHBondContact ND2-OG1 3.16Å; N23-T27 VanDerWaalsContact ND2-OG1 3.14Å; N23-T27 PolarHBondContact OD1-N 3.27Å; N23-S28 PolarHBondContact N-O 3.34Å; N23-S28 WeakPolarHBondContact ND2-CB 3.4Å; N23-S28 PolarHBondContact OD1-N 3.46Å; N23-S28 PolarHBondContact OD1-O 3.44Å; N23-F67 VanDerWaalsContact ND2-C 3.27Å; N23-F67 PolarHBondContact ND2-O 3.48Å
24	Q	97.5	Very high	91.9	Very high	25 Å²	25	32.5 Å²	32.5	12%	0.117	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-31.1	-168.4	-62.5	78.3	4.5	0	0	114.5	R65 F67 L108 I150	Q24-R65 PolarHBondContact NE2-O 3.32Å; Q24-R65 PolarHBondContact OE1-O 2.97Å; Q24-R65 VanDerWaalsContact OE1-O 3.09Å; Q24-F67 HydrophobicContact CB-CD1 3.85Å; Q24-F67 HydrophobicContact CB-CD2 4.35Å; Q24-F67 HydrophobicContact CB-CE1 3.51Å; Q24-F67 HydrophobicContact CB-CE2 4.03Å; Q24-F67 HydrophobicContact CB-CG 4.25Å; Q24-F67 HydrophobicContact CB-CZ 3.61Å; Q24-F67 HydrophobicContact CG-CD2 4.31Å; Q24-F67 HydrophobicContact CG-CE1 4.31Å; Q24-F67 HydrophobicContact CG-CE2 3.92Å; Q24-F67 HydrophobicContact CG-CZ 3.93Å; Q24-L108 WeakPolarHBondContact CG-O 3.4Å; Q24-L108 PolarHBondContact NE2-O 2.95Å; Q24-I150 HydrophobicContact CB-CB 4.19Å; Q24-I150 HydrophobicContact CB-CG2 3.74Å; Q24-I150 HydrophobicContact CG-CG2 4.06Å; Q24-I150 WeakPolarHBondContact O-CD1 3.4Å
25	D	95.4	Very high	94	Very high	32 Å²	32	26.3 Å²	26.3	17%	0.171	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103	2.2	179.3	56.1	27.2	0	0	0	112.9	N23 T27 F67 M242	N23-D25 VanDerWaalsContact C-N 3.28Å; N23-D25 PolarHBondContact ND2-OD1 2.73Å; N23-D25 PolarHBondContact O-N 2.79Å; N23-D25 PolarHBondContact OD1-OD1 3.21Å; N23-D25 VanDerWaalsContact OD1-OD1 3.07Å; D25-T27 HydrophobicContact CB-CG2 4.3Å; D25-T27 PolarHBondContact O-N 3.47Å; D25-T27 WeakPolarHBondContact OD1-CB 3.27Å; D25-T27 WeakPolarHBondContact OD1-CG2 3.44Å; D25-T27 PolarHBondContact OD1-N 3.22Å; D25-T27 VanDerWaalsContact OD1-N 3.16Å; D25-T27 PolarHBondContact OD1-OG1 3.39Å; D25-F67 HydrophobicContact CB-CD1 4.06Å; D25-F67 WeakPolarHBondContact OD2-CD1 3.5Å; D25-M242 HydrophobicContact CB-CE 4.15Å
26	C	95.9	Very high	95.6	Very high	11 Å²	11	23.4 Å²	23.4	7%	0.074	14%	0.14	C	C	.	.	S	Bend	trans	60.1	31.6	177.5	-54.9	0	0	0	0	113.9	N23 T319 S321	N23-C26 PolarHBondContact O-N 3.22Å; N23-C26 WeakPolarHBondContact OD1-CA 3.41Å; N23-C26 PolarHBondContact OD1-N 2.61Å; N23-C26 VanDerWaalsContact OD1-N 3.14Å; C26-T319 HydrophobicContact CB-CG2 4.06Å; C26-T319 WeakPolarHBondContact CB-OG1 3Å; C26-T319 PolarHBondContact SG-OG1 2.93Å; C26-S321 WeakPolarHBondContact O-CB 3.46Å; C26-S321 PolarHBondContact O-OG 2.93Å
27	T	96	Very high	96.3	Very high	51 Å²	51	21.1 Å²	21.1	31%	0.313	12%	0.12	S	C	.	.	S	Bend	trans	-99.5	-11.4	174.9	64.8	0	0	0	0	113.9	N23 D25 L42 S68	N23-T27 PolarHBondContact ND2-OG1 3.16Å; N23-T27 VanDerWaalsContact ND2-OG1 3.14Å; N23-T27 PolarHBondContact OD1-N 3.27Å; D25-T27 HydrophobicContact CB-CG2 4.3Å; D25-T27 PolarHBondContact O-N 3.47Å; D25-T27 WeakPolarHBondContact OD1-CB 3.27Å; D25-T27 WeakPolarHBondContact OD1-CG2 3.44Å; D25-T27 PolarHBondContact OD1-N 3.22Å; D25-T27 VanDerWaalsContact OD1-N 3.16Å; D25-T27 PolarHBondContact OD1-OG1 3.39Å; T27-L42 WeakPolarHBondContact O-CB 3.25Å; T27-L42 PolarHBondContact O-N 2.97Å; T27-S68 PolarHBondContact OG1-OG 2.89Å; T27-S68 VanDerWaalsContact OG1-OG 3.13Å
28	S	97.1	Very high	96.5	Very high	1 Å²	1	22.8 Å²	22.8	1%	0.007	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	143.1	-176.9	-166.8	0	0	0	0	111.9	N23 F40 R65	N23-S28 PolarHBondContact N-O 3.34Å; N23-S28 WeakPolarHBondContact ND2-CB 3.4Å; N23-S28 PolarHBondContact OD1-N 3.46Å; N23-S28 PolarHBondContact OD1-O 3.44Å; S28-F40 WeakPolarHBondContact CA-O 3.46Å; S28-F40 WeakPolarHBondContact CB-O 3.38Å; S28-F40 PolarHBondContact OG-O 2.68Å; S28-R65 PolarHBondContact OG-NH1 2.9Å
29	L	98.2	Very high	96.7	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	121.5	173.8	172.6	62.3	0	0	0	109	F20 S21 F22 I31 F40 L42 A332 L338 L359	F20-L29 HydrophobicContact CB-CD1 4.44Å; S21-L29 WeakPolarHBondContact O-CD1 3.15Å; F22-L29 HydrophobicContact CD1-CB 4.15Å; F22-L29 HydrophobicContact CD1-CD1 4Å; F22-L29 HydrophobicContact CE1-CB 4.15Å; F22-L29 HydrophobicContact CE1-CD1 3.94Å; F22-L29 HydrophobicContact CE1-CD2 4.44Å; F22-L29 HydrophobicContact CE1-CG 4.4Å; F22-L29 HydrophobicContact CZ-CD1 4.48Å; L29-I31 HydrophobicContact CD1-CG2 4.46Å; L29-I31 HydrophobicContact CG-CG2 4.2Å; L29-F40 PolarHBondContact N-O 2.91Å; L29-F40 PolarHBondContact O-N 2.79Å; L29-L42 HydrophobicContact CB-CD1 4.19Å; L29-L42 HydrophobicContact CB-CD2 4.05Å; L29-L42 HydrophobicContact CB-CG 4.39Å; L29-A332 HydrophobicContact CD1-CB 4.16Å; L29-A332 HydrophobicContact CD2-CB 4.3Å; L29-L338 HydrophobicContact CD2-CB 4.46Å; L29-L338 HydrophobicContact CD2-CD1 4.44Å; L29-L338 HydrophobicContact CD2-CD2 4.09Å; L29-L359 HydrophobicContact CD2-CD1 3.99Å; L29-L359 HydrophobicContact CD2-CD2 3.61Å; L29-L359 HydrophobicContact CD2-CG 4.47Å
30	A	98.1	Very high	96.8	Very high	3 Å²	3	21.2 Å²	21.2	3%	0.025	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	142.4	170.6	0	0	0	0	0	110	F20 S21 L39 V63	F20-A30 CarbonylContact C-O 3.4Å; F20-A30 VanDerWaalsContact CA-O 3.24Å; F20-A30 WeakPolarHBondContact CA-O 3.49Å; S21-A30 PolarHBondContact N-O 3.42Å; S21-A30 PolarHBondContact O-N 3.18Å; A30-L39 HydrophobicContact CB-CD2 3.44Å; A30-L39 VanDerWaalsContact CB-CD2 3.44Å; A30-V63 HydrophobicContact CB-CG1 3.77Å; A30-V63 HydrophobicContact CB-CG2 4.09Å
31	I	97.9	Very high	96.7	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	145.5	173	68.5	161.4	0	0	0	111.8	L17 C19 F20 L29 T33 Y37 K38 F40 L359	L17-I31 HydrophobicContact CD2-CB 3.84Å; L17-I31 HydrophobicContact CD2-CD1 3.69Å; L17-I31 HydrophobicContact CD2-CG1 4.34Å; L17-I31 HydrophobicContact CD2-CG2 4.16Å; C19-I31 WeakPolarHBondContact O-CA 3.32Å; F20-I31 HydrophobicContact CB-CG2 3.91Å; L29-I31 HydrophobicContact CD1-CG2 4.46Å; L29-I31 HydrophobicContact CG-CG2 4.2Å; I31-T33 HydrophobicContact CD1-CG2 4.44Å; I31-Y37 CarbonylContact O-C 3.56Å; I31-Y37 WeakPolarHBondContact O-CA 3.45Å; I31-Y37 VanDerWaalsContact O-CB 3.29Å; I31-Y37 WeakPolarHBondContact O-CB 3.15Å; I31-K38 HydrophobicContact CD1-CB 4.22Å; I31-K38 HydrophobicContact CD1-CD 4.24Å; I31-K38 HydrophobicContact CG1-CB 3.79Å; I31-K38 PolarHBondContact N-O 2.65Å; I31-K38 PolarHBondContact O-N 2.84Å; I31-F40 HydrophobicContact CD1-CE2 3.84Å; I31-F40 HydrophobicContact CD1-CZ 4.5Å; I31-F40 HydrophobicContact CG1-CE2 3.94Å; I31-L359 HydrophobicContact CD1-CB 4.23Å; I31-L359 WeakPolarHBondContact CD1-O 3.48Å; I31-L359 HydrophobicContact CG2-CD1 4.36Å
32	G	97.1	Very high	96.7	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	143.2	172.4	0	0	0	0	0	111.5	S18 C19 V60	S18-G32 PolarHBondContact N-O 2.94Å; C19-G32 PolarHBondContact N-O 2.76Å; C19-G32 VanDerWaalsContact N-O 3.15Å; C19-G32 PolarHBondContact O-N 2.94Å; C19-G32 VanDerWaalsContact SG-CA 3.56Å; G32-V60 CarbonylContact C-O 3.55Å
33	T	96.1	Very high	96.4	Very high	13 Å²	13	23.7 Å²	23.7	8%	0.08	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	174.8	-174.7	67.9	0	0	0	0	110	L17 I31 A35 G36 V60 L360	L17-T33 HydrophobicContact CD2-CG2 4.17Å; I31-T33 HydrophobicContact CD1-CG2 4.44Å; T33-A35 PolarHBondContact O-N 3.22Å; T33-A35 PolarHBondContact OG1-N 3.07Å; T33-G36 PolarHBondContact N-O 3.05Å; T33-G36 PolarHBondContact O-N 3.44Å; T33-G36 PolarHBondContact OG1-N 3.03Å; T33-G36 PolarHBondContact OG1-O 2.73Å; T33-V60 PolarHBondContact O-N 3.06Å; T33-V60 VanDerWaalsContact O-N 3.08Å; T33-L360 HydrophobicContact CG2-CD2 4.15Å
34	K	94.3	Very high	96.2	Very high	119 Å²	119	24.5 Å²	24.5	52%	0.517	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-33.8	169.3	-64.2	-171.1	176.1	178.6	0	113.6	P58 D59	K34-P58 WeakPolarHBondContact O-CA 3.46Å; K34-P58 WeakPolarHBondContact O-CB 3.32Å; K34-D59 WeakPolarHBondContact CA-OD1 3.36Å; K34-D59 WeakPolarHBondContact CG-OD1 3.47Å; K34-D59 PolarHBondContact O-N 2.99Å
35	A	93.9	Very high	96	Very high	50 Å²	50	23.5 Å²	23.5	41%	0.413	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-20.7	-176.4	0	0	0	0	0	114.1	T33 N55	T33-A35 PolarHBondContact O-N 3.22Å; T33-A35 PolarHBondContact OG1-N 3.07Å; A35-N55 VanDerWaalsContact O-CA 3.26Å; A35-N55 WeakPolarHBondContact O-CA 3.5Å; A35-N55 VanDerWaalsContact O-CB 3.25Å; A35-N55 WeakPolarHBondContact O-CB 3.36Å
36	G	95.2	Very high	96	Very high	1 Å²	1	27 Å²	27	1%	0.01	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	150.5	-161.7	-167.2	0	0	0	0	0	113	T33 S54 I57	T33-G36 PolarHBondContact N-O 3.05Å; T33-G36 PolarHBondContact O-N 3.44Å; T33-G36 PolarHBondContact OG1-N 3.03Å; T33-G36 PolarHBondContact OG1-O 2.73Å; G36-S54 VanDerWaalsContact CA-O 3.27Å; G36-S54 WeakPolarHBondContact CA-O 3.4Å; G36-I57 WeakPolarHBondContact CA-O 3.49Å
37	Y	96.8	Very high	95.8	Very high	7 Å²	7	32.6 Å²	32.6	3%	0.027	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	153.1	176.3	72.3	-82.8	0	0	0	112.4	I31 L39 H52 G53 S54 V60 V63 V72 V74	I31-Y37 CarbonylContact O-C 3.56Å; I31-Y37 WeakPolarHBondContact O-CA 3.45Å; I31-Y37 VanDerWaalsContact O-CB 3.29Å; I31-Y37 WeakPolarHBondContact O-CB 3.15Å; Y37-L39 HydrophobicContact CD2-CD2 4.37Å; Y37-L39 HydrophobicContact CD2-CG 4.36Å; Y37-L39 HydrophobicContact CE2-CG 4.38Å; Y37-H52 AromaticContact CE2-CD2 3.82Å; Y37-H52 AromaticContact CZ-NE2 3.97Å; Y37-H52 PolarHBondContact OH-NE2 3.36Å; Y37-G53 CarbonylContact O-C 3.46Å; Y37-G53 WeakPolarHBondContact O-CA 3.06Å; Y37-S54 PolarHBondContact N-O 2.73Å; Y37-S54 PolarHBondContact O-N 3.04Å; Y37-V60 HydrophobicContact CD1-CG2 4.36Å; Y37-V63 HydrophobicContact CD2-CG2 3.81Å; Y37-V63 HydrophobicContact CE2-CG2 4.47Å; Y37-V63 HydrophobicContact CG-CG2 4.23Å; Y37-V72 HydrophobicContact CE2-CG1 4.16Å; Y37-V72 HydrophobicContact CE2-CG2 3.99Å; Y37-V74 HydrophobicContact CD1-CG1 4.42Å; Y37-V74 HydrophobicContact CD1-CG2 4.23Å; Y37-V74 HydrophobicContact CE1-CG2 3.94Å; Y37-V74 HydrophobicContact CE2-CG2 4.5Å
38	K	97.3	Very high	95.7	Very high	55 Å²	55	31.6 Å²	31.6	24%	0.239	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	146.9	174.9	-59.8	175.7	179.2	179.1	0	110	I31 F40 Q50 L360	I31-K38 HydrophobicContact CD1-CB 4.22Å; I31-K38 HydrophobicContact CD1-CD 4.24Å; I31-K38 HydrophobicContact CG1-CB 3.79Å; I31-K38 PolarHBondContact N-O 2.65Å; I31-K38 PolarHBondContact O-N 2.84Å; K38-F40 HydrophobicContact CB-CE2 3.93Å; K38-F40 HydrophobicContact CB-CZ 4.08Å; K38-F40 HydrophobicContact CD-CE2 4.42Å; K38-F40 HydrophobicContact CD-CZ 3.91Å; K38-Q50 VanDerWaalsContact CD-OE1 3.3Å; K38-L360 PolarHBondContact NZ-O 2.85Å
39	L	97.6	Very high	95.5	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	126.4	175.4	-55.7	-179.4	0	0	0	108.6	A30 Y37 Q50 V51 H52 V63 V72 F88	A30-L39 HydrophobicContact CB-CD2 3.44Å; A30-L39 VanDerWaalsContact CB-CD2 3.44Å; Y37-L39 HydrophobicContact CD2-CD2 4.37Å; Y37-L39 HydrophobicContact CD2-CG 4.36Å; Y37-L39 HydrophobicContact CE2-CG 4.38Å; L39-Q50 CarbonylContact O-C 3.55Å; L39-V51 HydrophobicContact CB-CB 4.45Å; L39-V51 PolarHBondContact O-N 3.15Å; L39-H52 HydrophobicContact CD1-CB 4.28Å; L39-H52 PolarHBondContact N-O 3.17Å; L39-H52 PolarHBondContact O-N 3.38Å; L39-V63 HydrophobicContact CD2-CG2 4.07Å; L39-V72 HydrophobicContact CD1-CB 4.49Å; L39-V72 HydrophobicContact CD1-CG2 4.36Å; L39-V72 HydrophobicContact CD2-CG2 4.44Å; L39-F88 HydrophobicContact CD1-CD1 3.95Å; L39-F88 HydrophobicContact CD1-CE1 3.61Å; L39-F88 HydrophobicContact CD1-CZ 4.24Å
40	F	97.7	Very high	95.3	Very high	13 Å²	13	40.2 Å²	40.2	6%	0.057	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	150.5	-179.8	-61.3	-80.5	0	0	0	112.2	S28 L29 I31 K38 L48 D49 Q50 L359	S28-F40 WeakPolarHBondContact CA-O 3.46Å; S28-F40 WeakPolarHBondContact CB-O 3.38Å; S28-F40 PolarHBondContact OG-O 2.68Å; L29-F40 PolarHBondContact N-O 2.91Å; L29-F40 PolarHBondContact O-N 2.79Å; I31-F40 HydrophobicContact CD1-CE2 3.84Å; I31-F40 HydrophobicContact CD1-CZ 4.5Å; I31-F40 HydrophobicContact CG1-CE2 3.94Å; K38-F40 HydrophobicContact CB-CE2 3.93Å; K38-F40 HydrophobicContact CB-CZ 4.08Å; K38-F40 HydrophobicContact CD-CE2 4.42Å; K38-F40 HydrophobicContact CD-CZ 3.91Å; F40-L48 HydrophobicContact CB-CD1 3.93Å; F40-L48 HydrophobicContact CB-CD2 4.47Å; F40-L48 HydrophobicContact CB-CG 4Å; F40-L48 HydrophobicContact CD1-CD2 3.94Å; F40-L48 HydrophobicContact CD1-CG 3.78Å; F40-L48 HydrophobicContact CE1-CD2 4.25Å; F40-L48 HydrophobicContact CE1-CG 4.48Å; F40-L48 HydrophobicContact CG-CD1 4.41Å; F40-L48 HydrophobicContact CG-CD2 4.07Å; F40-L48 HydrophobicContact CG-CG 4Å; F40-D49 CarbonylContact C-O 3.59Å; F40-D49 VanDerWaalsContact CA-O 3.29Å; F40-D49 WeakPolarHBondContact CA-O 3.32Å; F40-Q50 HydrophobicContact CD1-CB 4.01Å; F40-Q50 HydrophobicContact CD1-CG 4.3Å; F40-Q50 HydrophobicContact CE1-CB 3.93Å; F40-Q50 HydrophobicContact CE1-CG 4.07Å; F40-L359 HydrophobicContact CD2-CD2 4.43Å; F40-L359 HydrophobicContact CE2-CD2 4.31Å; F40-L359 WeakPolarHBondContact CZ-O 3.42Å
41	S	96.5	Very high	95.2	Very high	27 Å²	27	43 Å²	43	19%	0.189	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	143	168.7	-169.1	0	0	0	0	110.7	S43 D49	S41-S43 PolarHBondContact OG-OG 3.35Å; S41-D49 PolarHBondContact N-O 2.8Å
42	L	95.6	Very high	95.1	Very high	7 Å²	7	45.1 Å²	45.1	4%	0.037	24%	0.239	C	C	.	.			trans	-110.2	24.3	177.5	-54	173.4	0	0	0	111.5	F22 T27 L29 S44 L48 I323 L330 L338	F22-L42 HydrophobicContact CD1-CD1 3.66Å; F22-L42 HydrophobicContact CE1-CD1 3.73Å; T27-L42 WeakPolarHBondContact O-CB 3.25Å; T27-L42 PolarHBondContact O-N 2.97Å; L29-L42 HydrophobicContact CB-CD1 4.19Å; L29-L42 HydrophobicContact CB-CD2 4.05Å; L29-L42 HydrophobicContact CB-CG 4.39Å; L42-S44 VanDerWaalsContact C-N 3.29Å; L42-S44 PolarHBondContact O-N 3.2Å; L42-L48 HydrophobicContact CD2-CD1 3.84Å; L42-I323 VanDerWaalsContact O-CD1 3.29Å; L42-I323 WeakPolarHBondContact O-CD1 3.04Å; L42-L330 HydrophobicContact CB-CD2 4.17Å; L42-L330 HydrophobicContact CD1-CD2 3.81Å; L42-L330 HydrophobicContact CD2-CD2 4Å; L42-L330 HydrophobicContact CG-CD2 4.21Å; L42-L338 HydrophobicContact CD2-CD2 3.81Å
43	S	92.4	Very high	95	Very high	75 Å²	75	46.4 Å²	46.4	52%	0.524	25%	0.253	S	S	.	.	S	Bend	trans	-71.4	-15.9	-178	43.4	0	0	0	0	114.8	S41	S41-S43 PolarHBondContact OG-OG 3.35Å
44	S	93.7	Very high	94.9	Very high	25 Å²	25	46.3 Å²	46.3	18%	0.175	25%	0.253	C	S	.	.			trans	-134.5	153.2	-176.8	-175	0	0	0	0	110.8	L42 E46	L42-S44 VanDerWaalsContact C-N 3.29Å; L42-S44 PolarHBondContact O-N 3.2Å; S44-E46 PolarHBondContact OG-N 2.86Å
45	V	93.9	Very high	94.8	Very high	4 Å²	4	46.2 Å²	46.2	2%	0.024	26%	0.258	C	S	.	.	S	Bend	trans	-84.5	-35.6	169.4	-177.7	0	0	0	0	110.6	I323 I340 I354 K355 H357	V45-I323 HydrophobicContact CG2-CB 4.33Å; V45-I323 HydrophobicContact CG2-CG2 3.79Å; V45-I340 HydrophobicContact CG1-CD1 4.35Å; V45-I340 HydrophobicContact CG1-CG2 4.24Å; V45-I354 HydrophobicContact CG1-CB 4.31Å; V45-I354 HydrophobicContact CG1-CG2 3.83Å; V45-K355 HydrophobicContact CG1-CB 3.95Å; V45-K355 WeakPolarHBondContact O-CG 3.18Å; V45-H357 PolarHBondContact O-NE2 3.13Å
46	E	94.2	Very high	94.6	Very high	106 Å²	106	51.9 Å²	51.9	50%	0.495	28%	0.276	S	S	.	.	S	Bend	trans	-84.6	-26.6	-170.5	-68	-54.7	138.3	0	0	114.4	S44 K355 H357	S44-E46 PolarHBondContact OG-N 2.86Å; E46-K355 IonicContact OE2-NZ 2.68Å; E46-K355 PolarHBondContact OE2-NZ 3.31Å; E46-H357 PolarHBondContact O-CE1 2.93Å
47	Q	91.4	Very high	94.4	Very high	128 Å²	128	52.9 Å²	52.9	60%	0.598	28%	0.28	S	S	*	.			trans	-131	139.9	-175.8	-71.1	174.7	-39.6	0	0	110
48	L	94.2	Very high	94.2	Very high	29 Å²	29	55.4 Å²	55.4	15%	0.152	30%	0.298	C	S	.	.			trans	-116	83.2	179.8	-174.5	72.9	0	0	0	109.4	F40 L42 Q50 L338 H357 L359	F40-L48 HydrophobicContact CB-CD1 3.93Å; F40-L48 HydrophobicContact CB-CD2 4.47Å; F40-L48 HydrophobicContact CB-CG 4Å; F40-L48 HydrophobicContact CD1-CD2 3.94Å; F40-L48 HydrophobicContact CD1-CG 3.78Å; F40-L48 HydrophobicContact CE1-CD2 4.25Å; F40-L48 HydrophobicContact CE1-CG 4.48Å; F40-L48 HydrophobicContact CG-CD1 4.41Å; F40-L48 HydrophobicContact CG-CD2 4.07Å; F40-L48 HydrophobicContact CG-CG 4Å; L42-L48 HydrophobicContact CD2-CD1 3.84Å; L48-Q50 PolarHBondContact O-N 3.32Å; L48-L338 HydrophobicContact CD1-CD2 3.79Å; L48-L338 HydrophobicContact CD2-CD2 4.44Å; L48-H357 HydrophobicContact CB-CB 4.46Å; L48-H357 HydrophobicContact CD2-CB 3.93Å; L48-L359 HydrophobicContact CD2-CD2 3.56Å
49	D	93.3	Very high	94.1	Very high	79 Å²	79	55.2 Å²	55.2	42%	0.422	30%	0.299	S	S	.	.			trans	-70.9	124	-171.2	-56.6	-48.1	0	0	0	111.7	F40 S41 V51	F40-D49 CarbonylContact C-O 3.59Å; F40-D49 VanDerWaalsContact CA-O 3.29Å; F40-D49 WeakPolarHBondContact CA-O 3.32Å; S41-D49 PolarHBondContact N-O 2.8Å; D49-V51 PolarHBondContact O-N 3.32Å
50	Q	95.3	Very high	94.1	Very high	103 Å²	103	55.2 Å²	55.2	48%	0.481	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	105.6	174	-167	-170.7	-88.4	0	0	109.9	K38 L39 F40 L48 H52	K38-Q50 VanDerWaalsContact CD-OE1 3.3Å; L39-Q50 CarbonylContact O-C 3.55Å; F40-Q50 HydrophobicContact CD1-CB 4.01Å; F40-Q50 HydrophobicContact CD1-CG 4.3Å; F40-Q50 HydrophobicContact CE1-CB 3.93Å; F40-Q50 HydrophobicContact CE1-CG 4.07Å; L48-Q50 PolarHBondContact O-N 3.32Å; Q50-H52 WeakPolarHBondContact CG-O 3.09Å
51	V	95.4	Very high	94	Very high	61 Å²	61	56.6 Å²	56.6	37%	0.37	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	-38.8	178.8	178.3	0	0	0	0	111.6	L39 D49 F88	L39-V51 HydrophobicContact CB-CB 4.45Å; L39-V51 PolarHBondContact O-N 3.15Å; D49-V51 PolarHBondContact O-N 3.32Å; V51-F88 HydrophobicContact CG1-CE2 4.23Å; V51-F88 HydrophobicContact CG1-CZ 4.03Å
52	H	96.3	Very high	94.1	Very high	45 Å²	45	55.8 Å²	55.8	21%	0.208	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.6	159.6	177.2	179	65.9	0	0	0	110.4	Y37 L39 Q50 F88	Y37-H52 AromaticContact CE2-CD2 3.82Å; Y37-H52 AromaticContact CZ-NE2 3.97Å; Y37-H52 PolarHBondContact OH-NE2 3.36Å; L39-H52 HydrophobicContact CD1-CB 4.28Å; L39-H52 PolarHBondContact N-O 3.17Å; L39-H52 PolarHBondContact O-N 3.38Å; Q50-H52 WeakPolarHBondContact CG-O 3.09Å; H52-F88 HydrophobicContact CB-CD2 3.66Å; H52-F88 HydrophobicContact CB-CE2 3.79Å; H52-F88 HydrophobicContact CB-CG 4.12Å; H52-F88 HydrophobicContact CB-CZ 4.32Å; H52-F88 AromaticContact CD2-CG 3.88Å; H52-F88 AromaticContact CG-CD2 3.62Å; H52-F88 AromaticContact CG-CG 3.79Å; H52-F88 AromaticContact ND1-CD2 3.92Å
53	G	94.6	Very high	94.2	Very high	28 Å²	28	55.5 Å²	55.5	29%	0.289	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	147.8	161.6	0	0	0	0	0	110.3	Y37	Y37-G53 CarbonylContact O-C 3.46Å; Y37-G53 WeakPolarHBondContact O-CA 3.06Å
54	S	93.2	Very high	94.5	Very high	11 Å²	11	52.9 Å²	52.9	8%	0.077	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	137.2	174.6	173.4	0	0	0	0	110.7	G36 Y37 E56	G36-S54 VanDerWaalsContact CA-O 3.27Å; G36-S54 WeakPolarHBondContact CA-O 3.4Å; Y37-S54 PolarHBondContact N-O 2.73Å; Y37-S54 PolarHBondContact O-N 3.04Å; S54-E56 WeakPolarHBondContact OG-CB 3.42Å; S54-E56 WeakPolarHBondContact OG-CG 3.41Å; S54-E56 PolarHBondContact OG-N 3.06Å; S54-E56 VanDerWaalsContact OG-N 3.17Å; S54-E56 PolarHBondContact OG-OE2 3.33Å
55	N	92.6	Very high	94.7	Very high	116 Å²	116	52.4 Å²	52.4	62%	0.62	27%	0.27	S	S	*	.			trans	-106.3	9	176	-62.5	-3.7	0	0	0	111.8	A35 I57	A35-N55 VanDerWaalsContact O-CA 3.26Å; A35-N55 WeakPolarHBondContact O-CA 3.5Å; A35-N55 VanDerWaalsContact O-CB 3.25Å; A35-N55 WeakPolarHBondContact O-CB 3.36Å; N55-I57 PolarHBondContact O-N 2.8Å
56	E	89.9	Confident	94.9	Very high	169 Å²	169	52.8 Å²	52.8	79%	0.79	27%	0.272	S	S	*	.	S	Bend	trans	-69.2	-23.1	178.8	-62.1	163.1	139.9	0	0	112	S54	S54-E56 WeakPolarHBondContact OG-CB 3.42Å; S54-E56 WeakPolarHBondContact OG-CG 3.41Å; S54-E56 PolarHBondContact OG-N 3.06Å; S54-E56 VanDerWaalsContact OG-N 3.17Å; S54-E56 PolarHBondContact OG-OE2 3.33Å
57	I	89.8	Confident	95	Very high	22 Å²	22	48.7 Å²	48.7	11%	0.113	25%	0.253	C	S	.	.	S	Bend	trans	-119.1	96	-179.6	-52.3	170.9	0	0	0	107.4	G36 N55 V60 V74 Y86	G36-I57 WeakPolarHBondContact CA-O 3.49Å; N55-I57 PolarHBondContact O-N 2.8Å; I57-V60 HydrophobicContact CB-CG2 4.4Å; I57-V60 HydrophobicContact CG2-CG2 4.07Å; I57-V60 VanDerWaalsContact O-CG2 3.24Å; I57-V60 WeakPolarHBondContact O-CG2 3.26Å; I57-V74 HydrophobicContact CD1-CB 4.31Å; I57-V74 HydrophobicContact CD1-CG1 4.03Å; I57-V74 HydrophobicContact CG2-CG1 4.06Å; I57-Y86 HydrophobicContact CD1-CD2 4.28Å; I57-Y86 HydrophobicContact CD1-CE2 3.36Å; I57-Y86 WeakPolarHBondContact CD1-OH 3.45Å
58	P	93.6	Very high	95.1	Very high	60 Å²	60	45.7 Å²	45.7	39%	0.39	25%	0.246	S	C	.	.			trans	-73.6	166.7	175.5	30	-35	0	0	0	112.3	K34 V60 S76	K34-P58 WeakPolarHBondContact O-CA 3.46Å; K34-P58 WeakPolarHBondContact O-CB 3.32Å; P58-V60 PolarHBondContact O-N 2.82Å; P58-S76 VanDerWaalsContact O-CB 3.28Å; P58-S76 WeakPolarHBondContact O-CB 3.45Å
59	D	95.3	Very high	95.2	Very high	51 Å²	51	45.5 Å²	45.5	27%	0.273	25%	0.247	S	C	.	.	S	Bend	trans	53.6	47	176.9	-61.5	-49.8	0	0	0	115.2	K34 Y61 S76 H77	K34-D59 WeakPolarHBondContact CA-OD1 3.36Å; K34-D59 WeakPolarHBondContact CG-OD1 3.47Å; K34-D59 PolarHBondContact O-N 2.99Å; D59-Y61 PolarHBondContact O-N 2.79Å; D59-S76 CarbonylContact O-C 3.56Å; D59-S76 WeakPolarHBondContact O-CA 3.5Å; D59-H77 HydrophobicContact CB-CB 4.09Å; D59-H77 PolarHBondContact O-N 2.87Å
60	V	97.2	Very high	95.4	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	120.4	-179.6	178.4	0	0	0	0	111.6	S18 G32 T33 Y37 I57 P58 I62 V63 V74	S18-V60 WeakPolarHBondContact CB-O 3.22Å; G32-V60 CarbonylContact C-O 3.55Å; T33-V60 PolarHBondContact O-N 3.06Å; T33-V60 VanDerWaalsContact O-N 3.08Å; Y37-V60 HydrophobicContact CD1-CG2 4.36Å; I57-V60 HydrophobicContact CB-CG2 4.4Å; I57-V60 HydrophobicContact CG2-CG2 4.07Å; I57-V60 VanDerWaalsContact O-CG2 3.24Å; I57-V60 WeakPolarHBondContact O-CG2 3.26Å; P58-V60 PolarHBondContact O-N 2.82Å; V60-I62 WeakPolarHBondContact CG1-O 3.5Å; V60-V63 HydrophobicContact CG1-CB 4.09Å; V60-V74 HydrophobicContact CB-CG1 4.45Å; V60-V74 HydrophobicContact CG1-CG1 3.83Å; V60-V74 HydrophobicContact CG2-CG1 3.76Å
61	Y	96.7	Very high	95.5	Very high	42 Å²	42	37 Å²	37	17%	0.165	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	-7.3	177.3	82.4	-87	0	0	0	114.5	C19 D59 V75 H77 P80 I103	C19-Y61 WeakPolarHBondContact CB-O 3.38Å; C19-Y61 PolarHBondContact SG-O 2.82Å; C19-Y61 VanDerWaalsContact SG-O 3.37Å; D59-Y61 PolarHBondContact O-N 2.79Å; Y61-V75 HydrophobicContact CE1-CB 4.22Å; Y61-V75 HydrophobicContact CE1-CG1 3.67Å; Y61-V75 PolarHBondContact N-O 2.91Å; Y61-H77 VanDerWaalsContact CB-CE1 3.47Å; Y61-H77 WeakPolarHBondContact CB-CE1 3.38Å; Y61-H77 WeakPolarHBondContact CB-NE2 3.25Å; Y61-H77 HydrophobicContact CD1-CB 4.48Å; Y61-H77 AromaticContact CD1-CE1 3.74Å; Y61-H77 AromaticContact CD1-CG 3.79Å; Y61-H77 AromaticContact CD1-ND1 3.44Å; Y61-H77 WeakPolarHBondContact CD1-ND1 3.43Å; Y61-H77 AromaticContact CE1-ND1 4Å; Y61-H77 AromaticContact CG-CE1 3.53Å; Y61-H77 AromaticContact CG-ND1 3.74Å; Y61-H77 AromaticContact CG-NE2 3.99Å; Y61-P80 HydrophobicContact CE1-CB 3.94Å; Y61-P80 WeakPolarHBondContact OH-CB 3.38Å; Y61-P80 PolarHBondContact OH-O 3.47Å; Y61-I103 WeakPolarHBondContact CE2-O 3.38Å; Y61-I103 PolarHBondContact OH-O 3.38Å
62	I	98.3	Very high	95.6	Very high	11 Å²	11	34.1 Å²	34.1	6%	0.056	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	124.4	160.6	-57.2	174.3	0	0	0	107.5	V60 E64 V74 V75 I103 I106	V60-I62 WeakPolarHBondContact CG1-O 3.5Å; I62-E64 HydrophobicContact CG2-CG 3.95Å; I62-V74 WeakPolarHBondContact O-CA 3.3Å; I62-V75 HydrophobicContact CB-CB 3.99Å; I62-V75 HydrophobicContact CB-CG2 4.02Å; I62-V75 HydrophobicContact CD1-CB 4.36Å; I62-V75 HydrophobicContact CD1-CG2 4.18Å; I62-V75 HydrophobicContact CG1-CB 4.4Å; I62-V75 PolarHBondContact N-O 3.3Å; I62-V75 PolarHBondContact O-N 3.37Å; I62-I103 HydrophobicContact CD1-CB 4.33Å; I62-I103 HydrophobicContact CD1-CG2 3.69Å; I62-I106 HydrophobicContact CG2-CB 4.26Å; I62-I106 HydrophobicContact CG2-CD1 4.23Å; I62-I106 HydrophobicContact CG2-CG1 4.27Å
63	V	98.1	Very high	95.7	Very high	1 Å²	1	32 Å²	32	1%	0.006	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	127.9	161.7	57.5	0	0	0	0	108.1	S21 A30 Y37 L39 V60 V72 V73	S21-V63 PolarHBondContact OG-O 2.87Å; A30-V63 HydrophobicContact CB-CG1 3.77Å; A30-V63 HydrophobicContact CB-CG2 4.09Å; Y37-V63 HydrophobicContact CD2-CG2 3.81Å; Y37-V63 HydrophobicContact CE2-CG2 4.47Å; Y37-V63 HydrophobicContact CG-CG2 4.23Å; L39-V63 HydrophobicContact CD2-CG2 4.07Å; V60-V63 HydrophobicContact CG1-CB 4.09Å; V63-V72 HydrophobicContact CG2-CG2 3.6Å; V63-V73 WeakPolarHBondContact CA-O 3.08Å
64	E	98.1	Very high	95.9	Very high	19 Å²	19	30.7 Å²	30.7	9%	0.089	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	126.9	-179.5	-70.7	-67.5	171.8	0	0	109.3	I62 V72 V73 I106 R107 L108	I62-E64 HydrophobicContact CG2-CG 3.95Å; E64-V72 WeakPolarHBondContact O-CA 3.47Å; E64-V73 PolarHBondContact N-O 2.98Å; E64-V73 PolarHBondContact O-N 2.79Å; E64-I106 HydrophobicContact CG-CB 4.24Å; E64-I106 HydrophobicContact CG-CG2 4.47Å; E64-R107 IonicContact OE1-CZ 2.62Å; E64-R107 IonicContact OE1-NH1 3.21Å; E64-R107 PolarHBondContact OE1-NH1 2.8Å; E64-R107 IonicContact OE2-NH1 3.65Å; E64-L108 HydrophobicContact CB-CD1 3.93Å
65	R	97.4	Very high	96.1	Very high	15 Å²	15	30.1 Å²	30.1	6%	0.057	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	145.4	179	-168.1	-176.2	-177.5	-174.3	-2.3	109.8	Q24 S28 F67 S68 S69	Q24-R65 PolarHBondContact NE2-O 3.32Å; Q24-R65 PolarHBondContact OE1-O 2.97Å; Q24-R65 VanDerWaalsContact OE1-O 3.09Å; S28-R65 PolarHBondContact OG-NH1 2.9Å; R65-F67 WeakPolarHBondContact CD-O 3.33Å; R65-F67 WeakPolarHBondContact CG-O 3.19Å; R65-F67 PolarHBondContact O-N 2.98Å; R65-S68 VanDerWaalsContact NH2-C 3.28Å; R65-S68 PolarHBondContact NH2-O 3.09Å; R65-S69 PolarHBondContact NE-O 2.83Å; R65-S69 PolarHBondContact NH2-O 2.72Å
66	L	97.8	Very high	96.4	Very high	13 Å²	13	24.8 Å²	24.8	7%	0.068	13%	0.132	C	C	.	.			trans	-89.2	99.8	170.4	-179.6	68.4	0	0	0	110	S68 S69 L71 L108 N109 I126	L66-S68 PolarHBondContact O-N 2.87Å; L66-S69 VanDerWaalsContact O-CB 3.25Å; L66-S69 WeakPolarHBondContact O-CB 3.48Å; L66-S69 PolarHBondContact O-N 3.48Å; L66-S69 PolarHBondContact O-OG 3.13Å; L66-L71 HydrophobicContact CB-CB 4.25Å; L66-L71 HydrophobicContact CB-CD2 4.18Å; L66-L71 HydrophobicContact CD2-CB 4.49Å; L66-L71 HydrophobicContact CD2-CD1 4.21Å; L66-L71 PolarHBondContact N-O 3.24Å; L66-L71 VanDerWaalsContact N-O 3.09Å; L66-L108 HydrophobicContact CB-CD1 4.44Å; L66-L108 HydrophobicContact CD1-CB 4.08Å; L66-N109 WeakPolarHBondContact CD1-O 3.36Å; L66-I126 HydrophobicContact CD2-CD1 4.43Å; L66-I126 HydrophobicContact CD2-CG1 3.91Å
67	F	96.8	Very high	96.7	Very high	20 Å²	20	21.9 Å²	21.9	9%	0.088	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.4	-132.9	-177.5	-63.4	-98.9	0	0	0	110.9	N23 Q24 D25 R65 R110 I150	N23-F67 VanDerWaalsContact ND2-C 3.27Å; N23-F67 PolarHBondContact ND2-O 3.48Å; Q24-F67 HydrophobicContact CB-CD1 3.85Å; Q24-F67 HydrophobicContact CB-CD2 4.35Å; Q24-F67 HydrophobicContact CB-CE1 3.51Å; Q24-F67 HydrophobicContact CB-CE2 4.03Å; Q24-F67 HydrophobicContact CB-CG 4.25Å; Q24-F67 HydrophobicContact CB-CZ 3.61Å; Q24-F67 HydrophobicContact CG-CD2 4.31Å; Q24-F67 HydrophobicContact CG-CE1 4.31Å; Q24-F67 HydrophobicContact CG-CE2 3.92Å; Q24-F67 HydrophobicContact CG-CZ 3.93Å; D25-F67 HydrophobicContact CB-CD1 4.06Å; D25-F67 WeakPolarHBondContact OD2-CD1 3.5Å; R65-F67 WeakPolarHBondContact CD-O 3.33Å; R65-F67 WeakPolarHBondContact CG-O 3.19Å; R65-F67 PolarHBondContact O-N 2.98Å; F67-R110 HydrophobicContact CD2-CG 3.94Å; F67-R110 HydrophobicContact CE2-CG 3.56Å; F67-R110 HydrophobicContact CZ-CG 4.16Å; F67-I150 HydrophobicContact CZ-CB 4.21Å
68	S	94.4	Very high	97	Very high	65 Å²	65	24.9 Å²	24.9	46%	0.455	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	14.2	170.6	-53.5	0	0	0	0	114.3	T27 R65 L66	T27-S68 PolarHBondContact OG1-OG 2.89Å; T27-S68 VanDerWaalsContact OG1-OG 3.13Å; R65-S68 VanDerWaalsContact NH2-C 3.28Å; R65-S68 PolarHBondContact NH2-O 3.09Å; L66-S68 PolarHBondContact O-N 2.87Å
69	S	96.2	Very high	97.1	Very high	25 Å²	25	27.3 Å²	27.3	18%	0.175	14%	0.142	C	C	.	.	S	Bend	trans	-70.8	175.8	-179.7	77.2	0	0	0	0	113.4	R65 L66 L71	R65-S69 PolarHBondContact NE-O 2.83Å; R65-S69 PolarHBondContact NH2-O 2.72Å; L66-S69 VanDerWaalsContact O-CB 3.25Å; L66-S69 WeakPolarHBondContact O-CB 3.48Å; L66-S69 PolarHBondContact O-N 3.48Å; L66-S69 PolarHBondContact O-OG 3.13Å; S69-L71 VanDerWaalsContact C-N 3.27Å; S69-L71 PolarHBondContact OG-N 2.56Å
70	S	96.6	Very high	97.2	Very high	2 Å²	2	26.5 Å²	26.5	1%	0.014	14%	0.139	C	C	.	.	S	Bend	trans	-76.2	-4.1	170.3	-63.3	0	0	0	0	115.1	H87 F88 K89 E426	S70-H87 WeakPolarHBondContact CB-CE1 3.42Å; S70-H87 WeakPolarHBondContact CB-ND1 3.49Å; S70-H87 CarbonylContact O-C 3.55Å; S70-H87 WeakPolarHBondContact O-CA 3.42Å; S70-F88 WeakPolarHBondContact O-CD1 3.33Å; S70-F88 PolarHBondContact O-N 3.14Å; S70-K89 WeakPolarHBondContact OG-CD 3.19Å; S70-K89 WeakPolarHBondContact OG-CE 3.36Å; S70-K89 WeakPolarHBondContact OG-CG 3.14Å; S70-K89 PolarHBondContact OG-NZ 3.07Å; S70-E426 WeakPolarHBondContact CB-OE2 3.39Å; S70-E426 PolarHBondContact OG-OE1 3.02Å; S70-E426 PolarHBondContact OG-OE2 2.96Å
71	L	97.7	Very high	97.3	Very high	2 Å²	2	33 Å²	33	1%	0.01	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	122	-174.3	-166.7	159.1	0	0	0	110.7	L66 S69 V73 V85 Y86 I94 M129 F429	L66-L71 HydrophobicContact CB-CB 4.25Å; L66-L71 HydrophobicContact CB-CD2 4.18Å; L66-L71 HydrophobicContact CD2-CB 4.49Å; L66-L71 HydrophobicContact CD2-CD1 4.21Å; L66-L71 PolarHBondContact N-O 3.24Å; L66-L71 VanDerWaalsContact N-O 3.09Å; S69-L71 VanDerWaalsContact C-N 3.27Å; S69-L71 PolarHBondContact OG-N 2.56Å; L71-V73 HydrophobicContact CD2-CG2 4.06Å; L71-V85 HydrophobicContact CD2-CG1 3.89Å; L71-V85 HydrophobicContact CG-CG1 4.16Å; L71-Y86 WeakPolarHBondContact CA-O 3.34Å; L71-I94 HydrophobicContact CD1-CD1 4.29Å; L71-I94 HydrophobicContact CG-CD1 4.29Å; L71-M129 HydrophobicContact CD1-CE 3.76Å; L71-F429 HydrophobicContact CD1-CE1 4.02Å; L71-F429 HydrophobicContact CD1-CZ 4.43Å
72	V	97.9	Very high	97.3	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	139.9	177.5	65.5	0	0	0	0	110.7	Y37 L39 V63 E64 V74 Y86 F88	Y37-V72 HydrophobicContact CE2-CG1 4.16Å; Y37-V72 HydrophobicContact CE2-CG2 3.99Å; L39-V72 HydrophobicContact CD1-CB 4.49Å; L39-V72 HydrophobicContact CD1-CG2 4.36Å; L39-V72 HydrophobicContact CD2-CG2 4.44Å; V63-V72 HydrophobicContact CG2-CG2 3.6Å; E64-V72 WeakPolarHBondContact O-CA 3.47Å; V72-V74 HydrophobicContact CG2-CG2 4.15Å; V72-Y86 PolarHBondContact N-O 2.93Å; V72-Y86 PolarHBondContact O-N 3.33Å; V72-F88 HydrophobicContact CB-CD1 4.37Å; V72-F88 HydrophobicContact CG1-CD1 4.09Å
73	V	98.3	Very high	97.3	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	-113	132.2	177.5	-174.1	0	0	0	0	109	V63 E64 L71 M83 N84 V85 I106 L108 L113	V63-V73 WeakPolarHBondContact CA-O 3.08Å; E64-V73 PolarHBondContact N-O 2.98Å; E64-V73 PolarHBondContact O-N 2.79Å; L71-V73 HydrophobicContact CD2-CG2 4.06Å; V73-M83 HydrophobicContact CG1-CG 3.39Å; V73-M83 HydrophobicContact CG1-SD 3.68Å; V73-N84 WeakPolarHBondContact CA-O 3.44Å; V73-V85 HydrophobicContact CG1-CG2 4.27Å; V73-V85 HydrophobicContact CG2-CG1 4.12Å; V73-V85 HydrophobicContact CG2-CG2 4.14Å; V73-I106 HydrophobicContact CG1-CD1 3.58Å; V73-I106 HydrophobicContact CG1-CG2 4.21Å; V73-L108 HydrophobicContact CB-CD1 4.49Å; V73-L108 HydrophobicContact CG2-CD1 3.81Å; V73-L108 HydrophobicContact CG2-CD2 4.08Å; V73-L113 HydrophobicContact CG2-CD1 4.25Å
74	V	98.3	Very high	97.3	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	133.6	-170.2	-173.6	0	0	0	0	111.4	Y37 I57 V60 I62 V72 N84 Y86	Y37-V74 HydrophobicContact CD1-CG1 4.42Å; Y37-V74 HydrophobicContact CD1-CG2 4.23Å; Y37-V74 HydrophobicContact CE1-CG2 3.94Å; Y37-V74 HydrophobicContact CE2-CG2 4.5Å; I57-V74 HydrophobicContact CD1-CB 4.31Å; I57-V74 HydrophobicContact CD1-CG1 4.03Å; I57-V74 HydrophobicContact CG2-CG1 4.06Å; V60-V74 HydrophobicContact CB-CG1 4.45Å; V60-V74 HydrophobicContact CG1-CG1 3.83Å; V60-V74 HydrophobicContact CG2-CG1 3.76Å; I62-V74 WeakPolarHBondContact O-CA 3.3Å; V72-V74 HydrophobicContact CG2-CG2 4.15Å; V74-N84 PolarHBondContact N-O 2.77Å; V74-N84 PolarHBondContact O-N 3.22Å; V74-N84 VanDerWaalsContact O-N 3.11Å; V74-N84 PolarHBondContact O-ND2 3.36Å; V74-N84 VanDerWaalsContact O-ND2 3.08Å; V74-Y86 HydrophobicContact CB-CD2 4.49Å; V74-Y86 HydrophobicContact CB-CE2 4.26Å; V74-Y86 HydrophobicContact CG2-CD2 4.13Å; V74-Y86 HydrophobicContact CG2-CE2 4.35Å
75	V	98.4	Very high	97.2	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	133.1	171.1	-165.4	0	0	0	0	109.9	Y61 I62 I103 I106	Y61-V75 HydrophobicContact CE1-CB 4.22Å; Y61-V75 HydrophobicContact CE1-CG1 3.67Å; Y61-V75 PolarHBondContact N-O 2.91Å; I62-V75 HydrophobicContact CB-CB 3.99Å; I62-V75 HydrophobicContact CB-CG2 4.02Å; I62-V75 HydrophobicContact CD1-CB 4.36Å; I62-V75 HydrophobicContact CD1-CG2 4.18Å; I62-V75 HydrophobicContact CG1-CB 4.4Å; I62-V75 PolarHBondContact N-O 3.3Å; I62-V75 PolarHBondContact O-N 3.37Å; V75-I103 HydrophobicContact CG1-CB 4.48Å; V75-I103 HydrophobicContact CG1-CD1 4.12Å; V75-I103 HydrophobicContact CG2-CD1 3.83Å; V75-I103 HydrophobicContact CG2-CG2 4.42Å; V75-I106 HydrophobicContact CG2-CD1 3.71Å
76	S	97.4	Very high	97.2	Very high	3 Å²	3	32.2 Å²	32.2	2%	0.021	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	152.7	-179.4	63.9	0	0	0	0	112.7	P58 D59 T78 K79 P80	P58-S76 VanDerWaalsContact O-CB 3.28Å; P58-S76 WeakPolarHBondContact O-CB 3.45Å; D59-S76 CarbonylContact O-C 3.56Å; D59-S76 WeakPolarHBondContact O-CA 3.5Å; S76-T78 WeakPolarHBondContact CB-OG1 3.49Å; S76-T78 PolarHBondContact O-N 3.02Å; S76-T78 PolarHBondContact OG-OG1 3.48Å; S76-K79 CarbonylContact O-C 3.58Å; S76-K79 PolarHBondContact O-N 2.8Å; S76-K79 PolarHBondContact OG-N 2.91Å; S76-P80 WeakPolarHBondContact O-CA 3.25Å; S76-P80 VanDerWaalsContact O-N 3.1Å
77	H	96.1	Very high	97.2	Very high	108 Å²	108	32 Å²	32	50%	0.5	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-20.5	173.4	-70.2	-59.6	0	0	0	112.6	D59 Y61 K79 P80	D59-H77 HydrophobicContact CB-CB 4.09Å; D59-H77 PolarHBondContact O-N 2.87Å; Y61-H77 VanDerWaalsContact CB-CE1 3.47Å; Y61-H77 WeakPolarHBondContact CB-CE1 3.38Å; Y61-H77 WeakPolarHBondContact CB-NE2 3.25Å; Y61-H77 HydrophobicContact CD1-CB 4.48Å; Y61-H77 AromaticContact CD1-CE1 3.74Å; Y61-H77 AromaticContact CD1-CG 3.79Å; Y61-H77 AromaticContact CD1-ND1 3.44Å; Y61-H77 WeakPolarHBondContact CD1-ND1 3.43Å; Y61-H77 AromaticContact CE1-ND1 4Å; Y61-H77 AromaticContact CG-CE1 3.53Å; Y61-H77 AromaticContact CG-ND1 3.74Å; Y61-H77 AromaticContact CG-NE2 3.99Å; H77-K79 VanDerWaalsContact C-N 3.28Å; H77-P80 WeakPolarHBondContact O-CD 3.29Å
78	T	95.9	Very high	97.1	Very high	86 Å²	86	32.2 Å²	32.2	53%	0.528	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-22.9	171.2	52	0	0	0	0	112.9	S76	S76-T78 WeakPolarHBondContact CB-OG1 3.49Å; S76-T78 PolarHBondContact O-N 3.02Å; S76-T78 PolarHBondContact OG-OG1 3.48Å
79	K	96.7	Very high	97.1	Very high	111 Å²	111	35.2 Å²	35.2	48%	0.483	17%	0.166	S	C	.	.	S	Bend	trans	-145.1	63.2	177.7	-56.8	-169.6	-168.4	167.1	0	112.1	S76 H77 R81 Q82	S76-K79 CarbonylContact O-C 3.58Å; S76-K79 PolarHBondContact O-N 2.8Å; S76-K79 PolarHBondContact OG-N 2.91Å; H77-K79 VanDerWaalsContact C-N 3.28Å; K79-R81 PolarHBondContact O-N 2.77Å; K79-Q82 HydrophobicContact CB-CB 4.08Å; K79-Q82 HydrophobicContact CD-CB 4.42Å; K79-Q82 PolarHBondContact O-N 3.17Å
80	P	97.5	Very high	97.1	Very high	33 Å²	33	39 Å²	39	21%	0.214	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-4.7	-169.4	29.6	-36.7	0	0	0	114.5	Y61 S76 H77 N102 I103	Y61-P80 HydrophobicContact CE1-CB 3.94Å; Y61-P80 WeakPolarHBondContact OH-CB 3.38Å; Y61-P80 PolarHBondContact OH-O 3.47Å; S76-P80 WeakPolarHBondContact O-CA 3.25Å; S76-P80 VanDerWaalsContact O-N 3.1Å; H77-P80 WeakPolarHBondContact O-CD 3.29Å; P80-N102 HydrophobicContact CB-CB 4.3Å; P80-N102 WeakPolarHBondContact CG-OD1 3.39Å; P80-N102 WeakPolarHBondContact O-CA 3.34Å; P80-I103 PolarHBondContact O-N 3.1Å
81	R	98.3	Very high	96.9	Very high	136 Å²	136	42.5 Å²	42.5	51%	0.513	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-2.6	176.5	-56.1	-166.8	-79	175.3	-6.3	113.5	K79 S98 Y99 S100 S101 N102	K79-R81 PolarHBondContact O-N 2.77Å; R81-S98 CarbonylContact O-C 3.56Å; R81-S98 WeakPolarHBondContact O-CA 3.49Å; R81-Y99 PolarHBondContact O-N 2.76Å; R81-S100 WeakPolarHBondContact CD-O 3.45Å; R81-S100 PolarHBondContact NH1-O 2.9Å; R81-S101 WeakPolarHBondContact CG-O 3.43Å; R81-N102 VanDerWaalsContact CG-OD1 3.32Å; R81-N102 WeakPolarHBondContact CG-OD1 3.38Å
82	Q	97.9	Very high	96.8	Very high	28 Å²	28	44.8 Å²	44.8	13%	0.131	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	112.3	-178.4	-167.9	174.9	35.9	0	0	110.5	K79 N84 N96 Y97	K79-Q82 HydrophobicContact CB-CB 4.08Å; K79-Q82 HydrophobicContact CD-CB 4.42Å; K79-Q82 PolarHBondContact O-N 3.17Å; Q82-N84 WeakPolarHBondContact CG-OD1 3.48Å; Q82-N84 PolarHBondContact O-ND2 2.56Å; Q82-N84 PolarHBondContact OE1-OD1 2.78Å; Q82-N96 HydrophobicContact CG-CB 4.12Å; Q82-N96 PolarHBondContact NE2-OD1 3.25Å; Q82-Y97 CarbonylContact C-O 3.51Å; Q82-Y97 WeakPolarHBondContact CA-O 3.35Å
83	M	97.7	Very high	96.7	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	133.7	164.3	-177.4	-179.6	71.3	0	0	108.8	V73 V85 N96 Y97 Y99 I103 I106 L113 V115	V73-M83 HydrophobicContact CG1-CG 3.39Å; V73-M83 HydrophobicContact CG1-SD 3.68Å; M83-V85 HydrophobicContact CE-CG2 3.9Å; M83-V85 HydrophobicContact CG-CG2 4.23Å; M83-V85 HydrophobicContact SD-CG2 4.3Å; M83-N96 CarbonylContact O-C 3.57Å; M83-N96 WeakPolarHBondContact O-CA 3.49Å; M83-N96 WeakPolarHBondContact O-CB 3.43Å; M83-Y97 HydrophobicContact CE-CD2 3.84Å; M83-Y97 HydrophobicContact CE-CG 4.44Å; M83-Y97 PolarHBondContact N-O 3.11Å; M83-Y97 PolarHBondContact O-N 2.97Å; M83-Y99 HydrophobicContact CB-CE2 3.81Å; M83-Y99 WeakPolarHBondContact CE-OH 3.33Å; M83-I103 HydrophobicContact CB-CD1 3.82Å; M83-I106 HydrophobicContact CG-CD1 3.89Å; M83-I106 HydrophobicContact SD-CD1 3.97Å; M83-L113 HydrophobicContact CE-CD1 3.99Å; M83-L113 HydrophobicContact CE-CD2 3.84Å; M83-L113 HydrophobicContact SD-CD1 3.9Å; M83-L113 HydrophobicContact SD-CD2 3.74Å; M83-L113 HydrophobicContact SD-CG 4.33Å; M83-V115 HydrophobicContact CE-CG2 4.38Å; M83-V115 HydrophobicContact SD-CG2 3.66Å
84	N	97.3	Very high	96.6	Very high	5 Å²	5	50.6 Å²	50.6	3%	0.027	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	134.8	175.7	-42.8	-88.7	0	0	0	108.2	V73 V74 Q82 Y86	V73-N84 WeakPolarHBondContact CA-O 3.44Å; V74-N84 PolarHBondContact N-O 2.77Å; V74-N84 PolarHBondContact O-N 3.22Å; V74-N84 VanDerWaalsContact O-N 3.11Å; V74-N84 PolarHBondContact O-ND2 3.36Å; V74-N84 VanDerWaalsContact O-ND2 3.08Å; Q82-N84 WeakPolarHBondContact CG-OD1 3.48Å; Q82-N84 PolarHBondContact O-ND2 2.56Å; Q82-N84 PolarHBondContact OE1-OD1 2.78Å; N84-Y86 HydrophobicContact CB-CD2 4.47Å; N84-Y86 HydrophobicContact CB-CE2 3.46Å; N84-Y86 VanDerWaalsContact CB-CE2 3.46Å; N84-Y86 WeakPolarHBondContact CB-OH 3.37Å
85	V	97.7	Very high	96.5	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	126.1	-174.4	-171.4	0	0	0	0	109.2	L71 V73 M83 I94 C95 M129	L71-V85 HydrophobicContact CD2-CG1 3.89Å; L71-V85 HydrophobicContact CG-CG1 4.16Å; V73-V85 HydrophobicContact CG1-CG2 4.27Å; V73-V85 HydrophobicContact CG2-CG1 4.12Å; V73-V85 HydrophobicContact CG2-CG2 4.14Å; M83-V85 HydrophobicContact CE-CG2 3.9Å; M83-V85 HydrophobicContact CG-CG2 4.23Å; M83-V85 HydrophobicContact SD-CG2 4.3Å; V85-I94 HydrophobicContact CB-CB 4.47Å; V85-I94 HydrophobicContact CG1-CB 4.4Å; V85-I94 HydrophobicContact CG1-CD1 4.11Å; V85-I94 PolarHBondContact O-N 2.94Å; V85-C95 PolarHBondContact N-O 2.8Å; V85-M129 HydrophobicContact CG1-CE 3.9Å
86	Y	96.8	Very high	96.3	Very high	39 Å²	39	54.7 Å²	54.7	15%	0.153	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	150.5	-172.7	-58.9	-82.3	0	0	0	112.2	I57 L71 V72 V74 N84 T92 E93	I57-Y86 HydrophobicContact CD1-CD2 4.28Å; I57-Y86 HydrophobicContact CD1-CE2 3.36Å; I57-Y86 WeakPolarHBondContact CD1-OH 3.45Å; L71-Y86 WeakPolarHBondContact CA-O 3.34Å; V72-Y86 PolarHBondContact N-O 2.93Å; V72-Y86 PolarHBondContact O-N 3.33Å; V74-Y86 HydrophobicContact CB-CD2 4.49Å; V74-Y86 HydrophobicContact CB-CE2 4.26Å; V74-Y86 HydrophobicContact CG2-CD2 4.13Å; V74-Y86 HydrophobicContact CG2-CE2 4.35Å; N84-Y86 HydrophobicContact CB-CD2 4.47Å; N84-Y86 HydrophobicContact CB-CE2 3.46Å; N84-Y86 VanDerWaalsContact CB-CE2 3.46Å; N84-Y86 WeakPolarHBondContact CB-OH 3.37Å; Y86-T92 WeakPolarHBondContact CA-O 3.35Å; Y86-E93 HydrophobicContact CD1-CB 3.84Å; Y86-E93 HydrophobicContact CD1-CG 4.05Å; Y86-E93 HydrophobicContact CE1-CB 3.63Å; Y86-E93 HydrophobicContact CE1-CG 3.59Å; Y86-E93 PolarHBondContact OH-OE2 3.37Å
87	H	96.8	Very high	96.3	Very high	8 Å²	8	57.7 Å²	57.7	4%	0.037	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	85.9	168.9	-168.3	-56.6	0	0	0	109.1	S70 K89 K90 G91 T92 I94 E426	S70-H87 WeakPolarHBondContact CB-CE1 3.42Å; S70-H87 WeakPolarHBondContact CB-ND1 3.49Å; S70-H87 CarbonylContact O-C 3.55Å; S70-H87 WeakPolarHBondContact O-CA 3.42Å; H87-K89 VanDerWaalsContact C-N 3.31Å; H87-K89 PolarHBondContact O-N 2.85Å; H87-K89 VanDerWaalsContact O-N 3.13Å; H87-K90 HydrophobicContact CB-CB 4.33Å; H87-K90 VanDerWaalsContact CE1-CD 3.44Å; H87-K90 WeakPolarHBondContact CE1-CD 3.47Å; H87-K90 VanDerWaalsContact CE1-CE 3.46Å; H87-K90 WeakPolarHBondContact CE1-CE 3.39Å; H87-K90 WeakPolarHBondContact ND1-CG 3.33Å; H87-K90 WeakPolarHBondContact NE2-CE 3.35Å; H87-K90 PolarHBondContact NE2-NZ 2.74Å; H87-K90 PolarHBondContact O-N 3.14Å; H87-G91 PolarHBondContact O-N 3.42Å; H87-T92 PolarHBondContact N-O 2.89Å; H87-I94 HydrophobicContact CB-CD1 4.02Å; H87-I94 HydrophobicContact CB-CG1 4.22Å; H87-E426 IonicContact CE1-OE2 3.9Å; H87-E426 PolarHBondContact CE1-OE2 3.06Å; H87-E426 IonicContact NE2-OE2 2.68Å
88	F	95.3	Very high	96.4	Very high	24 Å²	24	56.8 Å²	56.8	11%	0.105	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-60.1	-35.1	-162.6	64.9	-104.5	0	0	0	114.2	L39 V51 H52 S70 V72 K90 G91	L39-F88 HydrophobicContact CD1-CD1 3.95Å; L39-F88 HydrophobicContact CD1-CE1 3.61Å; L39-F88 HydrophobicContact CD1-CZ 4.24Å; V51-F88 HydrophobicContact CG1-CE2 4.23Å; V51-F88 HydrophobicContact CG1-CZ 4.03Å; H52-F88 HydrophobicContact CB-CD2 3.66Å; H52-F88 HydrophobicContact CB-CE2 3.79Å; H52-F88 HydrophobicContact CB-CG 4.12Å; H52-F88 HydrophobicContact CB-CZ 4.32Å; H52-F88 AromaticContact CD2-CG 3.88Å; H52-F88 AromaticContact CG-CD2 3.62Å; H52-F88 AromaticContact CG-CG 3.79Å; H52-F88 AromaticContact ND1-CD2 3.92Å; S70-F88 WeakPolarHBondContact O-CD1 3.33Å; S70-F88 PolarHBondContact O-N 3.14Å; V72-F88 HydrophobicContact CB-CD1 4.37Å; V72-F88 HydrophobicContact CG1-CD1 4.09Å; F88-K90 PolarHBondContact O-N 3.2Å; F88-G91 PolarHBondContact O-N 2.8Å
89	K	94.9	Very high	96.5	Very high	129 Å²	129	53.7 Å²	53.7	56%	0.561	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-64.9	-20.8	173.8	-67.8	-172.7	-157	154.8	0	115.1	S70 H87 E426	S70-K89 WeakPolarHBondContact OG-CD 3.19Å; S70-K89 WeakPolarHBondContact OG-CE 3.36Å; S70-K89 WeakPolarHBondContact OG-CG 3.14Å; S70-K89 PolarHBondContact OG-NZ 3.07Å; H87-K89 VanDerWaalsContact C-N 3.31Å; H87-K89 PolarHBondContact O-N 2.85Å; H87-K89 VanDerWaalsContact O-N 3.13Å; K89-E426 IonicContact NZ-OE1 2.72Å; K89-E426 PolarHBondContact NZ-OE1 3.17Å; K89-E426 IonicContact NZ-OE2 3.87Å
90	K	95.2	Very high	96.5	Very high	105 Å²	105	51.9 Å²	51.9	46%	0.457	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-102.8	-8.2	-179.8	-71.3	174.3	-172.7	149.5	0	112.4	H87 F88 T92 E426	H87-K90 HydrophobicContact CB-CB 4.33Å; H87-K90 VanDerWaalsContact CE1-CD 3.44Å; H87-K90 WeakPolarHBondContact CE1-CD 3.47Å; H87-K90 VanDerWaalsContact CE1-CE 3.46Å; H87-K90 WeakPolarHBondContact CE1-CE 3.39Å; H87-K90 WeakPolarHBondContact ND1-CG 3.33Å; H87-K90 WeakPolarHBondContact NE2-CE 3.35Å; H87-K90 PolarHBondContact NE2-NZ 2.74Å; H87-K90 PolarHBondContact O-N 3.14Å; F88-K90 PolarHBondContact O-N 3.2Å; K90-T92 HydrophobicContact CB-CG2 4.4Å; K90-T92 PolarHBondContact O-N 2.98Å; K90-E426 PolarHBondContact NZ-O 3.17Å
91	G	93.4	Very high	96.5	Very high	74 Å²	74	52.6 Å²	52.6	76%	0.763	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.5	17	-176.6	0	0	0	0	0	114.5	H87 F88	H87-G91 PolarHBondContact O-N 3.42Å; F88-G91 PolarHBondContact O-N 2.8Å
92	T	94.7	Very high	96.5	Very high	51 Å²	51	49.9 Å²	49.9	31%	0.313	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	132.9	-172.8	54.6	0	0	0	0	112.7	Y86 H87 K90	Y86-T92 WeakPolarHBondContact CA-O 3.35Å; H87-T92 PolarHBondContact N-O 2.89Å; K90-T92 HydrophobicContact CB-CG2 4.4Å; K90-T92 PolarHBondContact O-N 2.98Å
93	E	95.9	Very high	96.5	Very high	77 Å²	77	48.5 Å²	48.5	36%	0.36	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	125.6	156.8	-166.3	175.8	130.8	0	0	109.2	Y86 N96	Y86-E93 HydrophobicContact CD1-CB 3.84Å; Y86-E93 HydrophobicContact CD1-CG 4.05Å; Y86-E93 HydrophobicContact CE1-CB 3.63Å; Y86-E93 HydrophobicContact CE1-CG 3.59Å; Y86-E93 PolarHBondContact OH-OE2 3.37Å; E93-N96 WeakPolarHBondContact OE1-CB 3.35Å; E93-N96 PolarHBondContact OE1-ND2 3.17Å
94	I	96.1	Very high	96.5	Very high	45 Å²	45	51 Å²	51	23%	0.231	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	-48.8	175.4	-65.3	165.8	0	0	0	109.1	L71 V85 H87 M129	L71-I94 HydrophobicContact CD1-CD1 4.29Å; L71-I94 HydrophobicContact CG-CD1 4.29Å; V85-I94 HydrophobicContact CB-CB 4.47Å; V85-I94 HydrophobicContact CG1-CB 4.4Å; V85-I94 HydrophobicContact CG1-CD1 4.11Å; V85-I94 PolarHBondContact O-N 2.94Å; H87-I94 HydrophobicContact CB-CD1 4.02Å; H87-I94 HydrophobicContact CB-CG1 4.22Å; I94-M129 HydrophobicContact CG2-CG 4.25Å
95	C	96	Very high	96.6	Very high	18 Å²	18	51.4 Å²	51.4	12%	0.122	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	158.5	179.7	58.5	0	0	0	0	111.3	V85 Y97	V85-C95 PolarHBondContact N-O 2.8Å; C95-Y97 HydrophobicContact CB-CD2 4.36Å; C95-Y97 HydrophobicContact CB-CE2 3.88Å
96	N	95.8	Very high	96.6	Very high	68 Å²	68	51.4 Å²	51.4	36%	0.364	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	148.6	159.7	66.9	73.1	0	0	0	110.9	Q82 M83 E93	Q82-N96 HydrophobicContact CG-CB 4.12Å; Q82-N96 PolarHBondContact NE2-OD1 3.25Å; M83-N96 CarbonylContact O-C 3.57Å; M83-N96 WeakPolarHBondContact O-CA 3.49Å; M83-N96 WeakPolarHBondContact O-CB 3.43Å; E93-N96 WeakPolarHBondContact OE1-CB 3.35Å; E93-N96 PolarHBondContact OE1-ND2 3.17Å
97	Y	97.4	Very high	96.7	Very high	65 Å²	65	53.6 Å²	53.6	26%	0.255	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	132.6	179	-76.2	-82.6	0	0	0	110.2	Q82 M83 C95 Y99 M129	Q82-Y97 CarbonylContact C-O 3.51Å; Q82-Y97 WeakPolarHBondContact CA-O 3.35Å; M83-Y97 HydrophobicContact CE-CD2 3.84Å; M83-Y97 HydrophobicContact CE-CG 4.44Å; M83-Y97 PolarHBondContact N-O 3.11Å; M83-Y97 PolarHBondContact O-N 2.97Å; C95-Y97 HydrophobicContact CB-CD2 4.36Å; C95-Y97 HydrophobicContact CB-CE2 3.88Å; Y97-Y99 WeakPolarHBondContact CB-OH 3.41Å; Y97-Y99 WeakPolarHBondContact O-CE2 3.42Å; Y97-M129 HydrophobicContact CE2-CB 4.16Å; Y97-M129 PolarHBondContact OH-O 3.17Å
98	S	97.7	Very high	96.8	Very high	89 Å²	89	53.5 Å²	53.5	62%	0.622	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.6	132	178.4	-62.5	0	0	0	0	110.9	R81	R81-S98 CarbonylContact O-C 3.56Å; R81-S98 WeakPolarHBondContact O-CA 3.49Å
99	Y	98.1	Very high	96.9	Very high	22 Å²	22	52.4 Å²	52.4	9%	0.086	29%	0.291	C	S	.	.			trans	-111.5	172.4	-178.6	-54.8	-90	0	0	0	111.8	R81 M83 Y97 I103 V115 L117 Y122 H124	R81-Y99 PolarHBondContact O-N 2.76Å; M83-Y99 HydrophobicContact CB-CE2 3.81Å; M83-Y99 WeakPolarHBondContact CE-OH 3.33Å; Y97-Y99 WeakPolarHBondContact CB-OH 3.41Å; Y97-Y99 WeakPolarHBondContact O-CE2 3.42Å; Y99-I103 HydrophobicContact CD2-CD1 3.87Å; Y99-I103 HydrophobicContact CD2-CG1 4.03Å; Y99-I103 HydrophobicContact CE2-CD1 4.1Å; Y99-V115 HydrophobicContact CD2-CG1 4.24Å; Y99-V115 HydrophobicContact CE1-CB 4.37Å; Y99-V115 HydrophobicContact CE1-CG1 4.44Å; Y99-V115 HydrophobicContact CE1-CG2 4.43Å; Y99-V115 HydrophobicContact CE2-CG1 4.02Å; Y99-V115 HydrophobicContact CE2-CG2 4.26Å; Y99-L117 HydrophobicContact CD1-CD1 4.41Å; Y99-L117 HydrophobicContact CG-CD1 4.42Å; Y99-Y122 HydrophobicContact CD1-CD1 4.01Å; Y99-Y122 AromaticContact CD1-CD2 3.87Å; Y99-Y122 HydrophobicContact CD1-CD2 3.87Å; Y99-Y122 HydrophobicContact CD1-CE1 4.13Å; Y99-Y122 AromaticContact CD1-CE2 3.99Å; Y99-Y122 HydrophobicContact CD1-CE2 3.99Å; Y99-Y122 AromaticContact CD1-CG 3.88Å; Y99-Y122 HydrophobicContact CD1-CG 3.88Å; Y99-Y122 AromaticContact CE1-CD1 3.93Å; Y99-Y122 HydrophobicContact CE1-CD1 3.93Å; Y99-Y122 HydrophobicContact CE1-CD2 4.2Å; Y99-Y122 HydrophobicContact CE1-CE1 4.45Å; Y99-Y122 AromaticContact CE1-CG 3.79Å; Y99-Y122 HydrophobicContact CE1-CG 3.79Å; Y99-H124 AromaticContact CE1-CE1 3.86Å; Y99-H124 AromaticContact CE1-NE2 3.95Å; Y99-H124 AromaticContact CZ-CE1 3.88Å; Y99-H124 AromaticContact CZ-NE2 3.93Å; Y99-H124 PolarHBondContact OH-CE1 3.11Å; Y99-H124 PolarHBondContact OH-NE2 3.49Å
100	S	96	Very high	96.9	Very high	73 Å²	73	49.1 Å²	49.1	51%	0.51	28%	0.275	S	S	.	.	S	Bend	trans	-66.2	-55.3	-174.8	45.5	0	0	0	0	113	R81 L117	R81-S100 WeakPolarHBondContact CD-O 3.45Å; R81-S100 PolarHBondContact NH1-O 2.9Å; S100-L117 WeakPolarHBondContact OG-CD2 3.36Å
101	S	97.3	Very high	96.9	Very high	48 Å²	48	46.9 Å²	46.9	34%	0.336	27%	0.267	S	S	.	.	S	Bend	trans	-116.6	-173.7	174.8	73	0	0	0	0	111.6	R81	R81-S101 WeakPolarHBondContact CG-O 3.43Å
102	N	98.1	Very high	97.2	Very high	78 Å²	78	44.3 Å²	44.3	42%	0.417	23%	0.234	S	C	.	.			trans	-68.3	141.5	-172.6	-65.5	-13.8	0	0	0	111.5	P80 R81 L104	P80-N102 HydrophobicContact CB-CB 4.3Å; P80-N102 WeakPolarHBondContact CG-OD1 3.39Å; P80-N102 WeakPolarHBondContact O-CA 3.34Å; R81-N102 VanDerWaalsContact CG-OD1 3.32Å; R81-N102 WeakPolarHBondContact CG-OD1 3.38Å; N102-L104 PolarHBondContact O-N 3.42Å
103	I	98.7	Very high	97.3	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.219	C	C	.	.			trans	-74.3	122.3	172.5	-56.6	169	0	0	0	107.7	Y61 I62 V75 P80 M83 Y99 I106 V115	Y61-I103 WeakPolarHBondContact CE2-O 3.38Å; Y61-I103 PolarHBondContact OH-O 3.38Å; I62-I103 HydrophobicContact CD1-CB 4.33Å; I62-I103 HydrophobicContact CD1-CG2 3.69Å; V75-I103 HydrophobicContact CG1-CB 4.48Å; V75-I103 HydrophobicContact CG1-CD1 4.12Å; V75-I103 HydrophobicContact CG2-CD1 3.83Å; V75-I103 HydrophobicContact CG2-CG2 4.42Å; P80-I103 PolarHBondContact O-N 3.1Å; M83-I103 HydrophobicContact CB-CD1 3.82Å; Y99-I103 HydrophobicContact CD2-CD1 3.87Å; Y99-I103 HydrophobicContact CD2-CG1 4.03Å; Y99-I103 HydrophobicContact CE2-CD1 4.1Å; I103-I106 HydrophobicContact CG2-CD1 4.09Å; I103-I106 HydrophobicContact CG2-CG1 3.74Å; I103-V115 HydrophobicContact CB-CG1 4.27Å; I103-V115 HydrophobicContact CD1-CG1 4.13Å; I103-V115 HydrophobicContact CG1-CG1 3.8Å; I103-V115 HydrophobicContact CG2-CG1 3.6Å
104	L	98.4	Very high	97.5	Very high	54 Å²	54	38.3 Å²	38.3	28%	0.283	20%	0.202	S	C	.	.			trans	-97.7	-36.5	-179.4	-56	-177.2	0	0	0	111.7	N102 C116 E118 N141 G144	N102-L104 PolarHBondContact O-N 3.42Å; L104-C116 PolarHBondContact N-O 3.19Å; L104-E118 HydrophobicContact CD1-CB 4Å; L104-N141 WeakPolarHBondContact CD1-O 3.42Å; L104-G144 VanDerWaalsContact CB-CA 3.47Å
105	S	98.1	Very high	97.6	Very high	12 Å²	12	36.1 Å²	36.1	8%	0.084	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	160.5	171.1	72.6	0	0	0	0	113	C116 G144 C146	S105-C116 PolarHBondContact N-O 2.99Å; S105-C116 PolarHBondContact O-N 3.32Å; S105-C116 VanDerWaalsContact OG-CB 3.31Å; S105-C116 WeakPolarHBondContact OG-CB 3.29Å; S105-G144 VanDerWaalsContact CB-O 3.29Å; S105-G144 WeakPolarHBondContact CB-O 3.4Å; S105-G144 PolarHBondContact OG-O 2.83Å; S105-C146 PolarHBondContact OG-SG 2.85Å
106	I	98.6	Very high	97.7	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	140.2	174.4	-63.8	-178.2	0	0	0	108.4	I62 E64 V73 V75 M83 I103 L108 L114 V115	I62-I106 HydrophobicContact CG2-CB 4.26Å; I62-I106 HydrophobicContact CG2-CD1 4.23Å; I62-I106 HydrophobicContact CG2-CG1 4.27Å; E64-I106 HydrophobicContact CG-CB 4.24Å; E64-I106 HydrophobicContact CG-CG2 4.47Å; V73-I106 HydrophobicContact CG1-CD1 3.58Å; V73-I106 HydrophobicContact CG1-CG2 4.21Å; V75-I106 HydrophobicContact CG2-CD1 3.71Å; M83-I106 HydrophobicContact CG-CD1 3.89Å; M83-I106 HydrophobicContact SD-CD1 3.97Å; I103-I106 HydrophobicContact CG2-CD1 4.09Å; I103-I106 HydrophobicContact CG2-CG1 3.74Å; I106-L108 HydrophobicContact CG2-CD2 4.01Å; I106-L108 HydrophobicContact CG2-CG 4.28Å; I106-L114 VanDerWaalsContact CA-O 3.29Å; I106-L114 WeakPolarHBondContact CA-O 3.29Å; I106-V115 HydrophobicContact CG1-CG1 4.47Å
107	R	98.3	Very high	97.8	Very high	85 Å²	85	32 Å²	32	32%	0.321	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	136.6	176.2	-63.2	-71.1	164.6	-120.3	16.4	110.4	E64 L114 C146 L148	E64-R107 IonicContact OE1-CZ 2.62Å; E64-R107 IonicContact OE1-NH1 3.21Å; E64-R107 PolarHBondContact OE1-NH1 2.8Å; E64-R107 IonicContact OE2-NH1 3.65Å; R107-L114 HydrophobicContact CB-CB 4.24Å; R107-L114 HydrophobicContact CB-CD1 4.36Å; R107-L114 HydrophobicContact CB-CG 4.49Å; R107-L114 PolarHBondContact N-O 3.49Å; R107-L114 PolarHBondContact O-N 2.84Å; R107-C146 PolarHBondContact NE-O 2.82Å; R107-L148 HydrophobicContact CB-CB 3.83Å; R107-L148 HydrophobicContact CB-CD2 4.26Å
108	L	97.8	Very high	97.8	Very high	6 Å²	6	33.1 Å²	33.1	3%	0.031	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	135.5	-171.5	-52.2	171.3	0	0	0	110.4	Q24 E64 L66 V73 I106 L113 I126	Q24-L108 WeakPolarHBondContact CG-O 3.4Å; Q24-L108 PolarHBondContact NE2-O 2.95Å; E64-L108 HydrophobicContact CB-CD1 3.93Å; L66-L108 HydrophobicContact CB-CD1 4.44Å; L66-L108 HydrophobicContact CD1-CB 4.08Å; V73-L108 HydrophobicContact CB-CD1 4.49Å; V73-L108 HydrophobicContact CG2-CD1 3.81Å; V73-L108 HydrophobicContact CG2-CD2 4.08Å; I106-L108 HydrophobicContact CG2-CD2 4.01Å; I106-L108 HydrophobicContact CG2-CG 4.28Å; L108-L113 HydrophobicContact CD2-CB 3.77Å; L108-L113 HydrophobicContact CD2-CD1 3.57Å; L108-L113 HydrophobicContact CD2-CG 3.47Å; L108-L113 VanDerWaalsContact CD2-CG 3.47Å; L108-I126 HydrophobicContact CD2-CD1 4.13Å
109	N	97.6	Very high	97.8	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.174	C	C	.	.			trans	-133.3	-178.4	161.8	78	15.4	0	0	0	109.7	L66 Q111 R112 L148 S149 S155	L66-N109 WeakPolarHBondContact CD1-O 3.36Å; N109-Q111 PolarHBondContact O-N 2.99Å; N109-Q111 PolarHBondContact OD1-N 3.03Å; N109-R112 PolarHBondContact N-O 3.45Å; N109-R112 PolarHBondContact OD1-N 3.32Å; N109-L148 HydrophobicContact CB-CD2 3.83Å; N109-L148 HydrophobicContact CB-CG 4.27Å; N109-S149 WeakPolarHBondContact CB-O 3.36Å; N109-S149 PolarHBondContact ND2-O 2.88Å; N109-S155 PolarHBondContact ND2-OG 2.87Å
110	R	95.9	Very high	97.8	Very high	60 Å²	60	34.2 Å²	34.2	23%	0.226	17%	0.173	C	C	.	.	S	Bend	trans	-69.3	6.4	-177	-64.7	-166.8	-177.2	-122.6	18.3	115.4	F67 I126 H152 L423 D424	F67-R110 HydrophobicContact CD2-CG 3.94Å; F67-R110 HydrophobicContact CE2-CG 3.56Å; F67-R110 HydrophobicContact CZ-CG 4.16Å; R110-I126 VanDerWaalsContact C-CG2 3.48Å; R110-I126 WeakPolarHBondContact O-CG2 3.29Å; R110-H152 HydrophobicContact CB-CB 4.44Å; R110-L423 HydrophobicContact CB-CD1 3.98Å; R110-L423 PolarHBondContact NH1-O 2.81Å; R110-L423 WeakPolarHBondContact O-CD1 3.4Å; R110-D424 IonicContact CZ-OD1 2.66Å; R110-D424 IonicContact NH1-OD1 2.75Å; R110-D424 PolarHBondContact NH1-OD1 3.31Å; R110-D424 IonicContact NH2-OD1 2.67Å; R110-D424 PolarHBondContact NH2-OD1 2.84Å; R110-D424 IonicContact NH2-OD2 2.71Å
111	Q	95.9	Very high	97.9	Very high	59 Å²	59	30.8 Å²	30.8	28%	0.276	15%	0.149	S	C	.	.	S	Bend	trans	-140.2	-18.5	179.2	-150.6	-173.5	-17.3	0	0	114.4	N109 N125 I126 H152 N174	N109-Q111 PolarHBondContact O-N 2.99Å; N109-Q111 PolarHBondContact OD1-N 3.03Å; Q111-N125 PolarHBondContact O-OD1 2.83Å; Q111-I126 PolarHBondContact O-N 2.88Å; Q111-H152 HydrophobicContact CB-CB 3.96Å; Q111-H152 PolarHBondContact OE1-O 2.98Å; Q111-N174 VanDerWaalsContact CD-OD1 3.32Å; Q111-N174 PolarHBondContact NE2-OD1 3.11Å; Q111-N174 PolarHBondContact OE1-OD1 3.49Å; Q111-N174 VanDerWaalsContact OE1-OD1 3.06Å
112	R	98	Very high	98	Very high	19 Å²	19	30.3 Å²	30.3	7%	0.072	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	143.6	-173.1	-64.3	-63.1	178.9	-99.3	-2.6	112.9	N109 H124 L148 S155 G173	N109-R112 PolarHBondContact N-O 3.45Å; N109-R112 PolarHBondContact OD1-N 3.32Å; R112-H124 WeakPolarHBondContact CA-O 3.2Å; R112-L148 HydrophobicContact CB-CD1 4.46Å; R112-L148 HydrophobicContact CB-CD2 4.39Å; R112-S155 WeakPolarHBondContact CG-OG 3.37Å; R112-G173 VanDerWaalsContact CZ-O 3.23Å; R112-G173 PolarHBondContact NE-O 3.24Å; R112-G173 PolarHBondContact NH2-O 2.72Å
113	L	98.3	Very high	98	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.005	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	123	165.3	174.6	157.6	0	0	0	107.8	V73 M83 L108 V115 H124 I126 M129	V73-L113 HydrophobicContact CG2-CD1 4.25Å; M83-L113 HydrophobicContact CE-CD1 3.99Å; M83-L113 HydrophobicContact CE-CD2 3.84Å; M83-L113 HydrophobicContact SD-CD1 3.9Å; M83-L113 HydrophobicContact SD-CD2 3.74Å; M83-L113 HydrophobicContact SD-CG 4.33Å; L108-L113 HydrophobicContact CD2-CB 3.77Å; L108-L113 HydrophobicContact CD2-CD1 3.57Å; L108-L113 HydrophobicContact CD2-CG 3.47Å; L108-L113 VanDerWaalsContact CD2-CG 3.47Å; L113-V115 HydrophobicContact CD2-CG2 3.57Å; L113-H124 HydrophobicContact CB-CB 4.26Å; L113-H124 HydrophobicContact CD2-CB 4.07Å; L113-H124 WeakPolarHBondContact CD2-ND1 3.45Å; L113-H124 PolarHBondContact N-O 2.94Å; L113-H124 PolarHBondContact O-N 3.08Å; L113-I126 HydrophobicContact CB-CD1 3.94Å; L113-I126 HydrophobicContact CD1-CD1 4.15Å; L113-M129 HydrophobicContact CD1-SD 4.23Å
114	L	98.5	Very high	98	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.005	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	136.9	172.5	-54	-173.1	0	0	0	109.7	I106 R107 Y122 I123 L148 L157	I106-L114 VanDerWaalsContact CA-O 3.29Å; I106-L114 WeakPolarHBondContact CA-O 3.29Å; R107-L114 HydrophobicContact CB-CB 4.24Å; R107-L114 HydrophobicContact CB-CD1 4.36Å; R107-L114 HydrophobicContact CB-CG 4.49Å; R107-L114 PolarHBondContact N-O 3.49Å; R107-L114 PolarHBondContact O-N 2.84Å; L114-Y122 WeakPolarHBondContact CA-O 3.24Å; L114-I123 HydrophobicContact CD2-CB 4.18Å; L114-I123 HydrophobicContact CD2-CG1 3.84Å; L114-I123 HydrophobicContact CD2-CG2 3.99Å; L114-L148 HydrophobicContact CD1-CB 4Å; L114-L148 HydrophobicContact CD1-CD1 4.05Å; L114-L148 HydrophobicContact CD1-CG 4.4Å; L114-L148 HydrophobicContact CG-CD1 4.32Å; L114-L148 HydrophobicContact CG-CD2 4.26Å; L114-L157 HydrophobicContact CD1-CB 3.74Å; L114-L157 HydrophobicContact CD1-CD2 3.99Å; L114-L157 HydrophobicContact CD1-CG 4.37Å; L114-L157 HydrophobicContact CD2-CD2 3.75Å
115	V	98.7	Very high	97.9	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	118.3	165	-172	0	0	0	0	107.6	M83 Y99 I103 I106 L113 L117 I121 Y122	M83-V115 HydrophobicContact CE-CG2 4.38Å; M83-V115 HydrophobicContact SD-CG2 3.66Å; Y99-V115 HydrophobicContact CD2-CG1 4.24Å; Y99-V115 HydrophobicContact CE1-CB 4.37Å; Y99-V115 HydrophobicContact CE1-CG1 4.44Å; Y99-V115 HydrophobicContact CE1-CG2 4.43Å; Y99-V115 HydrophobicContact CE2-CG1 4.02Å; Y99-V115 HydrophobicContact CE2-CG2 4.26Å; I103-V115 HydrophobicContact CB-CG1 4.27Å; I103-V115 HydrophobicContact CD1-CG1 4.13Å; I103-V115 HydrophobicContact CG1-CG1 3.8Å; I103-V115 HydrophobicContact CG2-CG1 3.6Å; I106-V115 HydrophobicContact CG1-CG1 4.47Å; L113-V115 HydrophobicContact CD2-CG2 3.57Å; V115-L117 HydrophobicContact CG1-CD1 4.08Å; V115-I121 WeakPolarHBondContact O-CA 3.21Å; V115-Y122 PolarHBondContact N-O 3.05Å; V115-Y122 PolarHBondContact O-N 2.84Å
116	C	98.4	Very high	97.8	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	124.6	177.6	-162.5	0	0	0	0	109.8	L104 S105 I121	L104-C116 PolarHBondContact N-O 3.19Å; S105-C116 PolarHBondContact N-O 2.99Å; S105-C116 PolarHBondContact O-N 3.32Å; S105-C116 VanDerWaalsContact OG-CB 3.31Å; S105-C116 WeakPolarHBondContact OG-CB 3.29Å; C116-I121 HydrophobicContact CB-CG1 4.34Å
117	L	98.3	Very high	97.6	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	13%	0.126	C	C	.	.			trans	-102.9	-172.6	164.8	-67.1	73.9	0	0	0	107.7	Y99 S100 V115 S120 Y122	Y99-L117 HydrophobicContact CD1-CD1 4.41Å; Y99-L117 HydrophobicContact CG-CD1 4.42Å; S100-L117 WeakPolarHBondContact OG-CD2 3.36Å; V115-L117 HydrophobicContact CG1-CD1 4.08Å; L117-S120 PolarHBondContact N-O 3.09Å; L117-Y122 HydrophobicContact CD1-CD2 3.66Å; L117-Y122 HydrophobicContact CD1-CE2 3.76Å; L117-Y122 HydrophobicContact CD2-CE2 4.21Å
118	E	97.1	Very high	97.4	Very high	87 Å²	87	26.5 Å²	26.5	41%	0.407	12%	0.122	S	C	.	.	S	Bend	trans	-68.3	-47.4	178.8	-167.6	164.7	-166.6	0	0	112.8	L104 A140 N141	L104-E118 HydrophobicContact CD1-CB 4Å; E118-A140 HydrophobicContact CG-CB 4.39Å; E118-N141 WeakPolarHBondContact O-CB 3.46Å; E118-N141 PolarHBondContact O-N 2.96Å
119	E	97	Very high	97.3	Very high	125 Å²	125	26.8 Å²	26.8	58%	0.584	12%	0.123	S	C	*	.	S	Bend	trans	-118.1	14.3	-175.4	-59.4	-179.3	138.3	0	0	113	D137 I138 A140	E119-D137 PolarHBondContact O-N 3.06Å; E119-I138 WeakPolarHBondContact O-CG1 3.44Å; E119-I138 PolarHBondContact O-N 2.67Å; E119-A140 HydrophobicContact CG-CB 4.39Å
120	S	98.1	Very high	97.2	Very high	10 Å²	10	32 Å²	32	7%	0.07	15%	0.146	C	C	.	.			trans	-156.1	152.8	177.9	52.7	0	0	0	0	114.4	L117 L135	L117-S120 PolarHBondContact N-O 3.09Å; S120-L135 CarbonylContact C-O 3.56Å; S120-L135 WeakPolarHBondContact CA-O 3.18Å; S120-L135 WeakPolarHBondContact CB-O 3.38Å
121	I	98.6	Very high	97.3	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	127.5	173.1	-68.4	165.6	0	0	0	109.3	V115 C116 I123 T134 L135 I138 Y159	V115-I121 WeakPolarHBondContact O-CA 3.21Å; C116-I121 HydrophobicContact CB-CG1 4.34Å; I121-I123 HydrophobicContact CG2-CG1 4.32Å; I121-T134 WeakPolarHBondContact O-CA 3.27Å; I121-L135 HydrophobicContact CB-CB 4.31Å; I121-L135 HydrophobicContact CB-CD1 4.36Å; I121-L135 PolarHBondContact N-O 2.97Å; I121-L135 PolarHBondContact O-N 2.83Å; I121-I138 HydrophobicContact CD1-CD1 3.81Å; I121-I138 HydrophobicContact CG1-CD1 3.81Å; I121-Y159 HydrophobicContact CD1-CD1 3.85Å; I121-Y159 HydrophobicContact CD1-CD2 4.18Å; I121-Y159 HydrophobicContact CD1-CE1 4.48Å; I121-Y159 HydrophobicContact CD1-CG 3.68Å
122	Y	98.7	Very high	97.4	Very high	39 Å²	39	33.7 Å²	33.7	15%	0.153	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	119.2	177.6	-68.6	-108.8	0	0	0	110.3	Y99 L114 V115 L117 H124 L131 T134	Y99-Y122 HydrophobicContact CD1-CD1 4.01Å; Y99-Y122 AromaticContact CD1-CD2 3.87Å; Y99-Y122 HydrophobicContact CD1-CD2 3.87Å; Y99-Y122 HydrophobicContact CD1-CE1 4.13Å; Y99-Y122 AromaticContact CD1-CE2 3.99Å; Y99-Y122 HydrophobicContact CD1-CE2 3.99Å; Y99-Y122 AromaticContact CD1-CG 3.88Å; Y99-Y122 HydrophobicContact CD1-CG 3.88Å; Y99-Y122 AromaticContact CE1-CD1 3.93Å; Y99-Y122 HydrophobicContact CE1-CD1 3.93Å; Y99-Y122 HydrophobicContact CE1-CD2 4.2Å; Y99-Y122 HydrophobicContact CE1-CE1 4.45Å; Y99-Y122 AromaticContact CE1-CG 3.79Å; Y99-Y122 HydrophobicContact CE1-CG 3.79Å; L114-Y122 WeakPolarHBondContact CA-O 3.24Å; V115-Y122 PolarHBondContact N-O 3.05Å; V115-Y122 PolarHBondContact O-N 2.84Å; L117-Y122 HydrophobicContact CD1-CD2 3.66Å; L117-Y122 HydrophobicContact CD1-CE2 3.76Å; L117-Y122 HydrophobicContact CD2-CE2 4.21Å; Y122-H124 VanDerWaalsContact CB-CE1 3.47Å; Y122-H124 WeakPolarHBondContact CB-CE1 3.48Å; Y122-H124 PolarHBondContact O-ND1 2.86Å; Y122-L131 HydrophobicContact CD1-CD1 3.79Å; Y122-L131 HydrophobicContact CD1-CD2 4.03Å; Y122-L131 HydrophobicContact CE1-CD2 4.45Å; Y122-L131 HydrophobicContact CG-CD1 4.35Å; Y122-T134 HydrophobicContact CD1-CG2 3.9Å; Y122-T134 VanDerWaalsContact CD1-OG1 3.25Å; Y122-T134 WeakPolarHBondContact CD1-OG1 3.43Å; Y122-T134 HydrophobicContact CD2-CG2 4.1Å; Y122-T134 HydrophobicContact CE1-CG2 3.74Å; Y122-T134 WeakPolarHBondContact CE1-OG1 3.21Å; Y122-T134 HydrophobicContact CE2-CG2 3.94Å; Y122-T134 HydrophobicContact CG-CG2 4.08Å
123	I	98.6	Very high	97.4	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	112.2	-177.5	-51.1	172.9	0	0	0	108.6	L114 I121 L132 K133 L135 L157 Y171 L176	L114-I123 HydrophobicContact CD2-CB 4.18Å; L114-I123 HydrophobicContact CD2-CG1 3.84Å; L114-I123 HydrophobicContact CD2-CG2 3.99Å; I121-I123 HydrophobicContact CG2-CG1 4.32Å; I123-L132 WeakPolarHBondContact O-CB 3.28Å; I123-L132 PolarHBondContact O-N 3.21Å; I123-K133 HydrophobicContact CB-CB 4.32Å; I123-K133 WeakPolarHBondContact CB-O 3.39Å; I123-K133 HydrophobicContact CD1-CB 4.26Å; I123-K133 HydrophobicContact CD1-CG 4.24Å; I123-K133 PolarHBondContact N-O 2.84Å; I123-K133 PolarHBondContact O-N 3.41Å; I123-K133 VanDerWaalsContact O-N 3.17Å; I123-L135 HydrophobicContact CD1-CD1 4.3Å; I123-L135 HydrophobicContact CD1-CD2 4.38Å; I123-L135 HydrophobicContact CD1-CG 4.18Å; I123-L157 HydrophobicContact CD1-CD2 3.78Å; I123-L157 HydrophobicContact CG1-CD2 4.16Å; I123-Y171 HydrophobicContact CD1-CD1 4.2Å; I123-Y171 HydrophobicContact CD1-CE1 3.54Å; I123-L176 HydrophobicContact CD1-CD2 4.24Å; I123-L176 HydrophobicContact CG2-CD2 4.16Å
124	H	98.5	Very high	97.4	Very high	3 Å²	3	38.6 Å²	38.6	1%	0.014	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	154.9	177.8	-49.4	71.7	0	0	0	110.6	Y99 R112 L113 Y122 K130	Y99-H124 AromaticContact CE1-CE1 3.86Å; Y99-H124 AromaticContact CE1-NE2 3.95Å; Y99-H124 AromaticContact CZ-CE1 3.88Å; Y99-H124 AromaticContact CZ-NE2 3.93Å; Y99-H124 PolarHBondContact OH-CE1 3.11Å; Y99-H124 PolarHBondContact OH-NE2 3.49Å; R112-H124 WeakPolarHBondContact CA-O 3.2Å; L113-H124 HydrophobicContact CB-CB 4.26Å; L113-H124 HydrophobicContact CD2-CB 4.07Å; L113-H124 WeakPolarHBondContact CD2-ND1 3.45Å; L113-H124 PolarHBondContact N-O 2.94Å; L113-H124 PolarHBondContact O-N 3.08Å; Y122-H124 VanDerWaalsContact CB-CE1 3.47Å; Y122-H124 WeakPolarHBondContact CB-CE1 3.48Å; Y122-H124 PolarHBondContact O-ND1 2.86Å; H124-K130 CarbonylContact C-O 3.53Å; H124-K130 WeakPolarHBondContact CA-O 3.26Å; H124-K130 WeakPolarHBondContact CB-O 3.46Å
125	N	97.1	Very high	97.4	Very high	31 Å²	31	39.2 Å²	39.2	17%	0.166	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	127	166.9	177.7	19.4	0	0	0	109.5	Q111 K127 D128 M129 K130 L132	Q111-N125 PolarHBondContact O-OD1 2.83Å; N125-K127 VanDerWaalsContact C-N 3.28Å; N125-K127 PolarHBondContact O-N 3.16Å; N125-K127 PolarHBondContact OD1-N 2.92Å; N125-K127 VanDerWaalsContact OD1-N 3.16Å; N125-D128 WeakPolarHBondContact CB-OD1 3.14Å; N125-D128 PolarHBondContact ND2-OD1 3.07Å; N125-M129 WeakPolarHBondContact O-CA 3.25Å; N125-M129 PolarHBondContact O-N 2.83Å; N125-K130 PolarHBondContact N-O 3.27Å; N125-L132 HydrophobicContact CB-CD1 3.99Å; N125-L132 HydrophobicContact CB-CD2 4.13Å; N125-L132 HydrophobicContact CB-CG 4.05Å
126	I	95.8	Very high	97.2	Very high	5 Å²	5	44.3 Å²	44.3	3%	0.026	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-26.4	178.9	-162	70	0	0	0	112.5	L66 L108 R110 Q111 L113 M129	L66-I126 HydrophobicContact CD2-CD1 4.43Å; L66-I126 HydrophobicContact CD2-CG1 3.91Å; L108-I126 HydrophobicContact CD2-CD1 4.13Å; R110-I126 VanDerWaalsContact C-CG2 3.48Å; R110-I126 WeakPolarHBondContact O-CG2 3.29Å; Q111-I126 PolarHBondContact O-N 2.88Å; L113-I126 HydrophobicContact CB-CD1 3.94Å; L113-I126 HydrophobicContact CD1-CD1 4.15Å; I126-M129 HydrophobicContact CD1-CE 3.94Å; I126-M129 HydrophobicContact CD1-SD 4.46Å; I126-M129 HydrophobicContact CG1-CE 4.45Å; I126-M129 WeakPolarHBondContact O-CE 3.27Å
127	K	93.8	Very high	97	Very high	66 Å²	66	51.8 Å²	51.8	29%	0.287	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-41	-176.1	-73.4	-148.7	-179.7	-151.6	0	113	N125 E428 P430	N125-K127 VanDerWaalsContact C-N 3.28Å; N125-K127 PolarHBondContact O-N 3.16Å; N125-K127 PolarHBondContact OD1-N 2.92Å; N125-K127 VanDerWaalsContact OD1-N 3.16Å; K127-E428 IonicContact NZ-OE1 2.73Å; K127-E428 PolarHBondContact NZ-OE1 3.09Å; K127-E428 IonicContact NZ-OE2 2.66Å; K127-E428 PolarHBondContact NZ-OE2 3.14Å; K127-P430 WeakPolarHBondContact O-CD 3.45Å; K127-P430 WeakPolarHBondContact O-CG 3.4Å
128	D	95	Very high	96.9	Very high	45 Å²	45	52.4 Å²	52.4	24%	0.241	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123	10.6	-177.2	74.5	-12.9	0	0	0	114.6	N125 K130 P430	N125-D128 WeakPolarHBondContact CB-OD1 3.14Å; N125-D128 PolarHBondContact ND2-OD1 3.07Å; D128-K130 PolarHBondContact O-N 2.96Å; D128-K130 PolarHBondContact OD1-N 2.97Å; D128-K130 VanDerWaalsContact OD2-CD 3.32Å; D128-K130 WeakPolarHBondContact OD2-CD 3.48Å; D128-K130 WeakPolarHBondContact OD2-CE 3.42Å; D128-K130 IonicContact OD2-NZ 3.39Å; D128-K130 PolarHBondContact OD2-NZ 3Å; D128-P430 HydrophobicContact CB-CG 4.27Å
129	M	94.9	Very high	96.8	Very high	11 Å²	11	50.4 Å²	50.4	5%	0.054	25%	0.252	C	S	.	.			trans	57	5.3	179.9	-61.3	-63.4	170.6	0	0	115.8	L71 V85 I94 Y97 L113 N125 I126	L71-M129 HydrophobicContact CD1-CE 3.76Å; V85-M129 HydrophobicContact CG1-CE 3.9Å; I94-M129 HydrophobicContact CG2-CG 4.25Å; Y97-M129 HydrophobicContact CE2-CB 4.16Å; Y97-M129 PolarHBondContact OH-O 3.17Å; L113-M129 HydrophobicContact CD1-SD 4.23Å; N125-M129 WeakPolarHBondContact O-CA 3.25Å; N125-M129 PolarHBondContact O-N 2.83Å; I126-M129 HydrophobicContact CD1-CE 3.94Å; I126-M129 HydrophobicContact CD1-SD 4.46Å; I126-M129 HydrophobicContact CG1-CE 4.45Å; I126-M129 WeakPolarHBondContact O-CE 3.27Å
130	K	96.1	Very high	96.7	Very high	110 Å²	110	45.8 Å²	45.8	48%	0.478	24%	0.236	S	C	.	.			trans	-71.4	138	-178.3	-63.7	-171.2	-168.5	114.4	0	111.4	H124 N125 D128 L132	H124-K130 CarbonylContact C-O 3.53Å; H124-K130 WeakPolarHBondContact CA-O 3.26Å; H124-K130 WeakPolarHBondContact CB-O 3.46Å; N125-K130 PolarHBondContact N-O 3.27Å; D128-K130 PolarHBondContact O-N 2.96Å; D128-K130 PolarHBondContact OD1-N 2.97Å; D128-K130 VanDerWaalsContact OD2-CD 3.32Å; D128-K130 WeakPolarHBondContact OD2-CD 3.48Å; D128-K130 WeakPolarHBondContact OD2-CE 3.42Å; D128-K130 IonicContact OD2-NZ 3.39Å; D128-K130 PolarHBondContact OD2-NZ 3Å; K130-L132 PolarHBondContact O-N 3.01Å
131	L	97.6	Very high	96.6	Very high	83 Å²	83	45.6 Å²	45.6	44%	0.435	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	120.2	166.2	179.3	62.9	0	0	0	109.4	Y122	Y122-L131 HydrophobicContact CD1-CD1 3.79Å; Y122-L131 HydrophobicContact CD1-CD2 4.03Å; Y122-L131 HydrophobicContact CE1-CD2 4.45Å; Y122-L131 HydrophobicContact CG-CD1 4.35Å
132	L	97.9	Very high	96.5	Very high	72 Å²	72	49.4 Å²	49.4	38%	0.377	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-41.2	175.4	-62.1	177.5	0	0	0	111.5	I123 N125 K130 L176	I123-L132 WeakPolarHBondContact O-CB 3.28Å; I123-L132 PolarHBondContact O-N 3.21Å; N125-L132 HydrophobicContact CB-CD1 3.99Å; N125-L132 HydrophobicContact CB-CD2 4.13Å; N125-L132 HydrophobicContact CB-CG 4.05Å; K130-L132 PolarHBondContact O-N 3.01Å; L132-L176 HydrophobicContact CB-CD1 4.15Å
133	K	98.3	Very high	96.3	Very high	91 Å²	91	52.2 Å²	52.2	40%	0.396	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	138.7	-172.4	177.8	63.5	176.9	173	0	110.6	I123 L135 L176	I123-K133 HydrophobicContact CB-CB 4.32Å; I123-K133 WeakPolarHBondContact CB-O 3.39Å; I123-K133 HydrophobicContact CD1-CB 4.26Å; I123-K133 HydrophobicContact CD1-CG 4.24Å; I123-K133 PolarHBondContact N-O 2.84Å; I123-K133 PolarHBondContact O-N 3.41Å; I123-K133 VanDerWaalsContact O-N 3.17Å; K133-L135 HydrophobicContact CG-CD2 4.09Å; K133-L176 HydrophobicContact CB-CD1 4.37Å; K133-L176 HydrophobicContact CB-CD2 4.18Å
134	T	98.3	Very high	96.2	Very high	31 Å²	31	52.4 Å²	52.4	19%	0.19	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	135.6	161	-51.9	0	0	0	0	108.9	I121 Y122 L136	I121-T134 WeakPolarHBondContact O-CA 3.27Å; Y122-T134 HydrophobicContact CD1-CG2 3.9Å; Y122-T134 VanDerWaalsContact CD1-OG1 3.25Å; Y122-T134 WeakPolarHBondContact CD1-OG1 3.43Å; Y122-T134 HydrophobicContact CD2-CG2 4.1Å; Y122-T134 HydrophobicContact CE1-CG2 3.74Å; Y122-T134 WeakPolarHBondContact CE1-OG1 3.21Å; Y122-T134 HydrophobicContact CE2-CG2 3.94Å; Y122-T134 HydrophobicContact CG-CG2 4.08Å; T134-L136 HydrophobicContact CG2-CD2 3.58Å; T134-L136 HydrophobicContact CG2-CG 3.93Å
135	L	98	Very high	96.2	Very high	14 Å²	14	53.5 Å²	53.5	7%	0.073	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	113.9	161.3	-51.1	-176.1	0	0	0	106	S120 I121 I123 K133 I138 L157 Y159 Y171	S120-L135 CarbonylContact C-O 3.56Å; S120-L135 WeakPolarHBondContact CA-O 3.18Å; S120-L135 WeakPolarHBondContact CB-O 3.38Å; I121-L135 HydrophobicContact CB-CB 4.31Å; I121-L135 HydrophobicContact CB-CD1 4.36Å; I121-L135 PolarHBondContact N-O 2.97Å; I121-L135 PolarHBondContact O-N 2.83Å; I123-L135 HydrophobicContact CD1-CD1 4.3Å; I123-L135 HydrophobicContact CD1-CD2 4.38Å; I123-L135 HydrophobicContact CD1-CG 4.18Å; K133-L135 HydrophobicContact CG-CD2 4.09Å; L135-I138 HydrophobicContact CB-CG2 4.14Å; L135-L157 HydrophobicContact CD1-CD1 4.46Å; L135-Y159 HydrophobicContact CD1-CE1 3.81Å; L135-Y171 HydrophobicContact CD1-CD2 4.33Å; L135-Y171 HydrophobicContact CD1-CE2 4.42Å; L135-Y171 HydrophobicContact CD1-CG 4.45Å; L135-Y171 HydrophobicContact CD2-CD2 4.34Å; L135-Y171 HydrophobicContact CD2-CE1 4.45Å; L135-Y171 HydrophobicContact CD2-CE2 3.67Å
136	L	96.3	Very high	96.2	Very high	107 Å²	107	52.4 Å²	52.4	56%	0.56	28%	0.282	S	S	*	.			trans	-102.6	166.4	174.8	-63.9	174	0	0	0	108.8	T134 I138	T134-L136 HydrophobicContact CG2-CD2 3.58Å; T134-L136 HydrophobicContact CG2-CG 3.93Å; L136-I138 PolarHBondContact O-N 2.83Å; L136-I138 VanDerWaalsContact O-N 3.13Å
137	D	92.6	Very high	96.3	Very high	157 Å²	157	52.5 Å²	52.5	84%	0.84	28%	0.284	S	S	*	.	S	Bend	trans	56.5	31.4	171.6	-42	-47.2	0	0	0	113	E119	E119-D137 PolarHBondContact O-N 3.06Å
138	I	96.1	Very high	96.6	Very high	13 Å²	13	50.1 Å²	50.1	7%	0.067	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-77	151.5	170.9	66	163.1	0	0	0	109.6	E119 I121 L135 L136 A140 Y159	E119-I138 WeakPolarHBondContact O-CG1 3.44Å; E119-I138 PolarHBondContact O-N 2.67Å; I121-I138 HydrophobicContact CD1-CD1 3.81Å; I121-I138 HydrophobicContact CG1-CD1 3.81Å; L135-I138 HydrophobicContact CB-CG2 4.14Å; L136-I138 PolarHBondContact O-N 2.83Å; L136-I138 VanDerWaalsContact O-N 3.13Å; I138-A140 PolarHBondContact O-N 2.88Å; I138-Y159 HydrophobicContact CB-CD2 4.46Å; I138-Y159 HydrophobicContact CB-CE2 4.02Å; I138-Y159 HydrophobicContact CD1-CD2 4.25Å; I138-Y159 HydrophobicContact CG2-CD2 4.39Å; I138-Y159 HydrophobicContact CG2-CE2 3.61Å
139	P	95.9	Very high	96.7	Very high	45 Å²	45	48 Å²	48	29%	0.292	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-55.4	138.9	175.5	-25.1	35.1	0	0	0	111.8	N141 G161	P139-N141 PolarHBondContact O-N 2.8Å; P139-G161 WeakPolarHBondContact CG-O 3.45Å
140	A	95.6	Very high	96.7	Very high	29 Å²	29	49.1 Å²	49.1	24%	0.24	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-53.1	121.9	-176	0	0	0	0	0	112	E118 E119 I138 P142 L163	E118-A140 HydrophobicContact CG-CB 4.39Å; E119-A140 HydrophobicContact CG-CB 4.39Å; I138-A140 PolarHBondContact O-N 2.88Å; A140-P142 VanDerWaalsContact C-CD 3.41Å; A140-P142 VanDerWaalsContact O-CD 3.24Å; A140-P142 WeakPolarHBondContact O-CD 3.3Å; A140-L163 HydrophobicContact CB-CD1 4.48Å
141	N	95.9	Very high	96.6	Very high	5 Å²	5	45.8 Å²	45.8	3%	0.027	26%	0.256	C	S	.	.			trans	-120.4	67.7	-172.3	-173	5.6	0	0	0	110	L104 E118 P139 T143 G144 L145	L104-N141 WeakPolarHBondContact CD1-O 3.42Å; E118-N141 WeakPolarHBondContact O-CB 3.46Å; E118-N141 PolarHBondContact O-N 2.96Å; P139-N141 PolarHBondContact O-N 2.8Å; N141-T143 PolarHBondContact O-N 3.01Å; N141-T143 VanDerWaalsContact O-N 3.08Å; N141-T143 PolarHBondContact OD1-OG1 3.39Å; N141-G144 PolarHBondContact O-N 3.39Å; N141-G144 PolarHBondContact OD1-N 3.03Å; N141-L145 PolarHBondContact ND2-N 3.27Å; N141-L145 PolarHBondContact ND2-O 2.94Å; N141-L145 PolarHBondContact OD1-N 3.04Å
142	P	95.5	Very high	96.3	Very high	81 Å²	81	45.9 Å²	45.9	53%	0.526	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-14.6	-171	27	-36.6	0	0	0	114	A140	A140-P142 VanDerWaalsContact C-CD 3.41Å; A140-P142 VanDerWaalsContact O-CD 3.24Å; A140-P142 WeakPolarHBondContact O-CD 3.3Å
143	T	94.6	Very high	96	Very high	98 Å²	98	46.2 Å²	46.2	60%	0.601	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-7.9	173.5	56.4	0	0	0	0	113.2	N141 L145	N141-T143 PolarHBondContact O-N 3.01Å; N141-T143 VanDerWaalsContact O-N 3.08Å; N141-T143 PolarHBondContact OD1-OG1 3.39Å; T143-L145 PolarHBondContact O-N 2.82Å
144	G	96.8	Very high	95.7	Very high	3 Å²	3	44.7 Å²	44.7	3%	0.031	26%	0.259	C	S	.	.			trans	63	27.1	-173.1	0	0	0	0	0	113.3	L104 S105 N141 C146	L104-G144 VanDerWaalsContact CB-CA 3.47Å; S105-G144 VanDerWaalsContact CB-O 3.29Å; S105-G144 WeakPolarHBondContact CB-O 3.4Å; S105-G144 PolarHBondContact OG-O 2.83Å; N141-G144 PolarHBondContact O-N 3.39Å; N141-G144 PolarHBondContact OD1-N 3.03Å; G144-C146 PolarHBondContact O-N 3Å
145	L	97.8	Very high	95.6	Very high	26 Å²	26	43.2 Å²	43.2	14%	0.136	25%	0.25	C	C	.	.			trans	-66.4	106	-174.4	-178.5	61	0	0	0	110.4	N141 T143 P160 L189 I192	N141-L145 PolarHBondContact ND2-N 3.27Å; N141-L145 PolarHBondContact ND2-O 2.94Å; N141-L145 PolarHBondContact OD1-N 3.04Å; T143-L145 PolarHBondContact O-N 2.82Å; L145-P160 HydrophobicContact CB-CG 4.36Å; L145-P160 HydrophobicContact CD2-CG 4.34Å; L145-P160 WeakPolarHBondContact O-CD 3.44Å; L145-L189 HydrophobicContact CD2-CB 3.66Å; L145-L189 WeakPolarHBondContact CD2-O 3.29Å; L145-I192 HydrophobicContact CD1-CG1 3.82Å; L145-I192 HydrophobicContact CD2-CG1 4.32Å; L145-I192 HydrophobicContact CG-CD1 4.21Å; L145-I192 HydrophobicContact CG-CG1 3.86Å
146	C	97.7	Very high	95.6	Very high	8 Å²	8	44.2 Å²	44.2	5%	0.054	25%	0.253	C	S	.	.			trans	-144.9	151.6	170	75.5	0	0	0	0	111.5	S105 R107 G144 A158	S105-C146 PolarHBondContact OG-SG 2.85Å; R107-C146 PolarHBondContact NE-O 2.82Å; G144-C146 PolarHBondContact O-N 3Å; C146-A158 WeakPolarHBondContact CA-O 3.49Å
147	A	98.3	Very high	95.7	Very high	7 Å²	7	39.2 Å²	39.2	6%	0.058	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	149.2	173.6	0	0	0	0	0	110.6	L157 A158 I192 F194	A147-L157 CarbonylContact O-C 3.43Å; A147-L157 VanDerWaalsContact O-CA 3.27Å; A147-L157 WeakPolarHBondContact O-CA 3.43Å; A147-A158 PolarHBondContact N-O 3.03Å; A147-A158 PolarHBondContact O-N 3.45Å; A147-I192 HydrophobicContact CB-CD1 4.23Å; A147-I192 HydrophobicContact CB-CG1 4.1Å; A147-F194 HydrophobicContact CB-CD2 3.85Å; A147-F194 HydrophobicContact CB-CE2 4.02Å
148	L	98.5	Very high	96	Very high	17 Å²	17	31.8 Å²	31.8	9%	0.089	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	133.4	174.9	177.5	67.7	0	0	0	107.9	R107 N109 R112 L114 L157	R107-L148 HydrophobicContact CB-CB 3.83Å; R107-L148 HydrophobicContact CB-CD2 4.26Å; N109-L148 HydrophobicContact CB-CD2 3.83Å; N109-L148 HydrophobicContact CB-CG 4.27Å; R112-L148 HydrophobicContact CB-CD1 4.46Å; R112-L148 HydrophobicContact CB-CD2 4.39Å; L114-L148 HydrophobicContact CD1-CB 4Å; L114-L148 HydrophobicContact CD1-CD1 4.05Å; L114-L148 HydrophobicContact CD1-CG 4.4Å; L114-L148 HydrophobicContact CG-CD1 4.32Å; L114-L148 HydrophobicContact CG-CD2 4.26Å; L148-L157 HydrophobicContact CD1-CB 4.15Å
149	S	97.7	Very high	96.2	Very high	0 Å²	0	32 Å²	32	0%	0	19%	0.187	C	C	.	.			trans	-63	131.5	171.9	172.2	0	0	0	0	110.4	N109 N151 N154 Y156 G198	N109-S149 WeakPolarHBondContact CB-O 3.36Å; N109-S149 PolarHBondContact ND2-O 2.88Å; S149-N151 VanDerWaalsContact C-N 3.27Å; S149-N151 PolarHBondContact O-N 3.44Å; S149-N151 PolarHBondContact OG-N 2.82Å; S149-N151 PolarHBondContact OG-O 2.91Å; S149-N154 WeakPolarHBondContact CB-O 3.28Å; S149-N154 PolarHBondContact OG-O 2.9Å; S149-Y156 WeakPolarHBondContact CB-O 3.21Å; S149-Y156 PolarHBondContact N-O 3.25Å; S149-G198 VanDerWaalsContact OG-CA 3.29Å; S149-G198 WeakPolarHBondContact OG-CA 3.49Å
150	I	96	Very high	96.3	Very high	35 Å²	35	30.5 Å²	30.5	18%	0.179	18%	0.177	C	C	.	.	S	Bend	trans	-73.8	-23.9	178.6	74.4	174.2	0	0	0	111.8	Q24 F67 H152 A196 M242	Q24-I150 HydrophobicContact CB-CB 4.19Å; Q24-I150 HydrophobicContact CB-CG2 3.74Å; Q24-I150 HydrophobicContact CG-CG2 4.06Å; Q24-I150 WeakPolarHBondContact O-CD1 3.4Å; F67-I150 HydrophobicContact CZ-CB 4.21Å; I150-H152 PolarHBondContact O-N 2.81Å; I150-A196 HydrophobicContact CD1-CB 3.88Å; I150-A196 HydrophobicContact CG1-CB 4.49Å; I150-A196 VanDerWaalsContact CG1-O 3.25Å; I150-A196 WeakPolarHBondContact CG1-O 3.43Å; I150-M242 HydrophobicContact CD1-CE 3.79Å; I150-M242 HydrophobicContact CD1-SD 4.11Å
151	N	94.3	Very high	96.3	Very high	39 Å²	39	30 Å²	30	21%	0.209	18%	0.176	C	C	.	.			trans	-73.4	114.7	173.8	178.8	4	0	0	0	109.6	S149 S153 N154 S155 S197	S149-N151 VanDerWaalsContact C-N 3.27Å; S149-N151 PolarHBondContact O-N 3.44Å; S149-N151 PolarHBondContact OG-N 2.82Å; S149-N151 PolarHBondContact OG-O 2.91Å; N151-S153 WeakPolarHBondContact OD1-CB 3.39Å; N151-S153 PolarHBondContact OD1-N 3.32Å; N151-N154 HydrophobicContact CB-CB 4.38Å; N151-N154 PolarHBondContact ND2-ND2 3.28Å; N151-N154 CarbonylContact O-C 3.59Å; N151-N154 PolarHBondContact O-N 2.89Å; N151-N154 VanDerWaalsContact O-O 3.14Å; N151-S155 WeakPolarHBondContact O-CA 3.41Å; N151-S155 PolarHBondContact O-N 3.32Å; N151-S197 PolarHBondContact ND2-O 2.82Å
152	H	89.6	Confident	96.4	Very high	86 Å²	86	31 Å²	31	40%	0.398	18%	0.182	S	C	.	.	S	Bend	trans	-68.6	-35.1	-179.5	57.6	-89	0	0	0	112.8	R110 Q111 I150 N154 S155 N174	R110-H152 HydrophobicContact CB-CB 4.44Å; Q111-H152 HydrophobicContact CB-CB 3.96Å; Q111-H152 PolarHBondContact OE1-O 2.98Å; I150-H152 PolarHBondContact O-N 2.81Å; H152-N154 VanDerWaalsContact C-N 3.28Å; H152-N154 PolarHBondContact O-N 2.83Å; H152-S155 VanDerWaalsContact O-CB 3.26Å; H152-S155 WeakPolarHBondContact O-CB 3.21Å; H152-S155 PolarHBondContact O-N 3.45Å; H152-N174 PolarHBondContact O-ND2 3.09Å
153	S	92.3	Very high	96.3	Very high	78 Å²	78	32.1 Å²	32.1	55%	0.545	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-40.3	175.1	-55.3	0	0	0	0	111.5	N151 N174	N151-S153 WeakPolarHBondContact OD1-CB 3.39Å; N151-S153 PolarHBondContact OD1-N 3.32Å; S153-N174 PolarHBondContact O-ND2 2.96Å
154	N	92.7	Very high	96.3	Very high	60 Å²	60	32.7 Å²	32.7	32%	0.321	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	55.1	175.5	-63.2	-7.6	0	0	0	110.2	S149 N151 H152 Y156 S197	S149-N154 WeakPolarHBondContact CB-O 3.28Å; S149-N154 PolarHBondContact OG-O 2.9Å; N151-N154 HydrophobicContact CB-CB 4.38Å; N151-N154 PolarHBondContact ND2-ND2 3.28Å; N151-N154 CarbonylContact O-C 3.59Å; N151-N154 PolarHBondContact O-N 2.89Å; N151-N154 VanDerWaalsContact O-O 3.14Å; H152-N154 VanDerWaalsContact C-N 3.28Å; H152-N154 PolarHBondContact O-N 2.83Å; N154-Y156 HydrophobicContact CB-CD2 4.02Å; N154-Y156 HydrophobicContact CB-CE2 3.84Å; N154-Y156 WeakPolarHBondContact O-CD2 3.43Å; N154-Y156 PolarHBondContact O-N 2.88Å; N154-S197 PolarHBondContact ND2-O 2.94Å; N154-S197 VanDerWaalsContact ND2-O 3.14Å
155	S	96.2	Very high	96.3	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	20%	0.195	C	C	.	.			trans	-74.9	51.4	-173.7	-177.1	0	0	0	0	113.7	N109 R112 N151 H152 G173	N109-S155 PolarHBondContact ND2-OG 2.87Å; R112-S155 WeakPolarHBondContact CG-OG 3.37Å; N151-S155 WeakPolarHBondContact O-CA 3.41Å; N151-S155 PolarHBondContact O-N 3.32Å; H152-S155 VanDerWaalsContact O-CB 3.26Å; H152-S155 WeakPolarHBondContact O-CB 3.21Å; H152-S155 PolarHBondContact O-N 3.45Å; S155-G173 VanDerWaalsContact O-CA 3.3Å; S155-G173 WeakPolarHBondContact O-CA 3.26Å; S155-G173 PolarHBondContact O-N 2.76Å
156	Y	98.4	Very high	96.3	Very high	35 Å²	35	32.6 Å²	32.6	14%	0.137	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	146.4	172.3	-60	-67.5	0	0	0	112	S149 N154 L170 Y171 D172 V179 V216 P217	S149-Y156 WeakPolarHBondContact CB-O 3.21Å; S149-Y156 PolarHBondContact N-O 3.25Å; N154-Y156 HydrophobicContact CB-CD2 4.02Å; N154-Y156 HydrophobicContact CB-CE2 3.84Å; N154-Y156 WeakPolarHBondContact O-CD2 3.43Å; N154-Y156 PolarHBondContact O-N 2.88Å; Y156-L170 HydrophobicContact CD1-CD1 4.47Å; Y156-L170 HydrophobicContact CG-CD1 4.36Å; Y156-Y171 CarbonylContact C-O 3.5Å; Y156-Y171 WeakPolarHBondContact CA-O 3.32Å; Y156-D172 HydrophobicContact CD1-CB 4.07Å; Y156-D172 HydrophobicContact CE1-CB 4Å; Y156-V179 HydrophobicContact CD1-CG2 4.24Å; Y156-V179 HydrophobicContact CE1-CG2 4.06Å; Y156-V216 HydrophobicContact CD1-CG1 4.47Å; Y156-V216 HydrophobicContact CD2-CG1 3.37Å; Y156-V216 HydrophobicContact CE2-CG1 3.69Å; Y156-V216 HydrophobicContact CG-CG1 3.82Å; Y156-P217 HydrophobicContact CE1-CB 4.46Å
157	L	98.3	Very high	96.3	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.01	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	152.8	168.4	68.8	88.2	0	0	0	110.1	L114 I123 L135 A147 L148 Y159 Y171	L114-L157 HydrophobicContact CD1-CB 3.74Å; L114-L157 HydrophobicContact CD1-CD2 3.99Å; L114-L157 HydrophobicContact CD1-CG 4.37Å; L114-L157 HydrophobicContact CD2-CD2 3.75Å; I123-L157 HydrophobicContact CD1-CD2 3.78Å; I123-L157 HydrophobicContact CG1-CD2 4.16Å; L135-L157 HydrophobicContact CD1-CD1 4.46Å; A147-L157 CarbonylContact O-C 3.43Å; A147-L157 VanDerWaalsContact O-CA 3.27Å; A147-L157 WeakPolarHBondContact O-CA 3.43Å; L148-L157 HydrophobicContact CD1-CB 4.15Å; L157-Y159 HydrophobicContact CD1-CD1 3.6Å; L157-Y159 HydrophobicContact CD1-CE1 3.81Å; L157-Y171 HydrophobicContact CD1-CD1 4.22Å; L157-Y171 HydrophobicContact CD1-CG 4.28Å; L157-Y171 HydrophobicContact CD2-CD1 3.8Å; L157-Y171 HydrophobicContact CD2-CE1 4.42Å; L157-Y171 HydrophobicContact CG-CD1 3.93Å; L157-Y171 HydrophobicContact CG-CG 4.38Å; L157-Y171 PolarHBondContact N-O 3.22Å; L157-Y171 PolarHBondContact O-N 2.93Å
158	A	98.7	Very high	96.3	Very high	0 Å²	0	35 Å²	35	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	139.1	-178.1	0	0	0	0	0	110.8	C146 A147 I168 V169 I192 F194 L201	C146-A158 WeakPolarHBondContact CA-O 3.49Å; A147-A158 PolarHBondContact N-O 3.03Å; A147-A158 PolarHBondContact O-N 3.45Å; A158-I168 HydrophobicContact CB-CG2 3.81Å; A158-V169 WeakPolarHBondContact CA-O 3.29Å; A158-I192 HydrophobicContact CB-CD1 4.07Å; A158-I192 VanDerWaalsContact O-CD1 3.26Å; A158-I192 WeakPolarHBondContact O-CD1 3.41Å; A158-F194 HydrophobicContact CB-CE2 3.72Å; A158-F194 HydrophobicContact CB-CZ 3.69Å; A158-L201 HydrophobicContact CB-CD1 4.02Å; A158-L201 HydrophobicContact CB-CD2 4.18Å
159	Y	98.6	Very high	96.3	Very high	17 Å²	17	35 Å²	35	7%	0.067	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	161.9	178.9	61.9	-84.6	0	0	0	111.1	I121 L135 I138 L157 G161 I168 V169	I121-Y159 HydrophobicContact CD1-CD1 3.85Å; I121-Y159 HydrophobicContact CD1-CD2 4.18Å; I121-Y159 HydrophobicContact CD1-CE1 4.48Å; I121-Y159 HydrophobicContact CD1-CG 3.68Å; L135-Y159 HydrophobicContact CD1-CE1 3.81Å; I138-Y159 HydrophobicContact CB-CD2 4.46Å; I138-Y159 HydrophobicContact CB-CE2 4.02Å; I138-Y159 HydrophobicContact CD1-CD2 4.25Å; I138-Y159 HydrophobicContact CG2-CD2 4.39Å; I138-Y159 HydrophobicContact CG2-CE2 3.61Å; L157-Y159 HydrophobicContact CD1-CD1 3.6Å; L157-Y159 HydrophobicContact CD1-CE1 3.81Å; Y159-G161 PolarHBondContact O-N 2.89Å; Y159-I168 WeakPolarHBondContact O-CA 3.45Å; Y159-V169 HydrophobicContact CD1-CB 4.38Å; Y159-V169 HydrophobicContact CD2-CB 4.39Å; Y159-V169 HydrophobicContact CE1-CB 3.94Å; Y159-V169 HydrophobicContact CE1-CG1 3.87Å; Y159-V169 HydrophobicContact CE2-CB 3.94Å; Y159-V169 HydrophobicContact CE2-CG1 4.38Å; Y159-V169 HydrophobicContact CE2-CG2 4.15Å; Y159-V169 PolarHBondContact N-O 2.93Å; Y159-V169 PolarHBondContact O-N 2.9Å
160	P	98.3	Very high	96.4	Very high	14 Å²	14	35 Å²	35	9%	0.091	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	129.9	176.4	-26	34.4	0	0	0	113.4	L145 E167 L189	L145-P160 HydrophobicContact CB-CG 4.36Å; L145-P160 HydrophobicContact CD2-CG 4.34Å; L145-P160 WeakPolarHBondContact O-CD 3.44Å; P160-E167 WeakPolarHBondContact CA-O 3.47Å; P160-L189 HydrophobicContact CB-CD1 4.32Å; P160-L189 HydrophobicContact CG-CD1 4.27Å
161	G	97.3	Very high	96.5	Very high	20 Å²	20	33.7 Å²	33.7	21%	0.206	19%	0.191	C	C	.	.	S	Bend	trans	-91.5	-3.2	174.3	0	0	0	0	0	114.5	P139 Y159 E167	P139-G161 WeakPolarHBondContact CG-O 3.45Å; Y159-G161 PolarHBondContact O-N 2.89Å; G161-E167 PolarHBondContact N-O 2.99Å
162	S	96.5	Very high	96.7	Very high	24 Å²	24	33.1 Å²	33.1	17%	0.168	19%	0.188	C	C	.	.			trans	-156.1	154	-179.3	177.8	0	0	0	0	111.1	T164 S165	S162-T164 PolarHBondContact OG-N 2.52Å; S162-S165 WeakPolarHBondContact CB-OG 3.48Å; S162-S165 PolarHBondContact OG-N 2.94Å; S162-S165 VanDerWaalsContact OG-N 3.14Å; S162-S165 PolarHBondContact OG-OG 2.95Å
163	L	94.6	Very high	97	Very high	105 Å²	105	29 Å²	29	55%	0.55	17%	0.169	S	C	.	.	S	Bend	trans	-84.1	-16.9	173.8	-179.2	59.6	0	0	0	112.4	A140 T188	A140-L163 HydrophobicContact CB-CD1 4.48Å; L163-T188 VanDerWaalsContact O-CG2 3.27Å; L163-T188 WeakPolarHBondContact O-CG2 3.38Å
164	T	94.8	Very high	97.2	Very high	110 Å²	110	27.7 Å²	27.7	68%	0.675	16%	0.156	S	C	*	.	S	Bend	trans	-122.8	-37	-172.7	57.9	0	0	0	0	113.9	S162 G187 T188	S162-T164 PolarHBondContact OG-N 2.52Å; T164-G187 WeakPolarHBondContact O-CA 3.46Å; T164-T188 PolarHBondContact O-N 2.71Å
165	S	96.3	Very high	97.4	Very high	28 Å²	28	27.7 Å²	27.7	20%	0.196	16%	0.16	C	C	.	.	S	Bend	trans	-95.1	155.7	174.8	44.7	0	0	0	0	111.3	S162 E167	S162-S165 WeakPolarHBondContact CB-OG 3.48Å; S162-S165 PolarHBondContact OG-N 2.94Å; S162-S165 VanDerWaalsContact OG-N 3.14Å; S162-S165 PolarHBondContact OG-OG 2.95Å; S165-E167 WeakPolarHBondContact CB-OE1 3.4Å; S165-E167 PolarHBondContact O-N 2.8Å; S165-E167 PolarHBondContact OG-OE1 2.86Å
166	G	96.9	Very high	97.5	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	50.1	178.4	0	0	0	0	0	112.6	A184 H185 G187	G166-A184 WeakPolarHBondContact O-CA 3.29Å; G166-A184 WeakPolarHBondContact O-CB 3.32Å; G166-A184 PolarHBondContact O-N 3.5Å; G166-H185 WeakPolarHBondContact CA-O 3.14Å; G166-H185 PolarHBondContact N-O 2.91Å; G166-H185 PolarHBondContact O-N 3.48Å; G166-G187 WeakPolarHBondContact CA-O 3.34Å; G166-G187 VanDerWaalsContact N-C 3.34Å; G166-G187 PolarHBondContact N-O 3.16Å
167	E	98.2	Very high	97.4	Very high	66 Å²	66	35.1 Å²	35.1	31%	0.308	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	141.5	177.6	-75.8	167.8	-122.4	0	0	111	P160 G161 S165 T181 I182 L189	P160-E167 WeakPolarHBondContact CA-O 3.47Å; G161-E167 PolarHBondContact N-O 2.99Å; S165-E167 WeakPolarHBondContact CB-OE1 3.4Å; S165-E167 PolarHBondContact O-N 2.8Å; S165-E167 PolarHBondContact OG-OE1 2.86Å; E167-T181 HydrophobicContact CB-CG2 4.19Å; E167-T181 HydrophobicContact CG-CG2 4.49Å; E167-I182 CarbonylContact C-O 3.58Å; E167-I182 WeakPolarHBondContact CA-O 3.18Å; E167-L189 WeakPolarHBondContact O-CD1 3.27Å
168	I	98.7	Very high	97.4	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	123.9	175.5	-48.7	163.4	0	0	0	108.5	A158 Y159 T181 I182 A184 L189 I192 L201	A158-I168 HydrophobicContact CB-CG2 3.81Å; Y159-I168 WeakPolarHBondContact O-CA 3.45Å; I168-T181 CarbonylContact O-C 3.52Å; I168-T181 WeakPolarHBondContact O-CA 3.26Å; I168-I182 HydrophobicContact CB-CB 4.4Å; I168-I182 PolarHBondContact N-O 3.25Å; I168-I182 PolarHBondContact O-N 3.27Å; I168-A184 HydrophobicContact CD1-CB 3.68Å; I168-A184 HydrophobicContact CG1-CB 4.13Å; I168-L189 HydrophobicContact CG1-CD1 3.59Å; I168-L189 HydrophobicContact CG1-CD2 4.26Å; I168-I192 HydrophobicContact CD1-CG2 3.97Å; I168-I192 HydrophobicContact CG1-CG2 4.22Å; I168-L201 HydrophobicContact CD1-CD2 4.11Å; I168-L201 HydrophobicContact CG2-CD2 4.13Å
169	V	98.6	Very high	97.4	Very high	16 Å²	16	41.8 Å²	41.8	10%	0.097	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	123	166.3	-179.9	0	0	0	0	108.4	A158 Y159 T178	A158-V169 WeakPolarHBondContact CA-O 3.29Å; Y159-V169 HydrophobicContact CD1-CB 4.38Å; Y159-V169 HydrophobicContact CD2-CB 4.39Å; Y159-V169 HydrophobicContact CE1-CB 3.94Å; Y159-V169 HydrophobicContact CE1-CG1 3.87Å; Y159-V169 HydrophobicContact CE2-CB 3.94Å; Y159-V169 HydrophobicContact CE2-CG1 4.38Å; Y159-V169 HydrophobicContact CE2-CG2 4.15Å; Y159-V169 PolarHBondContact N-O 2.93Å; Y159-V169 PolarHBondContact O-N 2.9Å; V169-T178 HydrophobicContact CG1-CG2 3.72Å
170	L	98.6	Very high	97.3	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	127.3	169.2	-176.7	69.9	0	0	0	108.9	Y156 V179 C180 F194 V216 P217	Y156-L170 HydrophobicContact CD1-CD1 4.47Å; Y156-L170 HydrophobicContact CG-CD1 4.36Å; L170-V179 HydrophobicContact CB-CB 4.37Å; L170-V179 HydrophobicContact CD2-CB 3.99Å; L170-V179 HydrophobicContact CD2-CG1 3.86Å; L170-V179 HydrophobicContact CG-CB 4.06Å; L170-V179 HydrophobicContact CG-CG1 4.48Å; L170-V179 HydrophobicContact CG-CG2 4.41Å; L170-V179 PolarHBondContact O-N 2.91Å; L170-C180 PolarHBondContact N-O 3.36Å; L170-C180 PolarHBondContact O-N 3.43Å; L170-F194 HydrophobicContact CD1-CE1 3.9Å; L170-F194 HydrophobicContact CD1-CZ 3.76Å; L170-V216 HydrophobicContact CD1-CG1 4.19Å; L170-V216 HydrophobicContact CD2-CG1 4Å; L170-P217 HydrophobicContact CD2-CB 4.49Å; L170-P217 WeakPolarHBondContact CD2-O 3.47Å
171	Y	98.5	Very high	97.3	Very high	7 Å²	7	45.6 Å²	45.6	3%	0.027	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	136.7	-177.4	-176.4	-80.8	0	0	0	110.2	I123 L135 Y156 L157 L176 K177 T178	I123-Y171 HydrophobicContact CD1-CD1 4.2Å; I123-Y171 HydrophobicContact CD1-CE1 3.54Å; L135-Y171 HydrophobicContact CD1-CD2 4.33Å; L135-Y171 HydrophobicContact CD1-CE2 4.42Å; L135-Y171 HydrophobicContact CD1-CG 4.45Å; L135-Y171 HydrophobicContact CD2-CD2 4.34Å; L135-Y171 HydrophobicContact CD2-CE1 4.45Å; L135-Y171 HydrophobicContact CD2-CE2 3.67Å; Y156-Y171 CarbonylContact C-O 3.5Å; Y156-Y171 WeakPolarHBondContact CA-O 3.32Å; L157-Y171 HydrophobicContact CD1-CD1 4.22Å; L157-Y171 HydrophobicContact CD1-CG 4.28Å; L157-Y171 HydrophobicContact CD2-CD1 3.8Å; L157-Y171 HydrophobicContact CD2-CE1 4.42Å; L157-Y171 HydrophobicContact CG-CD1 3.93Å; L157-Y171 HydrophobicContact CG-CG 4.38Å; L157-Y171 PolarHBondContact N-O 3.22Å; L157-Y171 PolarHBondContact O-N 2.93Å; Y171-L176 HydrophobicContact CE1-CD2 4.31Å; Y171-L176 WeakPolarHBondContact OH-CA 3.32Å; Y171-L176 PolarHBondContact OH-O 3.08Å; Y171-K177 WeakPolarHBondContact CD2-O 3.34Å; Y171-K177 VanDerWaalsContact CE2-C 3.43Å; Y171-T178 VanDerWaalsContact CD2-N 3.33Å
172	D	97.9	Very high	97.4	Very high	27 Å²	27	45 Å²	45	14%	0.144	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	110.9	179.4	175.9	7.5	0	0	0	110	Y156 N174 S175 L176 K177 V179	Y156-D172 HydrophobicContact CD1-CB 4.07Å; Y156-D172 HydrophobicContact CE1-CB 4Å; D172-N174 PolarHBondContact O-N 3Å; D172-N174 WeakPolarHBondContact OD1-CA 3.38Å; D172-N174 WeakPolarHBondContact OD1-CB 3.16Å; D172-N174 PolarHBondContact OD1-N 2.97Å; D172-S175 VanDerWaalsContact CG-OG 3.27Å; D172-S175 PolarHBondContact OD1-N 2.85Å; D172-S175 WeakPolarHBondContact OD2-CB 3.31Å; D172-S175 PolarHBondContact OD2-N 2.8Å; D172-S175 VanDerWaalsContact OD2-N 3.15Å; D172-S175 PolarHBondContact OD2-OG 2.87Å; D172-L176 WeakPolarHBondContact O-CA 3.46Å; D172-L176 PolarHBondContact O-N 3.45Å; D172-K177 PolarHBondContact N-O 3.46Å; D172-K177 PolarHBondContact O-N 3.34Å; D172-V179 HydrophobicContact CB-CG2 3.71Å
173	G	96.8	Very high	97.4	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.01	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-15.6	176.7	0	0	0	0	0	114.1	R112 S155 L176	R112-G173 VanDerWaalsContact CZ-O 3.23Å; R112-G173 PolarHBondContact NE-O 3.24Å; R112-G173 PolarHBondContact NH2-O 2.72Å; S155-G173 VanDerWaalsContact O-CA 3.3Å; S155-G173 WeakPolarHBondContact O-CA 3.26Å; S155-G173 PolarHBondContact O-N 2.76Å; G173-L176 WeakPolarHBondContact O-CD2 3.46Å
174	N	96.3	Very high	97.6	Very high	50 Å²	50	43.2 Å²	43.2	27%	0.267	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-52.6	178	-74.2	-19.9	0	0	0	112	Q111 H152 S153 D172 L176	Q111-N174 VanDerWaalsContact CD-OD1 3.32Å; Q111-N174 PolarHBondContact NE2-OD1 3.11Å; Q111-N174 PolarHBondContact OE1-OD1 3.49Å; Q111-N174 VanDerWaalsContact OE1-OD1 3.06Å; H152-N174 PolarHBondContact O-ND2 3.09Å; S153-N174 PolarHBondContact O-ND2 2.96Å; D172-N174 PolarHBondContact O-N 3Å; D172-N174 WeakPolarHBondContact OD1-CA 3.38Å; D172-N174 WeakPolarHBondContact OD1-CB 3.16Å; D172-N174 PolarHBondContact OD1-N 2.97Å; N174-L176 VanDerWaalsContact C-N 3.31Å
175	S	97	Very high	97.7	Very high	59 Å²	59	38.5 Å²	38.5	41%	0.413	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-8.6	174.5	71.5	0	0	0	0	114.7	D172	D172-S175 VanDerWaalsContact CG-OG 3.27Å; D172-S175 PolarHBondContact OD1-N 2.85Å; D172-S175 WeakPolarHBondContact OD2-CB 3.31Å; D172-S175 PolarHBondContact OD2-N 2.8Å; D172-S175 VanDerWaalsContact OD2-N 3.15Å; D172-S175 PolarHBondContact OD2-OG 2.87Å
176	L	97.7	Very high	97.7	Very high	54 Å²	54	45.3 Å²	45.3	28%	0.283	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.1	48.2	-177.4	-61.2	173.8	0	0	0	112.7	I123 L132 K133 Y171 D172 G173 N174	I123-L176 HydrophobicContact CD1-CD2 4.24Å; I123-L176 HydrophobicContact CG2-CD2 4.16Å; L132-L176 HydrophobicContact CB-CD1 4.15Å; K133-L176 HydrophobicContact CB-CD1 4.37Å; K133-L176 HydrophobicContact CB-CD2 4.18Å; Y171-L176 HydrophobicContact CE1-CD2 4.31Å; Y171-L176 WeakPolarHBondContact OH-CA 3.32Å; Y171-L176 PolarHBondContact OH-O 3.08Å; D172-L176 WeakPolarHBondContact O-CA 3.46Å; D172-L176 PolarHBondContact O-N 3.45Å; G173-L176 WeakPolarHBondContact O-CD2 3.46Å; N174-L176 VanDerWaalsContact C-N 3.31Å
177	K	97.4	Very high	97.6	Very high	138 Å²	138	45.8 Å²	45.8	60%	0.6	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.7	148.7	-178.8	-67.5	173.5	-174	177.9	0	112.2	Y171 D172	Y171-K177 WeakPolarHBondContact CD2-O 3.34Å; Y171-K177 VanDerWaalsContact CE2-C 3.43Å; D172-K177 PolarHBondContact N-O 3.46Å; D172-K177 PolarHBondContact O-N 3.34Å
178	T	97.7	Very high	97.5	Very high	84 Å²	84	44.8 Å²	44.8	52%	0.515	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	136.3	165.5	-50.7	0	0	0	0	109.6	V169 Y171	V169-T178 HydrophobicContact CG1-CG2 3.72Å; Y171-T178 VanDerWaalsContact CD2-N 3.33Å
179	V	97.8	Very high	97.5	Very high	58 Å²	58	45.5 Å²	45.5	35%	0.352	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	-57.3	-179.1	179.8	0	0	0	0	110	Y156 L170 D172 P217	Y156-V179 HydrophobicContact CD1-CG2 4.24Å; Y156-V179 HydrophobicContact CE1-CG2 4.06Å; L170-V179 HydrophobicContact CB-CB 4.37Å; L170-V179 HydrophobicContact CD2-CB 3.99Å; L170-V179 HydrophobicContact CD2-CG1 3.86Å; L170-V179 HydrophobicContact CG-CB 4.06Å; L170-V179 HydrophobicContact CG-CG1 4.48Å; L170-V179 HydrophobicContact CG-CG2 4.41Å; L170-V179 PolarHBondContact O-N 2.91Å; D172-V179 HydrophobicContact CB-CG2 3.71Å; V179-P217 HydrophobicContact CG1-CB 3.77Å
180	C	97.4	Very high	97.4	Very high	34 Å²	34	46.1 Å²	46.1	23%	0.23	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	169	-179.6	64.5	0	0	0	0	110.6	L170 P217	L170-C180 PolarHBondContact N-O 3.36Å; L170-C180 PolarHBondContact O-N 3.43Å; C180-P217 PolarHBondContact SG-O 2.61Å
181	T	98	Very high	97.4	Very high	77 Å²	77	46.5 Å²	46.5	47%	0.472	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	129.9	167.3	-56.4	0	0	0	0	108.5	E167 I168	E167-T181 HydrophobicContact CB-CG2 4.19Å; E167-T181 HydrophobicContact CG-CG2 4.49Å; I168-T181 CarbonylContact O-C 3.52Å; I168-T181 WeakPolarHBondContact O-CA 3.26Å
182	I	98.6	Very high	97.3	Very high	8 Å²	8	46.9 Å²	46.9	4%	0.041	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	112.3	-177.5	-54.4	173	0	0	0	108.3	E167 I168 A184 L201 F214	E167-I182 CarbonylContact C-O 3.58Å; E167-I182 WeakPolarHBondContact CA-O 3.18Å; I168-I182 HydrophobicContact CB-CB 4.4Å; I168-I182 PolarHBondContact N-O 3.25Å; I168-I182 PolarHBondContact O-N 3.27Å; I182-A184 VanDerWaalsContact C-N 3.28Å; I182-A184 HydrophobicContact CG2-CB 4.2Å; I182-A184 PolarHBondContact O-N 2.66Å; I182-L201 HydrophobicContact CD1-CD2 4.05Å; I182-F214 HydrophobicContact CD1-CB 4.27Å; I182-F214 HydrophobicContact CD1-CG 4.5Å; I182-F214 HydrophobicContact CG2-CD1 3.49Å; I182-F214 VanDerWaalsContact CG2-CD1 3.49Å; I182-F214 HydrophobicContact CG2-CD2 4.31Å; I182-F214 HydrophobicContact CG2-CE1 3.55Å; I182-F214 HydrophobicContact CG2-CE2 4.38Å; I182-F214 HydrophobicContact CG2-CG 3.91Å; I182-F214 HydrophobicContact CG2-CZ 4.02Å
183	A	98.1	Very high	97.4	Very high	90 Å²	90	46.3 Å²	46.3	74%	0.744	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.4	80.7	170.7	0	0	0	0	0	109.9
184	A	97.8	Very high	97.5	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.008	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	-35.7	-167.9	0	0	0	0	0	113.6	G166 I168 I182 R212 F214	G166-A184 WeakPolarHBondContact O-CA 3.29Å; G166-A184 WeakPolarHBondContact O-CB 3.32Å; G166-A184 PolarHBondContact O-N 3.5Å; I168-A184 HydrophobicContact CD1-CB 3.68Å; I168-A184 HydrophobicContact CG1-CB 4.13Å; I182-A184 VanDerWaalsContact C-N 3.28Å; I182-A184 HydrophobicContact CG2-CB 4.2Å; I182-A184 PolarHBondContact O-N 2.66Å; A184-R212 WeakPolarHBondContact O-CD 3.3Å; A184-R212 PolarHBondContact O-NH1 2.84Å; A184-F214 HydrophobicContact CB-CE1 4.43Å; A184-F214 HydrophobicContact CB-CE2 3.69Å; A184-F214 HydrophobicContact CB-CZ 3.51Å
185	H	97.6	Very high	97.5	Very high	10 Å²	10	45 Å²	45	5%	0.046	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	155.9	180	-57.9	-98.6	0	0	0	112.5	G166 G187 S203 S205	G166-H185 WeakPolarHBondContact CA-O 3.14Å; G166-H185 PolarHBondContact N-O 2.91Å; G166-H185 PolarHBondContact O-N 3.48Å; H185-G187 PolarHBondContact O-N 3.5Å; H185-S203 PolarHBondContact NE2-O 3.01Å; H185-S203 PolarHBondContact NE2-OG 2.97Å; H185-S205 PolarHBondContact ND1-OG 2.87Å
186	E	95.6	Very high	97.5	Very high	172 Å²	172	43.3 Å²	43.3	80%	0.804	25%	0.254	S	S	*	.	S	Bend	trans	-67.4	0.5	174.9	-59.1	-57.2	124.7	0	0	114.7
187	G	94.9	Very high	97.4	Very high	9 Å²	9	43 Å²	43	9%	0.093	26%	0.257	C	S	.	.	S	Bend	trans	-163	158.3	-176.1	0	0	0	0	0	111.8	T164 G166 H185 S205	T164-G187 WeakPolarHBondContact O-CA 3.46Å; G166-G187 WeakPolarHBondContact CA-O 3.34Å; G166-G187 VanDerWaalsContact N-C 3.34Å; G166-G187 PolarHBondContact N-O 3.16Å; H185-G187 PolarHBondContact O-N 3.5Å; G187-S205 WeakPolarHBondContact O-CB 3.44Å
188	T	96.8	Very high	97.4	Very high	45 Å²	45	36.4 Å²	36.4	28%	0.276	23%	0.228	S	C	.	.			trans	-15.9	131.8	171.5	42.3	0	0	0	0	116.4	L163 T164 S205 E206	L163-T188 VanDerWaalsContact O-CG2 3.27Å; L163-T188 WeakPolarHBondContact O-CG2 3.38Å; T164-T188 PolarHBondContact O-N 2.71Å; T188-S205 CarbonylContact O-C 3.07Å; T188-S205 WeakPolarHBondContact O-CA 3.41Å; T188-S205 VanDerWaalsContact O-CB 3.25Å; T188-S205 WeakPolarHBondContact O-CB 3.41Å; T188-E206 VanDerWaalsContact CB-OE2 3.26Å; T188-E206 WeakPolarHBondContact CB-OE2 3.27Å; T188-E206 PolarHBondContact O-N 3.06Å; T188-E206 PolarHBondContact OG1-OE2 3.04Å
189	L	97.8	Very high	97.4	Very high	16 Å²	16	34.2 Å²	34.2	8%	0.084	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	132.1	179.4	-61.6	172.1	0	0	0	111.5	L145 P160 E167 I168 I192	L145-L189 HydrophobicContact CD2-CB 3.66Å; L145-L189 WeakPolarHBondContact CD2-O 3.29Å; P160-L189 HydrophobicContact CB-CD1 4.32Å; P160-L189 HydrophobicContact CG-CD1 4.27Å; E167-L189 WeakPolarHBondContact O-CD1 3.27Å; I168-L189 HydrophobicContact CG1-CD1 3.59Å; I168-L189 HydrophobicContact CG1-CD2 4.26Å; L189-I192 HydrophobicContact CD1-CG2 4.18Å
190	A	96.9	Very high	97.4	Very high	29 Å²	29	33.6 Å²	33.6	24%	0.24	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	-32.9	170.7	0	0	0	0	0	112.5	A204 E206 I235	A190-A204 PolarHBondContact N-O 3.31Å; A190-E206 HydrophobicContact CB-CG 4.13Å; A190-I235 HydrophobicContact CB-CB 4.5Å
191	A	97.8	Very high	97.4	Very high	8 Å²	8	32 Å²	32	7%	0.066	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	143.4	-177.4	0	0	0	0	0	112	S203 A204 I235 L238	A191-S203 CarbonylContact O-C 3.46Å; A191-S203 VanDerWaalsContact O-CA 3.26Å; A191-S203 WeakPolarHBondContact O-CA 3.39Å; A191-A204 PolarHBondContact N-O 3.37Å; A191-A204 PolarHBondContact O-N 2.67Å; A191-I235 HydrophobicContact CB-CG2 3.86Å; A191-L238 HydrophobicContact CB-CB 4.41Å; A191-L238 HydrophobicContact CB-CD1 3.68Å; A191-L238 HydrophobicContact CB-CG 3.73Å
192	I	98.4	Very high	97.5	Very high	15 Å²	15	28.3 Å²	28.3	8%	0.077	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	142.7	169.7	50	173.2	0	0	0	109.5	L145 A147 A158 I168 L189 A202	L145-I192 HydrophobicContact CD1-CG1 3.82Å; L145-I192 HydrophobicContact CD2-CG1 4.32Å; L145-I192 HydrophobicContact CG-CD1 4.21Å; L145-I192 HydrophobicContact CG-CG1 3.86Å; A147-I192 HydrophobicContact CB-CD1 4.23Å; A147-I192 HydrophobicContact CB-CG1 4.1Å; A158-I192 HydrophobicContact CB-CD1 4.07Å; A158-I192 VanDerWaalsContact O-CD1 3.26Å; A158-I192 WeakPolarHBondContact O-CD1 3.41Å; I168-I192 HydrophobicContact CD1-CG2 3.97Å; I168-I192 HydrophobicContact CG1-CG2 4.22Å; L189-I192 HydrophobicContact CD1-CG2 4.18Å; I192-A202 VanDerWaalsContact CA-O 3.3Å; I192-A202 WeakPolarHBondContact CA-O 3.43Å
193	A	98.6	Very high	97.5	Very high	14 Å²	14	27.9 Å²	27.9	12%	0.116	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	138.6	179.3	0	0	0	0	0	112	L201 A202 L238 F240	A193-L201 CarbonylContact O-C 3.49Å; A193-L201 WeakPolarHBondContact O-CA 3.42Å; A193-A202 PolarHBondContact N-O 3.46Å; A193-A202 PolarHBondContact O-N 2.72Å; A193-L238 HydrophobicContact CB-CB 4.14Å; A193-L238 WeakPolarHBondContact CB-O 3.03Å; A193-F240 WeakPolarHBondContact O-CE2 3.18Å
194	F	98.7	Very high	97.5	Very high	22 Å²	22	23.6 Å²	23.6	10%	0.096	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	156.1	169.8	-71.6	-82.1	0	0	0	111.2	A147 A158 L170 K200 L201 V216 F240	A147-F194 HydrophobicContact CB-CD2 3.85Å; A147-F194 HydrophobicContact CB-CE2 4.02Å; A158-F194 HydrophobicContact CB-CE2 3.72Å; A158-F194 HydrophobicContact CB-CZ 3.69Å; L170-F194 HydrophobicContact CD1-CE1 3.9Å; L170-F194 HydrophobicContact CD1-CZ 3.76Å; F194-K200 WeakPolarHBondContact CA-O 3.44Å; F194-L201 HydrophobicContact CD1-CB 4.28Å; F194-L201 HydrophobicContact CD1-CD1 4.04Å; F194-L201 HydrophobicContact CD2-CD1 4.26Å; F194-L201 HydrophobicContact CE1-CB 4.3Å; F194-L201 HydrophobicContact CE1-CD1 3.99Å; F194-L201 HydrophobicContact CE2-CD1 4.21Å; F194-L201 HydrophobicContact CG-CD1 4.19Å; F194-L201 HydrophobicContact CZ-CD1 4.08Å; F194-V216 HydrophobicContact CD1-CG2 4.28Å; F194-V216 HydrophobicContact CE1-CG1 4.2Å; F194-V216 HydrophobicContact CE1-CG2 4.01Å; F194-F240 WeakPolarHBondContact O-CD2 3.22Å
195	N	97.9	Very high	97.4	Very high	2 Å²	2	23.9 Å²	23.9	1%	0.011	14%	0.14	C	C	.	.			trans	-81	168.2	164.3	78.8	-32.1	0	0	0	111.9	S197 G198 S199 K200 F240 S244	N195-S197 PolarHBondContact ND2-OG 3.39Å; N195-S197 VanDerWaalsContact ND2-OG 3.11Å; N195-S197 PolarHBondContact O-N 3.17Å; N195-S197 VanDerWaalsContact O-N 3.1Å; N195-G198 PolarHBondContact O-N 3.28Å; N195-G198 PolarHBondContact OD1-N 2.97Å; N195-S199 PolarHBondContact ND2-OG 2.89Å; N195-S199 VanDerWaalsContact ND2-OG 3.09Å; N195-S199 PolarHBondContact OD1-N 3.16Å; N195-S199 PolarHBondContact OD1-OG 3.13Å; N195-K200 HydrophobicContact CB-CB 4.18Å; N195-K200 PolarHBondContact N-O 3.44Å; N195-K200 PolarHBondContact OD1-N 3.46Å; N195-K200 PolarHBondContact OD1-O 3.09Å; N195-F240 HydrophobicContact CB-CB 3.95Å; N195-F240 HydrophobicContact CB-CD1 3.76Å; N195-F240 HydrophobicContact CB-CD2 3.71Å; N195-F240 HydrophobicContact CB-CE1 4.12Å; N195-F240 HydrophobicContact CB-CE2 4.05Å; N195-F240 HydrophobicContact CB-CG 3.54Å; N195-F240 HydrophobicContact CB-CZ 4.25Å; N195-S244 PolarHBondContact ND2-OG 3.37Å
196	A	96.1	Very high	97.3	Very high	23 Å²	23	28.7 Å²	28.7	19%	0.19	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-31.3	-173.3	0	0	0	0	0	115	I150 M242	I150-A196 HydrophobicContact CD1-CB 3.88Å; I150-A196 HydrophobicContact CG1-CB 4.49Å; I150-A196 VanDerWaalsContact CG1-O 3.25Å; I150-A196 WeakPolarHBondContact CG1-O 3.43Å; A196-M242 HydrophobicContact CB-CE 4.2Å; A196-M242 WeakPolarHBondContact CB-O 3.45Å; A196-M242 HydrophobicContact CB-SD 4.08Å
197	S	96	Very high	97.2	Very high	47 Å²	47	24.9 Å²	24.9	33%	0.329	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-5.1	178.9	50.1	0	0	0	0	114.7	N151 N154 N195 S199	N151-S197 PolarHBondContact ND2-O 2.82Å; N154-S197 PolarHBondContact ND2-O 2.94Å; N154-S197 VanDerWaalsContact ND2-O 3.14Å; N195-S197 PolarHBondContact ND2-OG 3.39Å; N195-S197 VanDerWaalsContact ND2-OG 3.11Å; N195-S197 PolarHBondContact O-N 3.17Å; N195-S197 VanDerWaalsContact O-N 3.1Å; S197-S199 VanDerWaalsContact C-N 3.25Å; S197-S199 PolarHBondContact O-N 3.44Å; S197-S199 PolarHBondContact OG-OG 3.27Å
198	G	96.8	Very high	97	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.139	C	C	.	.	S	Bend	trans	68.1	21.9	-174.7	0	0	0	0	0	114.1	S149 N195 V216	S149-G198 VanDerWaalsContact OG-CA 3.29Å; S149-G198 WeakPolarHBondContact OG-CA 3.49Å; N195-G198 PolarHBondContact O-N 3.28Å; N195-G198 PolarHBondContact OD1-N 2.97Å; G198-V216 WeakPolarHBondContact O-CB 3.41Å; G198-V216 VanDerWaalsContact O-CG1 3.28Å; G198-V216 WeakPolarHBondContact O-CG1 3.46Å
199	S	97.2	Very high	96.8	Very high	39 Å²	39	23.8 Å²	23.8	27%	0.273	14%	0.135	S	C	.	.	S	Bend	trans	-101.6	-13.3	-177.3	56.8	0	0	0	0	113.9	N195 S197 V216	N195-S199 PolarHBondContact ND2-OG 2.89Å; N195-S199 VanDerWaalsContact ND2-OG 3.09Å; N195-S199 PolarHBondContact OD1-N 3.16Å; N195-S199 PolarHBondContact OD1-OG 3.13Å; S197-S199 VanDerWaalsContact C-N 3.25Å; S197-S199 PolarHBondContact O-N 3.44Å; S197-S199 PolarHBondContact OG-OG 3.27Å; S199-V216 PolarHBondContact O-N 2.93Å
200	K	98.2	Very high	96.6	Very high	44 Å²	44	24.1 Å²	24.1	19%	0.191	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	145.1	176.4	-59	-172.9	-178.4	70.5	0	110.7	F194 N195 V213 F214 L222 F240	F194-K200 WeakPolarHBondContact CA-O 3.44Å; N195-K200 HydrophobicContact CB-CB 4.18Å; N195-K200 PolarHBondContact N-O 3.44Å; N195-K200 PolarHBondContact OD1-N 3.46Å; N195-K200 PolarHBondContact OD1-O 3.09Å; K200-V213 HydrophobicContact CB-CG1 3.95Å; K200-V213 HydrophobicContact CD-CG1 4.13Å; K200-V213 HydrophobicContact CG-CG1 4.43Å; K200-F214 VanDerWaalsContact CA-O 3.27Å; K200-F214 WeakPolarHBondContact CA-O 3.23Å; K200-L222 HydrophobicContact CD-CD1 4.32Å; K200-L222 HydrophobicContact CG-CD1 4.15Å; K200-F240 HydrophobicContact CB-CE1 4.22Å; K200-F240 HydrophobicContact CB-CZ 3.97Å; K200-F240 HydrophobicContact CD-CE1 4.37Å
201	L	98.7	Very high	96.6	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	118	175.4	176.5	67.5	0	0	0	109	A158 I168 I182 A193 F194 V213 F214 V216	A158-L201 HydrophobicContact CB-CD1 4.02Å; A158-L201 HydrophobicContact CB-CD2 4.18Å; I168-L201 HydrophobicContact CD1-CD2 4.11Å; I168-L201 HydrophobicContact CG2-CD2 4.13Å; I182-L201 HydrophobicContact CD1-CD2 4.05Å; A193-L201 CarbonylContact O-C 3.49Å; A193-L201 WeakPolarHBondContact O-CA 3.42Å; F194-L201 HydrophobicContact CD1-CB 4.28Å; F194-L201 HydrophobicContact CD1-CD1 4.04Å; F194-L201 HydrophobicContact CD2-CD1 4.26Å; F194-L201 HydrophobicContact CE1-CB 4.3Å; F194-L201 HydrophobicContact CE1-CD1 3.99Å; F194-L201 HydrophobicContact CE2-CD1 4.21Å; F194-L201 HydrophobicContact CG-CD1 4.19Å; F194-L201 HydrophobicContact CZ-CD1 4.08Å; L201-V213 CarbonylContact O-C 3.6Å; L201-V213 WeakPolarHBondContact O-CA 3.48Å; L201-F214 PolarHBondContact N-O 2.95Å; L201-F214 PolarHBondContact O-N 3.38Å; L201-V216 HydrophobicContact CB-CG2 3.69Å
202	A	98.7	Very high	96.6	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	148	171.3	0	0	0	0	0	110.8	I192 A193 R212 V213 L238 F240 L247	I192-A202 VanDerWaalsContact CA-O 3.3Å; I192-A202 WeakPolarHBondContact CA-O 3.43Å; A193-A202 PolarHBondContact N-O 3.46Å; A193-A202 PolarHBondContact O-N 2.72Å; A202-R212 CarbonylContact C-O 3.58Å; A202-R212 VanDerWaalsContact CA-O 3.29Å; A202-R212 WeakPolarHBondContact CA-O 3.34Å; A202-V213 HydrophobicContact CB-CG2 4.13Å; A202-L238 HydrophobicContact CB-CD1 4.32Å; A202-F240 HydrophobicContact CB-CE2 3.51Å; A202-F240 HydrophobicContact CB-CZ 3.68Å; A202-L247 HydrophobicContact CB-CD1 3.83Å; A202-L247 HydrophobicContact CB-CD2 3.83Å
203	S	98.6	Very high	96.6	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	153.5	171.9	75.5	0	0	0	0	114.1	H185 A191 I211 R212	H185-S203 PolarHBondContact NE2-O 3.01Å; H185-S203 PolarHBondContact NE2-OG 2.97Å; A191-S203 CarbonylContact O-C 3.46Å; A191-S203 VanDerWaalsContact O-CA 3.26Å; A191-S203 WeakPolarHBondContact O-CA 3.39Å; S203-I211 WeakPolarHBondContact O-CA 3.44Å; S203-R212 PolarHBondContact N-O 3.05Å; S203-R212 PolarHBondContact O-N 2.88Å
204	A	97.9	Very high	96.6	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	144.7	170.9	0	0	0	0	0	111.1	A190 A191 I211 I235 L238	A190-A204 PolarHBondContact N-O 3.31Å; A191-A204 PolarHBondContact N-O 3.37Å; A191-A204 PolarHBondContact O-N 2.67Å; A204-I211 HydrophobicContact CB-CG1 4.18Å; A204-I235 HydrophobicContact CB-CB 4.31Å; A204-I235 HydrophobicContact CB-CG1 3.88Å; A204-I235 HydrophobicContact CB-CG2 4.32Å; A204-L238 HydrophobicContact CB-CD1 4.05Å
205	S	96.7	Very high	96.5	Very high	7 Å²	7	23.3 Å²	23.3	5%	0.049	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	165.6	171.7	46.8	0	0	0	0	112.5	H185 G187 T188 K207 G208	H185-S205 PolarHBondContact ND1-OG 2.87Å; G187-S205 WeakPolarHBondContact O-CB 3.44Å; T188-S205 CarbonylContact O-C 3.07Å; T188-S205 WeakPolarHBondContact O-CA 3.41Å; T188-S205 VanDerWaalsContact O-CB 3.25Å; T188-S205 WeakPolarHBondContact O-CB 3.41Å; S205-K207 PolarHBondContact O-N 3.36Å; S205-G208 WeakPolarHBondContact O-CA 3.1Å; S205-G208 PolarHBondContact O-N 2.99Å
206	E	94.9	Very high	96.5	Very high	111 Å²	111	23.8 Å²	23.8	52%	0.519	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-16.9	177.1	-66.8	-174.2	137.8	0	0	114.2	T188 A190 G208	T188-E206 VanDerWaalsContact CB-OE2 3.26Å; T188-E206 WeakPolarHBondContact CB-OE2 3.27Å; T188-E206 PolarHBondContact O-N 3.06Å; T188-E206 PolarHBondContact OG1-OE2 3.04Å; A190-E206 HydrophobicContact CB-CG 4.13Å; E206-G208 VanDerWaalsContact C-N 3.29Å
207	K	92.8	Very high	96.5	Very high	91 Å²	91	25 Å²	25	40%	0.396	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-27	170.2	-65.9	171.8	-175.7	166.2	0	112.1	S205 T209 Y232 V233	S205-K207 PolarHBondContact O-N 3.36Å; K207-T209 PolarHBondContact O-N 3.02Å; K207-Y232 HydrophobicContact CB-CD1 4.27Å; K207-Y232 HydrophobicContact CB-CE1 4.35Å; K207-Y232 VanDerWaalsContact O-CA 3.25Å; K207-Y232 WeakPolarHBondContact O-CA 3.34Å; K207-Y232 WeakPolarHBondContact O-CB 3.24Å; K207-V233 PolarHBondContact O-N 2.8Å
208	G	92.1	Very high	96.6	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.144	C	C	.	.			trans	58.7	16.3	174.1	0	0	0	0	0	116.5	S205 E206 R227 V233	S205-G208 WeakPolarHBondContact O-CA 3.1Å; S205-G208 PolarHBondContact O-N 2.99Å; E206-G208 VanDerWaalsContact C-N 3.29Å; G208-R227 PolarHBondContact O-NE 2.94Å; G208-R227 PolarHBondContact O-NH2 3.3Å; G208-V233 WeakPolarHBondContact CA-O 3.41Å
209	T	91.7	Very high	96.6	Very high	31 Å²	31	28.6 Å²	28.6	19%	0.19	15%	0.152	C	C	.	.	S	Bend	trans	-83.1	-35.7	-178.8	47.3	0	0	0	0	112.9	K207 R227 Y232	K207-T209 PolarHBondContact O-N 3.02Å; T209-R227 PolarHBondContact O-N 2.81Å; T209-R227 VanDerWaalsContact O-N 3.09Å; T209-Y232 HydrophobicContact CG2-CD1 3.64Å; T209-Y232 HydrophobicContact CG2-CE1 3.95Å
210	V	93.7	Very high	96.6	Very high	24 Å²	24	32.9 Å²	32.9	15%	0.145	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	137.1	-171.9	177.1	0	0	0	0	109.1	R212 E224 F225	V210-R212 HydrophobicContact CG1-CG 4.16Å; V210-E224 HydrophobicContact CG1-CG 3.41Å; V210-E224 VanDerWaalsContact CG1-CG 3.41Å; V210-F225 WeakPolarHBondContact CA-O 3.47Å
211	I	96.6	Very high	96.5	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	131.1	174.3	-59.6	160.5	0	0	0	106.7	S203 A204 F225 R227 L238 L247 A249 F259	S203-I211 WeakPolarHBondContact O-CA 3.44Å; A204-I211 HydrophobicContact CB-CG1 4.18Å; I211-F225 PolarHBondContact N-O 2.92Å; I211-F225 PolarHBondContact O-N 3.37Å; I211-R227 HydrophobicContact CD1-CB 4.15Å; I211-R227 HydrophobicContact CD1-CG 4.33Å; I211-L238 HydrophobicContact CD1-CD2 4.08Å; I211-L238 HydrophobicContact CG1-CD2 4.32Å; I211-L238 HydrophobicContact CG2-CD1 4.31Å; I211-L238 HydrophobicContact CG2-CD2 4.02Å; I211-L247 HydrophobicContact CG2-CD2 3.81Å; I211-A249 HydrophobicContact CD1-CB 3.46Å; I211-A249 VanDerWaalsContact CD1-CB 3.46Å; I211-F259 HydrophobicContact CD1-CD2 4.48Å; I211-F259 HydrophobicContact CD1-CE2 3.65Å; I211-F259 HydrophobicContact CD1-CZ 4.2Å
212	R	97.6	Very high	96.4	Very high	49 Å²	49	40 Å²	40	19%	0.185	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	150.7	-179.3	-73.6	171.9	174.4	142	7.8	110.5	A184 A202 S203 V210 F214 K221 Y223 E224	A184-R212 WeakPolarHBondContact O-CD 3.3Å; A184-R212 PolarHBondContact O-NH1 2.84Å; A202-R212 CarbonylContact C-O 3.58Å; A202-R212 VanDerWaalsContact CA-O 3.29Å; A202-R212 WeakPolarHBondContact CA-O 3.34Å; S203-R212 PolarHBondContact N-O 3.05Å; S203-R212 PolarHBondContact O-N 2.88Å; V210-R212 HydrophobicContact CG1-CG 4.16Å; R212-F214 HydrophobicContact CB-CD2 4.45Å; R212-F214 HydrophobicContact CB-CE2 3.46Å; R212-F214 VanDerWaalsContact CB-CE2 3.46Å; R212-F214 HydrophobicContact CB-CZ 3.59Å; R212-F214 HydrophobicContact CG-CZ 4.38Å; R212-K221 HydrophobicContact CG-CD 4.18Å; R212-Y223 WeakPolarHBondContact CA-O 3.43Å; R212-E224 HydrophobicContact CG-CB 4.31Å; R212-E224 HydrophobicContact CG-CG 3.97Å; R212-E224 IonicContact CZ-OE1 3.56Å; R212-E224 IonicContact CZ-OE2 3.22Å; R212-E224 IonicContact NE-OE1 2.73Å; R212-E224 PolarHBondContact NE-OE1 2.81Å; R212-E224 IonicContact NE-OE2 3.42Å; R212-E224 PolarHBondContact NE-OE2 2.84Å; R212-E224 VanDerWaalsContact NH2-CD 3.31Å; R212-E224 IonicContact NH2-OE1 2.78Å; R212-E224 PolarHBondContact NH2-OE1 2.88Å; R212-E224 IonicContact NH2-OE2 3.49Å; R212-E224 PolarHBondContact NH2-OE2 2.95Å
213	V	98.3	Very high	96.2	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	133.7	174.3	-179.6	0	0	0	0	109	K200 L201 A202 L222 Y223 F225 F240 L247 L261	K200-V213 HydrophobicContact CB-CG1 3.95Å; K200-V213 HydrophobicContact CD-CG1 4.13Å; K200-V213 HydrophobicContact CG-CG1 4.43Å; L201-V213 CarbonylContact O-C 3.6Å; L201-V213 WeakPolarHBondContact O-CA 3.48Å; A202-V213 HydrophobicContact CB-CG2 4.13Å; V213-L222 PolarHBondContact O-N 2.93Å; V213-Y223 HydrophobicContact CB-CD2 3.9Å; V213-Y223 HydrophobicContact CB-CG 4.44Å; V213-Y223 HydrophobicContact CG1-CD2 4.02Å; V213-Y223 PolarHBondContact N-O 2.87Å; V213-Y223 PolarHBondContact O-N 3.33Å; V213-Y223 VanDerWaalsContact O-N 3.15Å; V213-F225 HydrophobicContact CG2-CE2 4.24Å; V213-F240 HydrophobicContact CG1-CE1 4.27Å; V213-F240 HydrophobicContact CG1-CZ 3.92Å; V213-F240 HydrophobicContact CG2-CZ 4.3Å; V213-L247 HydrophobicContact CG2-CD2 3.59Å; V213-L261 HydrophobicContact CG2-CD2 4.34Å
214	F	98.6	Very high	96	Very high	9 Å²	9	45.3 Å²	45.3	4%	0.039	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	152.8	-175.6	-55.3	-93.9	0	0	0	111	I182 A184 K200 L201 R212 G219 Q220 K221	I182-F214 HydrophobicContact CD1-CB 4.27Å; I182-F214 HydrophobicContact CD1-CG 4.5Å; I182-F214 HydrophobicContact CG2-CD1 3.49Å; I182-F214 VanDerWaalsContact CG2-CD1 3.49Å; I182-F214 HydrophobicContact CG2-CD2 4.31Å; I182-F214 HydrophobicContact CG2-CE1 3.55Å; I182-F214 HydrophobicContact CG2-CE2 4.38Å; I182-F214 HydrophobicContact CG2-CG 3.91Å; I182-F214 HydrophobicContact CG2-CZ 4.02Å; A184-F214 HydrophobicContact CB-CE1 4.43Å; A184-F214 HydrophobicContact CB-CE2 3.69Å; A184-F214 HydrophobicContact CB-CZ 3.51Å; K200-F214 VanDerWaalsContact CA-O 3.27Å; K200-F214 WeakPolarHBondContact CA-O 3.23Å; L201-F214 PolarHBondContact N-O 2.95Å; L201-F214 PolarHBondContact O-N 3.38Å; R212-F214 HydrophobicContact CB-CD2 4.45Å; R212-F214 HydrophobicContact CB-CE2 3.46Å; R212-F214 VanDerWaalsContact CB-CE2 3.46Å; R212-F214 HydrophobicContact CB-CZ 3.59Å; R212-F214 HydrophobicContact CG-CZ 4.38Å; F214-G219 WeakPolarHBondContact CD1-O 3.38Å; F214-Q220 CarbonylContact C-O 3.51Å; F214-Q220 WeakPolarHBondContact CA-O 3.16Å; F214-K221 HydrophobicContact CD1-CB 3.89Å; F214-K221 HydrophobicContact CD1-CG 4.32Å; F214-K221 HydrophobicContact CE1-CB 3.78Å; F214-K221 HydrophobicContact CE1-CG 3.98Å; F214-K221 HydrophobicContact CZ-CG 4.44Å
215	S	97.9	Very high	95.8	Very high	12 Å²	12	45.6 Å²	45.6	8%	0.084	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	152.3	167.8	74.7	0	0	0	0	110.8	D218 G219 Q220	S215-D218 WeakPolarHBondContact OG-CB 3.44Å; S215-D218 PolarHBondContact OG-OD2 3.36Å; S215-G219 WeakPolarHBondContact O-CA 3.43Å; S215-G219 PolarHBondContact O-N 2.88Å; S215-Q220 PolarHBondContact N-O 2.96Å; S215-Q220 PolarHBondContact OG-N 2.84Å
216	V	97.8	Very high	95.5	Very high	12 Å²	12	49.8 Å²	49.8	7%	0.073	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.4	124.5	175.5	-179.1	0	0	0	0	106.5	Y156 L170 F194 G198 S199 L201	Y156-V216 HydrophobicContact CD1-CG1 4.47Å; Y156-V216 HydrophobicContact CD2-CG1 3.37Å; Y156-V216 HydrophobicContact CE2-CG1 3.69Å; Y156-V216 HydrophobicContact CG-CG1 3.82Å; L170-V216 HydrophobicContact CD1-CG1 4.19Å; L170-V216 HydrophobicContact CD2-CG1 4Å; F194-V216 HydrophobicContact CD1-CG2 4.28Å; F194-V216 HydrophobicContact CE1-CG1 4.2Å; F194-V216 HydrophobicContact CE1-CG2 4.01Å; G198-V216 WeakPolarHBondContact O-CB 3.41Å; G198-V216 VanDerWaalsContact O-CG1 3.28Å; G198-V216 WeakPolarHBondContact O-CG1 3.46Å; S199-V216 PolarHBondContact O-N 2.93Å; L201-V216 HydrophobicContact CB-CG2 3.69Å
217	P	96.8	Very high	95.1	Very high	50 Å²	50	45.5 Å²	45.5	33%	0.325	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	cis	-85.4	-12.4	12.2	33.4	-36.5	0	0	0	116.9	Y156 L170 V179 C180 G219	Y156-P217 HydrophobicContact CE1-CB 4.46Å; L170-P217 HydrophobicContact CD2-CB 4.49Å; L170-P217 WeakPolarHBondContact CD2-O 3.47Å; V179-P217 HydrophobicContact CG1-CB 3.77Å; C180-P217 PolarHBondContact SG-O 2.61Å; P217-G219 VanDerWaalsContact C-N 3.28Å; P217-G219 PolarHBondContact O-N 3.43Å; P217-G219 VanDerWaalsContact O-N 3.16Å
218	D	96.4	Very high	94.1	Very high	105 Å²	105	42 Å²	42	56%	0.561	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-14.1	-160.4	-26.4	-74.9	0	0	0	115.4	S215 Q220	S215-D218 WeakPolarHBondContact OG-CB 3.44Å; S215-D218 PolarHBondContact OG-OD2 3.36Å; D218-Q220 HydrophobicContact CB-CG 4.1Å; D218-Q220 PolarHBondContact O-N 2.8Å
219	G	96.8	Very high	92.8	Very high	16 Å²	16	49.5 Å²	49.5	17%	0.165	25%	0.248	C	C	.	.			trans	71.5	10.7	178.1	0	0	0	0	0	115.1	F214 S215 P217	F214-G219 WeakPolarHBondContact CD1-O 3.38Å; S215-G219 WeakPolarHBondContact O-CA 3.43Å; S215-G219 PolarHBondContact O-N 2.88Å; P217-G219 VanDerWaalsContact C-N 3.28Å; P217-G219 PolarHBondContact O-N 3.43Å; P217-G219 VanDerWaalsContact O-N 3.16Å
220	Q	97.2	Very high	91.6	Very high	130 Å²	130	57 Å²	57	61%	0.607	28%	0.277	S	S	*	.			trans	-75.2	133.1	-177.8	-62.4	179.6	20.5	0	0	110.8	F214 S215 D218 L222	F214-Q220 CarbonylContact C-O 3.51Å; F214-Q220 WeakPolarHBondContact CA-O 3.16Å; S215-Q220 PolarHBondContact N-O 2.96Å; S215-Q220 PolarHBondContact OG-N 2.84Å; D218-Q220 HydrophobicContact CB-CG 4.1Å; D218-Q220 PolarHBondContact O-N 2.8Å; Q220-L222 PolarHBondContact O-N 2.72Å
221	K	97.4	Very high	91	Very high	118 Å²	118	64.2 Å²	64.2	51%	0.513	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	114.7	177.8	-169.5	-174.2	71.5	-179.7	0	110.4	R212 F214 E224	R212-K221 HydrophobicContact CG-CD 4.18Å; F214-K221 HydrophobicContact CD1-CB 3.89Å; F214-K221 HydrophobicContact CD1-CG 4.32Å; F214-K221 HydrophobicContact CE1-CB 3.78Å; F214-K221 HydrophobicContact CE1-CG 3.98Å; F214-K221 HydrophobicContact CZ-CG 4.44Å; K221-E224 HydrophobicContact CD-CB 4.4Å; K221-E224 WeakPolarHBondContact CD-OE2 3.38Å; K221-E224 WeakPolarHBondContact CE-OE2 3.48Å; K221-E224 IonicContact NZ-OE2 3.2Å; K221-E224 PolarHBondContact NZ-OE2 2.81Å
222	L	95.9	Very high	90.7	Very high	75 Å²	75	71.8 Å²	71.8	39%	0.393	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	-41.4	178.4	-61.9	177.3	0	0	0	112.5	K200 V213 Q220	K200-L222 HydrophobicContact CD-CD1 4.32Å; K200-L222 HydrophobicContact CG-CD1 4.15Å; V213-L222 PolarHBondContact O-N 2.93Å; Q220-L222 PolarHBondContact O-N 2.72Å
223	Y	95.4	Very high	90.4	Very high	34 Å²	34	69.8 Å²	69.8	13%	0.133	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	152.5	-176.3	-53.6	-93.4	0	0	0	111.9	R212 V213 F225 L261 E262	R212-Y223 WeakPolarHBondContact CA-O 3.43Å; V213-Y223 HydrophobicContact CB-CD2 3.9Å; V213-Y223 HydrophobicContact CB-CG 4.44Å; V213-Y223 HydrophobicContact CG1-CD2 4.02Å; V213-Y223 PolarHBondContact N-O 2.87Å; V213-Y223 PolarHBondContact O-N 3.33Å; V213-Y223 VanDerWaalsContact O-N 3.15Å; Y223-F225 HydrophobicContact CD1-CE1 4.49Å; Y223-F225 HydrophobicContact CD1-CE2 4.45Å; Y223-F225 AromaticContact CD1-CZ 3.8Å; Y223-F225 HydrophobicContact CD1-CZ 3.8Å; Y223-F225 HydrophobicContact CG-CE2 4.12Å; Y223-F225 AromaticContact CG-CZ 3.94Å; Y223-F225 HydrophobicContact CG-CZ 3.94Å; Y223-L261 HydrophobicContact CD1-CD2 4.46Å; Y223-L261 HydrophobicContact CD2-CD2 3.9Å; Y223-L261 HydrophobicContact CE2-CD2 4.03Å; Y223-L261 HydrophobicContact CG-CD2 4.15Å; Y223-E262 VanDerWaalsContact CE1-O 3.29Å; Y223-E262 WeakPolarHBondContact CE1-O 3.41Å; Y223-E262 PolarHBondContact OH-O 3.34Å; Y223-E262 VanDerWaalsContact OH-O 3.04Å
224	E	94.6	Very high	90.2	Very high	78 Å²	78	73.7 Å²	73.7	36%	0.364	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	101.9	173.2	-174.7	160.3	156	0	0	110.8	V210 R212 K221	V210-E224 HydrophobicContact CG1-CG 3.41Å; V210-E224 VanDerWaalsContact CG1-CG 3.41Å; R212-E224 HydrophobicContact CG-CB 4.31Å; R212-E224 HydrophobicContact CG-CG 3.97Å; R212-E224 IonicContact CZ-OE1 3.56Å; R212-E224 IonicContact CZ-OE2 3.22Å; R212-E224 IonicContact NE-OE1 2.73Å; R212-E224 PolarHBondContact NE-OE1 2.81Å; R212-E224 IonicContact NE-OE2 3.42Å; R212-E224 PolarHBondContact NE-OE2 2.84Å; R212-E224 VanDerWaalsContact NH2-CD 3.31Å; R212-E224 IonicContact NH2-OE1 2.78Å; R212-E224 PolarHBondContact NH2-OE1 2.88Å; R212-E224 IonicContact NH2-OE2 3.49Å; R212-E224 PolarHBondContact NH2-OE2 2.95Å; K221-E224 HydrophobicContact CD-CB 4.4Å; K221-E224 WeakPolarHBondContact CD-OE2 3.38Å; K221-E224 WeakPolarHBondContact CE-OE2 3.48Å; K221-E224 IonicContact NZ-OE2 3.2Å; K221-E224 PolarHBondContact NZ-OE2 2.81Å
225	F	93.2	Very high	90	Very high	5 Å²	5	73.6 Å²	73.6	2%	0.022	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	137	-175.5	-60.9	-65	0	0	0	111.9	V210 I211 V213 Y223 L247 F259 L261 D301	V210-F225 WeakPolarHBondContact CA-O 3.47Å; I211-F225 PolarHBondContact N-O 2.92Å; I211-F225 PolarHBondContact O-N 3.37Å; V213-F225 HydrophobicContact CG2-CE2 4.24Å; Y223-F225 HydrophobicContact CD1-CE1 4.49Å; Y223-F225 HydrophobicContact CD1-CE2 4.45Å; Y223-F225 AromaticContact CD1-CZ 3.8Å; Y223-F225 HydrophobicContact CD1-CZ 3.8Å; Y223-F225 HydrophobicContact CG-CE2 4.12Å; Y223-F225 AromaticContact CG-CZ 3.94Å; Y223-F225 HydrophobicContact CG-CZ 3.94Å; F225-L247 HydrophobicContact CD2-CD2 4.35Å; F225-L247 HydrophobicContact CE2-CD2 4.41Å; F225-F259 HydrophobicContact CB-CD1 3.64Å; F225-F259 HydrophobicContact CB-CD2 4.33Å; F225-F259 HydrophobicContact CB-CE1 3.8Å; F225-F259 HydrophobicContact CB-CE2 4.47Å; F225-F259 HydrophobicContact CB-CG 3.92Å; F225-F259 HydrophobicContact CB-CZ 4.22Å; F225-F259 HydrophobicContact CD1-CB 3.85Å; F225-F259 AromaticContact CD1-CD1 3.75Å; F225-F259 HydrophobicContact CD1-CD1 3.75Å; F225-F259 AromaticContact CD1-CG 3.98Å; F225-F259 HydrophobicContact CD1-CG 3.98Å; F225-F259 HydrophobicContact CD2-CB 3.95Å; F225-F259 HydrophobicContact CD2-CG 4.08Å; F225-F259 HydrophobicContact CE1-CB 3.91Å; F225-F259 HydrophobicContact CE2-CB 4.01Å; F225-F259 HydrophobicContact CG-CB 3.87Å; F225-F259 AromaticContact CG-CD1 3.73Å; F225-F259 HydrophobicContact CG-CD1 3.73Å; F225-F259 HydrophobicContact CG-CD2 4.39Å; F225-F259 HydrophobicContact CG-CE1 4.4Å; F225-F259 AromaticContact CG-CG 3.72Å; F225-F259 HydrophobicContact CG-CG 3.72Å; F225-F259 HydrophobicContact CZ-CB 3.98Å; F225-L261 HydrophobicContact CE2-CD2 3.76Å; F225-L261 HydrophobicContact CZ-CD2 3.89Å; F225-D301 HydrophobicContact CD1-CB 4.37Å
226	R	90.2	Very high	89.9	Confident	96 Å²	96	74.9 Å²	74.9	36%	0.362	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	94.7	-179.5	-168.1	173.8	-176.3	-169.6	6	111.8	G228 M229 Q300	R226-G228 PolarHBondContact NE-O 3.39Å; R226-G228 PolarHBondContact O-N 2.82Å; R226-M229 PolarHBondContact NH2-O 3.44Å; R226-Q300 HydrophobicContact CB-CG 4.15Å
227	R	85.3	Confident	89.8	Confident	21 Å²	21	75.1 Å²	75.1	8%	0.079	36%	0.36	C	S	.	.	S	Bend	trans	-63.5	-23.5	-178.6	-168.2	-78.3	-41.6	148.2	7.6	113.4	G208 T209 I211 R231 V233 H257 F259	G208-R227 PolarHBondContact O-NE 2.94Å; G208-R227 PolarHBondContact O-NH2 3.3Å; T209-R227 PolarHBondContact O-N 2.81Å; T209-R227 VanDerWaalsContact O-N 3.09Å; I211-R227 HydrophobicContact CD1-CB 4.15Å; I211-R227 HydrophobicContact CD1-CG 4.33Å; R227-R231 PolarHBondContact NH2-O 3.1Å; R227-V233 VanDerWaalsContact CZ-CG2 3.44Å; R227-H257 HydrophobicContact CG-CB 4.35Å; R227-F259 HydrophobicContact CB-CZ 4.13Å; R227-F259 HydrophobicContact CG-CZ 4.33Å
228	G	73.8	Confident	89.9	Confident	18 Å²	18	73.1 Å²	73.1	19%	0.186	35%	0.347	C	S	.	.			trans	-169.6	160.4	171.8	0	0	0	0	0	115.4	R226	R226-G228 PolarHBondContact NE-O 3.39Å; R226-G228 PolarHBondContact O-N 2.82Å
229	M	64.8	Low	89.9	Confident	157 Å²	157	69.6 Å²	69.6	77%	0.773	33%	0.329	S	S	*	.	S	Bend	trans	-68.5	-38.5	-172.4	-71	-177.8	173.1	0	0	114.6	R226	R226-M229 PolarHBondContact NH2-O 3.44Å
230	K	66.2	Low	90	Very high	187 Å²	187	69.3 Å²	69.3	81%	0.813	32%	0.323	S	S	*	.	S	Bend	trans	-156.1	-20.1	-178.5	-143.3	172.6	-176.8	178.3	0	117.2	Y232	K230-Y232 PolarHBondContact O-N 2.84Å
231	R	81.3	Confident	90	Very high	176 Å²	176	63.5 Å²	63.5	66%	0.664	30%	0.297	S	S	*	.			trans	-71.3	117.1	179.1	178.3	-176.4	-74.3	178.5	-2.9	110.4	R227 V233	R227-R231 PolarHBondContact NH2-O 3.1Å; R231-V233 HydrophobicContact CG-CG1 4.24Å
232	Y	89.9	Confident	89.9	Confident	160 Å²	160	61.9 Å²	61.9	63%	0.627	29%	0.292	S	S	*	.			trans	-65.2	144.8	166.5	-60.1	-22.2	0	0	0	110.7	K207 T209 K230	K207-Y232 HydrophobicContact CB-CD1 4.27Å; K207-Y232 HydrophobicContact CB-CE1 4.35Å; K207-Y232 VanDerWaalsContact O-CA 3.25Å; K207-Y232 WeakPolarHBondContact O-CA 3.34Å; K207-Y232 WeakPolarHBondContact O-CB 3.24Å; T209-Y232 HydrophobicContact CG2-CD1 3.64Å; T209-Y232 HydrophobicContact CG2-CE1 3.95Å; K230-Y232 PolarHBondContact O-N 2.84Å
233	V	91.6	Very high	89.8	Confident	6 Å²	6	62.9 Å²	62.9	4%	0.036	30%	0.298	C	S	.	.			trans	-144.8	153.4	178.7	-55.7	0	0	0	0	110.1	K207 G208 R227 R231 I235 N252 T253	K207-V233 PolarHBondContact O-N 2.8Å; G208-V233 WeakPolarHBondContact CA-O 3.41Å; R227-V233 VanDerWaalsContact CZ-CG2 3.44Å; R231-V233 HydrophobicContact CG-CG1 4.24Å; V233-I235 HydrophobicContact CG2-CD1 3.82Å; V233-I235 HydrophobicContact CG2-CG1 4.48Å; V233-I235 PolarHBondContact O-N 2.89Å; V233-N252 WeakPolarHBondContact CB-OD1 3.32Å; V233-T253 HydrophobicContact CB-CG2 4.47Å; V233-T253 HydrophobicContact CG1-CG2 3.56Å
234	T	92.5	Very high	89.7	Confident	83 Å²	83	62 Å²	62	51%	0.509	30%	0.297	S	S	.	.			trans	-85.2	103.3	170.7	-50.1	0	0	0	0	108.4	S236 S251 N252	T234-S236 PolarHBondContact O-N 3.28Å; T234-S236 PolarHBondContact O-OG 2.86Å; T234-S251 CarbonylContact O-C 3.47Å; T234-S251 WeakPolarHBondContact O-CA 3.32Å; T234-S251 VanDerWaalsContact O-CB 3.3Å; T234-S251 WeakPolarHBondContact O-CB 3.3Å; T234-N252 PolarHBondContact N-OD1 2.87Å; T234-N252 PolarHBondContact O-N 3.15Å
235	I	95.9	Very high	89.7	Confident	6 Å²	6	62.3 Å²	62.3	3%	0.031	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	123.9	171.4	-58.9	-62.2	0	0	0	107.9	A190 A191 A204 V233 L238	A190-I235 HydrophobicContact CB-CB 4.5Å; A191-I235 HydrophobicContact CB-CG2 3.86Å; A204-I235 HydrophobicContact CB-CB 4.31Å; A204-I235 HydrophobicContact CB-CG1 3.88Å; A204-I235 HydrophobicContact CB-CG2 4.32Å; V233-I235 HydrophobicContact CG2-CD1 3.82Å; V233-I235 HydrophobicContact CG2-CG1 4.48Å; V233-I235 PolarHBondContact O-N 2.89Å; I235-L238 HydrophobicContact CG2-CD2 4Å; I235-L238 HydrophobicContact CG2-CG 4Å
236	S	95	Very high	89.9	Confident	39 Å²	39	62.7 Å²	62.7	27%	0.273	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	-24.3	-174.3	-56.1	0	0	0	0	112.3	T234 S250 N316	T234-S236 PolarHBondContact O-N 3.28Å; T234-S236 PolarHBondContact O-OG 2.86Å; S236-S250 PolarHBondContact N-O 2.88Å; S236-N316 WeakPolarHBondContact CB-O 3.43Å
237	S	95.6	Very high	90.2	Very high	17 Å²	17	58.1 Å²	58.1	12%	0.119	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	146.5	176.3	-172.8	0	0	0	0	111.3	A249 S250	S237-A249 WeakPolarHBondContact O-CA 3.26Å; S237-S250 PolarHBondContact N-O 3.4Å; S237-S250 PolarHBondContact O-N 3.19Å
238	L	98.1	Very high	90.8	Very high	9 Å²	9	57.1 Å²	57.1	5%	0.047	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	126.7	166	-68.3	178.1	0	0	0	107.5	A191 A193 A202 A204 I211 I235 C248 A249	A191-L238 HydrophobicContact CB-CB 4.41Å; A191-L238 HydrophobicContact CB-CD1 3.68Å; A191-L238 HydrophobicContact CB-CG 3.73Å; A193-L238 HydrophobicContact CB-CB 4.14Å; A193-L238 WeakPolarHBondContact CB-O 3.03Å; A202-L238 HydrophobicContact CB-CD1 4.32Å; A204-L238 HydrophobicContact CB-CD1 4.05Å; I211-L238 HydrophobicContact CD1-CD2 4.08Å; I211-L238 HydrophobicContact CG1-CD2 4.32Å; I211-L238 HydrophobicContact CG2-CD1 4.31Å; I211-L238 HydrophobicContact CG2-CD2 4.02Å; I235-L238 HydrophobicContact CG2-CD2 4Å; I235-L238 HydrophobicContact CG2-CG 4Å; L238-C248 WeakPolarHBondContact CA-O 3.29Å; L238-A249 HydrophobicContact CD2-CB 3.54Å
239	V	98.1	Very high	91.9	Very high	31 Å²	31	56.3 Å²	56.3	19%	0.188	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	129	179.4	173.4	0	0	0	0	110.5	C248 C318	V239-C248 PolarHBondContact N-O 2.82Å; V239-C248 PolarHBondContact O-N 2.84Å; V239-C318 VanDerWaalsContact CG2-O 3.22Å; V239-C318 WeakPolarHBondContact CG2-O 3.27Å
240	F	98.2	Very high	93.4	Very high	10 Å²	10	48.8 Å²	48.8	4%	0.044	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	148	168.3	-71.5	-93	0	0	0	110.7	A193 F194 N195 K200 A202 V213 F246 L247 L261	A193-F240 WeakPolarHBondContact O-CE2 3.18Å; F194-F240 WeakPolarHBondContact O-CD2 3.22Å; N195-F240 HydrophobicContact CB-CB 3.95Å; N195-F240 HydrophobicContact CB-CD1 3.76Å; N195-F240 HydrophobicContact CB-CD2 3.71Å; N195-F240 HydrophobicContact CB-CE1 4.12Å; N195-F240 HydrophobicContact CB-CE2 4.05Å; N195-F240 HydrophobicContact CB-CG 3.54Å; N195-F240 HydrophobicContact CB-CZ 4.25Å; K200-F240 HydrophobicContact CB-CE1 4.22Å; K200-F240 HydrophobicContact CB-CZ 3.97Å; K200-F240 HydrophobicContact CD-CE1 4.37Å; A202-F240 HydrophobicContact CB-CE2 3.51Å; A202-F240 HydrophobicContact CB-CZ 3.68Å; V213-F240 HydrophobicContact CG1-CE1 4.27Å; V213-F240 HydrophobicContact CG1-CZ 3.92Å; V213-F240 HydrophobicContact CG2-CZ 4.3Å; F240-F246 WeakPolarHBondContact CA-O 3.38Å; F240-L247 HydrophobicContact CD1-CB 4.49Å; F240-L247 HydrophobicContact CD1-CD1 4.32Å; F240-L247 HydrophobicContact CD2-CD1 4.15Å; F240-L247 HydrophobicContact CE1-CD1 4.36Å; F240-L247 HydrophobicContact CE2-CD1 4.2Å; F240-L247 HydrophobicContact CG-CD1 4.22Å; F240-L247 HydrophobicContact CZ-CD1 4.31Å; F240-L261 HydrophobicContact CD1-CD1 3.51Å; F240-L261 HydrophobicContact CE1-CD1 3.55Å; F240-L261 HydrophobicContact CE1-CD2 4.42Å
241	S	96.8	Very high	94.8	Very high	8 Å²	8	40 Å²	40	6%	0.056	20%	0.195	C	C	.	.			trans	-63.8	152.5	160.3	57.2	0	0	0	0	110.7	D243 S244 Q245 F246	S241-D243 WeakPolarHBondContact CB-OD1 3.38Å; S241-D243 PolarHBondContact O-N 2.83Å; S241-D243 PolarHBondContact OG-OD1 2.93Å; S241-S244 WeakPolarHBondContact O-CA 3.37Å; S241-S244 PolarHBondContact O-N 3.2Å; S241-Q245 PolarHBondContact OG-N 2.8Å; S241-F246 PolarHBondContact N-O 3.01Å; S241-F246 PolarHBondContact OG-N 3.23Å; S241-F246 PolarHBondContact OG-O 2.74Å
242	M	94.9	Very high	95.4	Very high	84 Å²	84	34.5 Å²	34.5	41%	0.414	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-29.3	-175.8	-68.6	-64.1	-73	0	0	113.4	D25 I150 A196 S244	D25-M242 HydrophobicContact CB-CE 4.15Å; I150-M242 HydrophobicContact CD1-CE 3.79Å; I150-M242 HydrophobicContact CD1-SD 4.11Å; A196-M242 HydrophobicContact CB-CE 4.2Å; A196-M242 WeakPolarHBondContact CB-O 3.45Å; A196-M242 HydrophobicContact CB-SD 4.08Å; M242-S244 PolarHBondContact O-N 3.24Å
243	D	93.8	Very high	95.5	Very high	95 Å²	95	27.7 Å²	27.7	51%	0.508	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-5.4	172.1	61.9	8	0	0	0	114	S241 Q245	S241-D243 WeakPolarHBondContact CB-OD1 3.38Å; S241-D243 PolarHBondContact O-N 2.83Å; S241-D243 PolarHBondContact OG-OD1 2.93Å; D243-Q245 HydrophobicContact CB-CG 4.13Å; D243-Q245 VanDerWaalsContact CG-CG 3.46Å; D243-Q245 PolarHBondContact O-N 3.48Å; D243-Q245 WeakPolarHBondContact OD1-CB 3.27Å; D243-Q245 PolarHBondContact OD1-N 3.08Å; D243-Q245 WeakPolarHBondContact OD2-CG 3.37Å
244	S	94.9	Very high	95.5	Very high	16 Å²	16	30.9 Å²	30.9	11%	0.112	17%	0.169	C	C	.	.	S	Bend	trans	57.6	23.5	-173.5	-50.9	0	0	0	0	115.5	N195 S241 M242 L261	N195-S244 PolarHBondContact ND2-OG 3.37Å; S241-S244 WeakPolarHBondContact O-CA 3.37Å; S241-S244 PolarHBondContact O-N 3.2Å; M242-S244 PolarHBondContact O-N 3.24Å; S244-L261 VanDerWaalsContact O-CD1 3.3Å; S244-L261 WeakPolarHBondContact O-CD1 3.48Å
245	Q	94.2	Very high	95.5	Very high	84 Å²	84	28.9 Å²	28.9	39%	0.393	16%	0.156	S	C	.	.	S	Bend	trans	-80.8	-25.7	173.8	-65.6	-64.1	-48.6	0	0	113.2	S241 D243 L261	S241-Q245 PolarHBondContact OG-N 2.8Å; D243-Q245 HydrophobicContact CB-CG 4.13Å; D243-Q245 VanDerWaalsContact CG-CG 3.46Å; D243-Q245 PolarHBondContact O-N 3.48Å; D243-Q245 WeakPolarHBondContact OD1-CB 3.27Å; D243-Q245 PolarHBondContact OD1-N 3.08Å; D243-Q245 WeakPolarHBondContact OD2-CG 3.37Å; Q245-L261 WeakPolarHBondContact O-CB 3.47Å; Q245-L261 PolarHBondContact O-N 2.91Å
246	F	96.6	Very high	95.5	Very high	13 Å²	13	28.6 Å²	28.6	6%	0.057	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	151.6	-174.7	-56.9	-76.1	0	0	0	112.5	F240 S241 I258 F259 K260 F304 L320 P345	F240-F246 WeakPolarHBondContact CA-O 3.38Å; S241-F246 PolarHBondContact N-O 3.01Å; S241-F246 PolarHBondContact OG-N 3.23Å; S241-F246 PolarHBondContact OG-O 2.74Å; F246-I258 HydrophobicContact CB-CG2 4.05Å; F246-I258 HydrophobicContact CD1-CG2 4.05Å; F246-I258 HydrophobicContact CG-CG2 4.3Å; F246-F259 CarbonylContact C-O 3.58Å; F246-F259 VanDerWaalsContact CA-O 3.26Å; F246-F259 WeakPolarHBondContact CA-O 3.47Å; F246-K260 HydrophobicContact CD1-CB 4.29Å; F246-K260 HydrophobicContact CD1-CG 4.24Å; F246-K260 HydrophobicContact CE1-CB 4.25Å; F246-K260 HydrophobicContact CE1-CD 4.19Å; F246-K260 HydrophobicContact CE1-CG 3.84Å; F246-F304 HydrophobicContact CD1-CD1 4.03Å; F246-F304 HydrophobicContact CD1-CE1 4.24Å; F246-F304 AromaticContact CE1-CD1 3.59Å; F246-F304 HydrophobicContact CE1-CD1 3.59Å; F246-F304 AromaticContact CE1-CE1 3.4Å; F246-F304 HydrophobicContact CE1-CE1 3.4Å; F246-F304 HydrophobicContact CE1-CG 4.45Å; F246-F304 HydrophobicContact CE1-CZ 4.13Å; F246-F304 HydrophobicContact CZ-CE1 4.03Å; F246-L320 HydrophobicContact CB-CD1 3.59Å; F246-L320 HydrophobicContact CG-CD1 4.48Å; F246-P345 HydrophobicContact CE2-CB 4.36Å; F246-P345 HydrophobicContact CZ-CB 4.19Å
247	L	97.6	Very high	95.5	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	116.6	168.6	176.5	61.2	0	0	0	109.1	A202 I211 V213 F225 F240 I258 F259 L261	A202-L247 HydrophobicContact CB-CD1 3.83Å; A202-L247 HydrophobicContact CB-CD2 3.83Å; I211-L247 HydrophobicContact CG2-CD2 3.81Å; V213-L247 HydrophobicContact CG2-CD2 3.59Å; F225-L247 HydrophobicContact CD2-CD2 4.35Å; F225-L247 HydrophobicContact CE2-CD2 4.41Å; F240-L247 HydrophobicContact CD1-CB 4.49Å; F240-L247 HydrophobicContact CD1-CD1 4.32Å; F240-L247 HydrophobicContact CD2-CD1 4.15Å; F240-L247 HydrophobicContact CE1-CD1 4.36Å; F240-L247 HydrophobicContact CE2-CD1 4.2Å; F240-L247 HydrophobicContact CG-CD1 4.22Å; F240-L247 HydrophobicContact CZ-CD1 4.31Å; L247-I258 WeakPolarHBondContact O-CA 3.35Å; L247-F259 PolarHBondContact N-O 3.42Å; L247-F259 PolarHBondContact O-N 3.49Å; L247-L261 HydrophobicContact CB-CD1 4.25Å; L247-L261 HydrophobicContact CB-CD2 4.42Å; L247-L261 HydrophobicContact CB-CG 4.46Å
248	C	97.3	Very high	95.6	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	141	175.1	-174	0	0	0	0	110.9	L238 V239 V256 H257 I258 C318 L320 L329	L238-C248 WeakPolarHBondContact CA-O 3.29Å; V239-C248 PolarHBondContact N-O 2.82Å; V239-C248 PolarHBondContact O-N 2.84Å; C248-V256 WeakPolarHBondContact SG-CG1 3.18Å; C248-H257 CarbonylContact C-O 3.57Å; C248-H257 WeakPolarHBondContact CA-O 3.44Å; C248-I258 HydrophobicContact CB-CG1 4.33Å; C248-C318 PolarHBondContact SG-SG 2.85Å; C248-L320 HydrophobicContact CB-CD1 3.89Å; C248-L320 HydrophobicContact CB-CD2 4.41Å; C248-L320 HydrophobicContact CB-CG 3.85Å; C248-L329 WeakPolarHBondContact SG-CD1 3.21Å
249	A	97.3	Very high	95.5	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.008	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	119.4	178.5	0	0	0	0	0	111.2	I211 S237 L238 H257 F259	I211-A249 HydrophobicContact CD1-CB 3.46Å; I211-A249 VanDerWaalsContact CD1-CB 3.46Å; S237-A249 WeakPolarHBondContact O-CA 3.26Å; L238-A249 HydrophobicContact CD2-CB 3.54Å; A249-H257 PolarHBondContact N-O 2.98Å; A249-H257 PolarHBondContact O-N 2.8Å; A249-F259 HydrophobicContact CB-CE2 4.18Å
250	S	96.3	Very high	95.3	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	158.3	173.2	83.7	0	0	0	0	111.7	S236 S237 N316	S236-S250 PolarHBondContact N-O 2.88Å; S237-S250 PolarHBondContact N-O 3.4Å; S237-S250 PolarHBondContact O-N 3.19Å; S250-N316 WeakPolarHBondContact CB-OD1 3.1Å; S250-N316 PolarHBondContact OG-OD1 2.92Å
251	S	94.9	Very high	95.1	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.007	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	-173.2	-177.9	81.2	0	0	0	0	111.8	T234 T253 N316	T234-S251 CarbonylContact O-C 3.47Å; T234-S251 WeakPolarHBondContact O-CA 3.32Å; T234-S251 VanDerWaalsContact O-CB 3.3Å; T234-S251 WeakPolarHBondContact O-CB 3.3Å; S251-T253 PolarHBondContact O-N 2.93Å; S251-T253 PolarHBondContact OG-N 3.15Å; S251-T253 PolarHBondContact OG-OG1 2.77Å; S251-N316 PolarHBondContact O-ND2 2.82Å
252	N	93.2	Very high	94.4	Very high	62 Å²	62	33.3 Å²	33.3	33%	0.332	17%	0.167	S	C	.	.	S	Bend	trans	-73.9	-0.6	172.6	67.6	-31.9	0	0	0	114.8	V233 T234 G313	V233-N252 WeakPolarHBondContact CB-OD1 3.32Å; T234-N252 PolarHBondContact N-OD1 2.87Å; T234-N252 PolarHBondContact O-N 3.15Å; N252-G313 PolarHBondContact O-N 2.8Å
253	T	92.4	Very high	92.8	Very high	17 Å²	17	36.2 Å²	36.2	10%	0.104	18%	0.179	C	C	.	.	S	Bend	trans	-82.7	165.1	170.6	59.4	0	0	0	0	112.8	V233 S251 T255	V233-T253 HydrophobicContact CB-CG2 4.47Å; V233-T253 HydrophobicContact CG1-CG2 3.56Å; S251-T253 PolarHBondContact O-N 2.93Å; S251-T253 PolarHBondContact OG-N 3.15Å; S251-T253 PolarHBondContact OG-OG1 2.77Å; T253-T255 PolarHBondContact O-N 2.8Å; T253-T255 PolarHBondContact OG1-O 3.41Å; T253-T255 PolarHBondContact OG1-OG1 3.47Å
254	E	91.4	Very high	90.8	Very high	73 Å²	73	37.1 Å²	37.1	34%	0.341	19%	0.188	S	C	.	.	S	Bend	trans	-65.3	13.2	170.7	69.7	-171.3	119.4	0	0	114.5	R308 L309	E254-R308 CarbonylContact O-C 3.58Å; E254-R308 WeakPolarHBondContact O-CA 3.38Å; E254-R308 IonicContact OE2-CZ 3.19Å; E254-R308 IonicContact OE2-NE 2.84Å; E254-R308 PolarHBondContact OE2-NE 2.84Å; E254-R308 IonicContact OE2-NH2 2.7Å; E254-R308 PolarHBondContact OE2-NH2 2.88Å; E254-L309 PolarHBondContact O-N 3.31Å
255	T	92.9	Very high	88.2	Confident	40 Å²	40	40.6 Å²	40.6	25%	0.245	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	128.5	-170.5	57.7	0	0	0	0	112.5	T253 H257 A307	T253-T255 PolarHBondContact O-N 2.8Å; T253-T255 PolarHBondContact OG1-O 3.41Å; T253-T255 PolarHBondContact OG1-OG1 3.47Å; T255-H257 PolarHBondContact OG1-NE2 2.83Å; T255-A307 WeakPolarHBondContact CA-O 3.45Å
256	V	96.1	Very high	85.5	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	135	163.8	-174.3	0	0	0	0	108.1	C248 T306 A307 L309 C318 L329 V331	C248-V256 WeakPolarHBondContact SG-CG1 3.18Å; V256-T306 VanDerWaalsContact O-CA 3.29Å; V256-T306 WeakPolarHBondContact O-CA 3.46Å; V256-A307 HydrophobicContact CB-CB 4.35Å; V256-A307 PolarHBondContact N-O 3.19Å; V256-A307 PolarHBondContact O-N 3.08Å; V256-L309 HydrophobicContact CG2-CD1 3.94Å; V256-L309 HydrophobicContact CG2-CD2 3.94Å; V256-L309 HydrophobicContact CG2-CG 4.08Å; V256-C318 HydrophobicContact CG1-CB 4.2Å; V256-L329 HydrophobicContact CB-CD2 4.11Å; V256-L329 HydrophobicContact CG1-CD1 4.13Å; V256-L329 HydrophobicContact CG1-CD2 4Å; V256-V331 HydrophobicContact CG2-CG2 4.11Å
257	H	95.9	Very high	82.6	Confident	24 Å²	24	47.5 Å²	47.5	11%	0.111	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	132.6	-177.3	-65.1	-94.1	0	0	0	110.3	R227 C248 A249 T255 F259 A303	R227-H257 HydrophobicContact CG-CB 4.35Å; C248-H257 CarbonylContact C-O 3.57Å; C248-H257 WeakPolarHBondContact CA-O 3.44Å; A249-H257 PolarHBondContact N-O 2.98Å; A249-H257 PolarHBondContact O-N 2.8Å; T255-H257 PolarHBondContact OG1-NE2 2.83Å; H257-F259 HydrophobicContact CB-CE2 3.77Å; H257-F259 HydrophobicContact CB-CZ 3.74Å; H257-A303 HydrophobicContact CB-CB 3.84Å
258	I	97.2	Very high	79.7	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	124.9	177	-60.4	165.2	0	0	0	107.8	F246 L247 C248 A303 F304 A305 L320 L329 L343	F246-I258 HydrophobicContact CB-CG2 4.05Å; F246-I258 HydrophobicContact CD1-CG2 4.05Å; F246-I258 HydrophobicContact CG-CG2 4.3Å; L247-I258 WeakPolarHBondContact O-CA 3.35Å; C248-I258 HydrophobicContact CB-CG1 4.33Å; I258-A303 CarbonylContact O-C 3.57Å; I258-A303 WeakPolarHBondContact O-CA 3.49Å; I258-F304 PolarHBondContact O-N 2.93Å; I258-A305 HydrophobicContact CB-CB 4.19Å; I258-A305 HydrophobicContact CD1-CB 4.26Å; I258-A305 PolarHBondContact N-O 3Å; I258-A305 PolarHBondContact O-N 3.28Å; I258-A305 VanDerWaalsContact O-N 3.16Å; I258-L320 HydrophobicContact CD1-CD2 3.99Å; I258-L320 HydrophobicContact CG1-CD2 4.45Å; I258-L320 HydrophobicContact CG2-CD1 4.3Å; I258-L329 HydrophobicContact CD1-CB 4.44Å; I258-L329 HydrophobicContact CD1-CD2 4.34Å; I258-L343 HydrophobicContact CD1-CD1 3.92Å; I258-L343 HydrophobicContact CD1-CD2 4.21Å
259	F	96.1	Very high	77.1	Confident	1 Å²	1	64.1 Å²	64.1	0%	0.004	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	141.1	178.8	-54.1	-83.4	0	0	0	109.7	I211 F225 R227 F246 L247 A249 H257 A303	I211-F259 HydrophobicContact CD1-CD2 4.48Å; I211-F259 HydrophobicContact CD1-CE2 3.65Å; I211-F259 HydrophobicContact CD1-CZ 4.2Å; F225-F259 HydrophobicContact CB-CD1 3.64Å; F225-F259 HydrophobicContact CB-CD2 4.33Å; F225-F259 HydrophobicContact CB-CE1 3.8Å; F225-F259 HydrophobicContact CB-CE2 4.47Å; F225-F259 HydrophobicContact CB-CG 3.92Å; F225-F259 HydrophobicContact CB-CZ 4.22Å; F225-F259 HydrophobicContact CD1-CB 3.85Å; F225-F259 AromaticContact CD1-CD1 3.75Å; F225-F259 HydrophobicContact CD1-CD1 3.75Å; F225-F259 AromaticContact CD1-CG 3.98Å; F225-F259 HydrophobicContact CD1-CG 3.98Å; F225-F259 HydrophobicContact CD2-CB 3.95Å; F225-F259 HydrophobicContact CD2-CG 4.08Å; F225-F259 HydrophobicContact CE1-CB 3.91Å; F225-F259 HydrophobicContact CE2-CB 4.01Å; F225-F259 HydrophobicContact CG-CB 3.87Å; F225-F259 AromaticContact CG-CD1 3.73Å; F225-F259 HydrophobicContact CG-CD1 3.73Å; F225-F259 HydrophobicContact CG-CD2 4.39Å; F225-F259 HydrophobicContact CG-CE1 4.4Å; F225-F259 AromaticContact CG-CG 3.72Å; F225-F259 HydrophobicContact CG-CG 3.72Å; F225-F259 HydrophobicContact CZ-CB 3.98Å; R227-F259 HydrophobicContact CB-CZ 4.13Å; R227-F259 HydrophobicContact CG-CZ 4.33Å; F246-F259 CarbonylContact C-O 3.58Å; F246-F259 VanDerWaalsContact CA-O 3.26Å; F246-F259 WeakPolarHBondContact CA-O 3.47Å; L247-F259 PolarHBondContact N-O 3.42Å; L247-F259 PolarHBondContact O-N 3.49Å; A249-F259 HydrophobicContact CB-CE2 4.18Å; H257-F259 HydrophobicContact CB-CE2 3.77Å; H257-F259 HydrophobicContact CB-CZ 3.74Å; F259-A303 HydrophobicContact CD1-CB 4.27Å; F259-A303 HydrophobicContact CE1-CB 3.92Å; F259-A303 HydrophobicContact CZ-CB 4.31Å
260	K	94.1	Very high	74.4	Confident	57 Å²	57	73.2 Å²	73.2	25%	0.248	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	135.3	176.6	-162.1	167.5	-176.4	170.3	0	109.1	F246 E262 F304	F246-K260 HydrophobicContact CD1-CB 4.29Å; F246-K260 HydrophobicContact CD1-CG 4.24Å; F246-K260 HydrophobicContact CE1-CB 4.25Å; F246-K260 HydrophobicContact CE1-CD 4.19Å; F246-K260 HydrophobicContact CE1-CG 3.84Å; K260-E262 HydrophobicContact CB-CG 4.27Å; K260-E262 HydrophobicContact CD-CG 4.25Å; K260-E262 HydrophobicContact CG-CG 3.93Å; K260-E262 PolarHBondContact O-N 3.41Å; K260-F304 HydrophobicContact CB-CB 3.97Å; K260-F304 HydrophobicContact CB-CD2 4.3Å; K260-F304 HydrophobicContact CB-CG 4.01Å; K260-F304 HydrophobicContact CD-CD2 3.78Å; K260-F304 HydrophobicContact CD-CE2 3.85Å; K260-F304 HydrophobicContact CD-CG 4.21Å; K260-F304 HydrophobicContact CD-CZ 4.33Å
261	L	92.6	Very high	71.7	Confident	5 Å²	5	80.1 Å²	80.1	3%	0.026	41%	0.407	C	S	.	.			trans	-98.9	63.8	-175.7	-65.9	163.1	0	0	0	109.4	V213 Y223 F225 F240 S244 Q245 L247 Q263	V213-L261 HydrophobicContact CG2-CD2 4.34Å; Y223-L261 HydrophobicContact CD1-CD2 4.46Å; Y223-L261 HydrophobicContact CD2-CD2 3.9Å; Y223-L261 HydrophobicContact CE2-CD2 4.03Å; Y223-L261 HydrophobicContact CG-CD2 4.15Å; F225-L261 HydrophobicContact CE2-CD2 3.76Å; F225-L261 HydrophobicContact CZ-CD2 3.89Å; F240-L261 HydrophobicContact CD1-CD1 3.51Å; F240-L261 HydrophobicContact CE1-CD1 3.55Å; F240-L261 HydrophobicContact CE1-CD2 4.42Å; S244-L261 VanDerWaalsContact O-CD1 3.3Å; S244-L261 WeakPolarHBondContact O-CD1 3.48Å; Q245-L261 WeakPolarHBondContact O-CB 3.47Å; Q245-L261 PolarHBondContact O-N 2.91Å; L247-L261 HydrophobicContact CB-CD1 4.25Å; L247-L261 HydrophobicContact CB-CD2 4.42Å; L247-L261 HydrophobicContact CB-CG 4.46Å; L261-Q263 PolarHBondContact O-N 2.89Å
262	E	83.7	Confident	68.9	Low	126 Å²	126	86 Å²	86	59%	0.589	44%	0.444	S	S	*	.			trans	-63.7	126.3	-175.2	-58.2	-160.9	157.6	0	0	111.1	Y223 K260 V264	Y223-E262 VanDerWaalsContact CE1-O 3.29Å; Y223-E262 WeakPolarHBondContact CE1-O 3.41Å; Y223-E262 PolarHBondContact OH-O 3.34Å; Y223-E262 VanDerWaalsContact OH-O 3.04Å; K260-E262 HydrophobicContact CB-CG 4.27Å; K260-E262 HydrophobicContact CD-CG 4.25Å; K260-E262 HydrophobicContact CG-CG 3.93Å; K260-E262 PolarHBondContact O-N 3.41Å; E262-V264 PolarHBondContact O-N 3.08Å
263	Q	60.6	Low	66.7	Low	146 Å²	146	89.1 Å²	89.1	68%	0.682	47%	0.47	S	S	*	.			trans	-65.9	111.7	-180	-66.4	-171.2	3.9	0	0	109.9	L261 T265	L261-Q263 PolarHBondContact O-N 2.89Å; Q263-T265 HydrophobicContact CB-CG2 4.19Å; Q263-T265 PolarHBondContact O-N 2.79Å
264	V	51.5	Low	64.5	Low	113 Å²	113	92.4 Å²	92.4	69%	0.685	49%	0.491	S	S	*	.			trans	-67.3	75.3	168.6	-172.8	0	0	0	0	109	E262 N266	E262-V264 PolarHBondContact O-N 3.08Å; V264-N266 PolarHBondContact O-N 3.38Å
265	T	40.7	Very low	62.4	Low	90 Å²	90	100.1 Å²	100.1	55%	0.552	52%	0.517	S	S	*	.			trans	-75.8	113.3	170.9	46.9	0	0	0	0	107.4	Q263 S267	Q263-T265 HydrophobicContact CB-CG2 4.19Å; Q263-T265 PolarHBondContact O-N 2.79Å; T265-S267 PolarHBondContact O-N 3.34Å
266	N	38.1	Very low	60.4	Low	159 Å²	159	102.2 Å²	102.2	85%	0.85	53%	0.533	S	S	*	.			trans	-73.8	41.7	172.9	-79.4	-29.4	0	0	0	111.7	V264 R268	V264-N266 PolarHBondContact O-N 3.38Å; N266-R268 PolarHBondContact O-N 3.16Å; N266-R268 VanDerWaalsContact O-N 3.17Å
267	S	35.7	Very low	58.1	Low	82 Å²	82	103.9 Å²	103.9	57%	0.573	55%	0.55	S	S	*	*			trans	-73.2	100.5	167.7	51.8	0	0	0	0	108.7	T265 P269	T265-S267 PolarHBondContact O-N 3.34Å; S267-P269 VanDerWaalsContact O-CD 3.27Å; S267-P269 WeakPolarHBondContact O-CD 3.47Å
268	R	36.8	Very low	56.1	Low	234 Å²	234	111.4 Å²	111.4	88%	0.883	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-53.6	121.3	155.2	-90	-179.2	165.7	171.9	-4.6	107.6	N266 E270	N266-R268 PolarHBondContact O-N 3.16Å; N266-R268 VanDerWaalsContact O-N 3.17Å; R268-E270 PolarHBondContact O-N 2.85Å
269	P	41.1	Very low	53.9	Low	116 Å²	116	118.3 Å²	118.3	75%	0.753	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-66.1	127.8	170.8	-17.5	31.9	0	0	0	109	S267 E271	S267-P269 VanDerWaalsContact O-CD 3.27Å; S267-P269 WeakPolarHBondContact O-CD 3.47Å; P269-E271 PolarHBondContact O-N 2.85Å
270	E	41.2	Very low	51.7	Low	191 Å²	191	120 Å²	120	89%	0.893	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-70	121.9	161.4	-68	-169.5	124.8	0	0	107.9	R268 T272	R268-E270 PolarHBondContact O-N 2.85Å; E270-T272 PolarHBondContact O-N 2.82Å; E270-T272 VanDerWaalsContact O-N 3.09Å
271	E	39.8	Very low	49.6	Very low	145 Å²	145	122.3 Å²	122.3	68%	0.678	64%	0.64	S	S	*	*			trans	-70.1	107.9	-173.6	-66	-159.8	148	0	0	111.6	P269 K281	P269-E271 PolarHBondContact O-N 2.85Å; E271-K281 WeakPolarHBondContact OE1-CE 3.49Å; E271-K281 IonicContact OE1-NZ 3.86Å; E271-K281 PolarHBondContact OE1-NZ 3.07Å; E271-K281 IonicContact OE2-NZ 3.66Å; E271-K281 PolarHBondContact OE2-NZ 2.97Å
272	T	36.5	Very low	47.6	Very low	125 Å²	125	129.4 Å²	129.4	77%	0.767	68%	0.675	S	S	*	*			trans	-84.8	116	159.4	46	0	0	0	0	109.5	E270 T274	E270-T272 PolarHBondContact O-N 2.82Å; E270-T272 VanDerWaalsContact O-N 3.09Å; T272-T274 VanDerWaalsContact C-N 3.3Å; T272-T274 PolarHBondContact O-N 2.81Å
273	S	46.4	Very low	46.1	Very low	127 Å²	127	131 Å²	131	89%	0.888	68%	0.681	S	S	*	*			trans	-75.1	71.8	-165.7	59.4	0	0	0	0	113.8
274	T	47.2	Very low	45.6	Very low	87 Å²	87	130.5 Å²	130.5	53%	0.534	68%	0.68	S	S	.	*			trans	-89.3	145.9	175.4	-48.9	0	0	0	0	110.9	T272 S276 G277	T272-T274 VanDerWaalsContact C-N 3.3Å; T272-T274 PolarHBondContact O-N 2.81Å; T274-S276 WeakPolarHBondContact CG2-OG 3.42Å; T274-S276 PolarHBondContact O-N 3.42Å; T274-S276 VanDerWaalsContact O-N 3.16Å; T274-G277 WeakPolarHBondContact O-CA 3.39Å; T274-G277 PolarHBondContact O-N 3.46Å
275	W	46.2	Very low	45.5	Very low	234 Å²	234	127.6 Å²	127.6	89%	0.886	67%	0.668	S	S	*	*	H	α-helix	trans	-58.3	-30	-176.7	-166.4	32.3	0	0	0	113.8	G277 Y278	W275-G277 PolarHBondContact O-N 2.96Å; W275-Y278 WeakPolarHBondContact O-CB 3.49Å; W275-Y278 PolarHBondContact O-N 2.91Å; W275-Y278 VanDerWaalsContact O-N 3.08Å
276	S	50.8	Low	45.8	Very low	84 Å²	84	126.2 Å²	126.2	59%	0.587	67%	0.665	S	S	*	*	H	α-helix	trans	-56.5	-34.2	170.1	48.1	0	0	0	0	113.4	T274 Y278 M279 G280	T274-S276 WeakPolarHBondContact CG2-OG 3.42Å; T274-S276 PolarHBondContact O-N 3.42Å; T274-S276 VanDerWaalsContact O-N 3.16Å; S276-Y278 VanDerWaalsContact C-N 3.27Å; S276-Y278 PolarHBondContact O-N 3.41Å; S276-M279 PolarHBondContact O-N 3.06Å; S276-G280 PolarHBondContact O-N 3.5Å
277	G	49	Very low	46.3	Very low	35 Å²	35	121.4 Å²	121.4	36%	0.361	64%	0.642	S	S	.	*	H	α-helix	trans	-65	-27.4	175.9	0	0	0	0	0	113.4	T274 W275 K281	T274-G277 WeakPolarHBondContact O-CA 3.39Å; T274-G277 PolarHBondContact O-N 3.46Å; W275-G277 PolarHBondContact O-N 2.96Å; G277-K281 WeakPolarHBondContact O-CB 3.48Å; G277-K281 VanDerWaalsContact O-CG 3.28Å; G277-K281 WeakPolarHBondContact O-CG 3.34Å; G277-K281 PolarHBondContact O-N 2.72Å
278	Y	53.9	Low	46.6	Very low	182 Å²	182	124.1 Å²	124.1	71%	0.714	65%	0.65	S	S	*	*	H	α-helix	trans	-71.1	-40.1	173	-110.7	-86.4	0	0	0	111.8	W275 S276 K281 M282	W275-Y278 WeakPolarHBondContact O-CB 3.49Å; W275-Y278 PolarHBondContact O-N 2.91Å; W275-Y278 VanDerWaalsContact O-N 3.08Å; S276-Y278 VanDerWaalsContact C-N 3.27Å; S276-Y278 PolarHBondContact O-N 3.41Å; Y278-K281 PolarHBondContact O-N 3.25Å; Y278-M282 PolarHBondContact O-N 3.21Å
279	M	49.6	Very low	47.4	Very low	146 Å²	146	123 Å²	123	72%	0.719	65%	0.647	S	S	*	*	H	α-helix	trans	-67.3	-39.3	174.7	-157.1	176.6	-165.7	0	0	111.2	S276 M282 F283	S276-M279 PolarHBondContact O-N 3.06Å; M279-M282 PolarHBondContact O-N 2.7Å; M279-F283 PolarHBondContact O-N 2.87Å
280	G	50.3	Low	47.6	Very low	36 Å²	36	121.4 Å²	121.4	37%	0.371	63%	0.632	S	S	.	*	H	α-helix	trans	-60.6	-45.3	171.4	0	0	0	0	0	113.1	S276 M282 F283 M284	S276-G280 PolarHBondContact O-N 3.5Å; G280-M282 VanDerWaalsContact C-N 3.29Å; G280-M282 PolarHBondContact O-N 2.97Å; G280-F283 PolarHBondContact O-N 3.44Å; G280-M284 PolarHBondContact O-N 2.86Å
281	K	50	Low	47.7	Very low	105 Å²	105	115.9 Å²	115.9	46%	0.457	61%	0.613	S	S	.	*	H	α-helix	trans	-63	-33.8	174.7	-76.3	173.9	-179.4	-178.3	0	112.4	E271 G277 Y278 A285	E271-K281 WeakPolarHBondContact OE1-CE 3.49Å; E271-K281 IonicContact OE1-NZ 3.86Å; E271-K281 PolarHBondContact OE1-NZ 3.07Å; E271-K281 IonicContact OE2-NZ 3.66Å; E271-K281 PolarHBondContact OE2-NZ 2.97Å; G277-K281 WeakPolarHBondContact O-CB 3.48Å; G277-K281 VanDerWaalsContact O-CG 3.28Å; G277-K281 WeakPolarHBondContact O-CG 3.34Å; G277-K281 PolarHBondContact O-N 2.72Å; Y278-K281 PolarHBondContact O-N 3.25Å; K281-A285 WeakPolarHBondContact O-CB 3.15Å; K281-A285 PolarHBondContact O-N 3.08Å
282	M	49.8	Very low	48.1	Very low	154 Å²	154	114.1 Å²	114.1	76%	0.759	61%	0.612	S	S	*	*	H	α-helix	trans	-70.9	-35.1	173.8	-164.5	168.3	178	0	0	112.6	Y278 M279 G280 A286	Y278-M282 PolarHBondContact O-N 3.21Å; M279-M282 PolarHBondContact O-N 2.7Å; G280-M282 VanDerWaalsContact C-N 3.29Å; G280-M282 PolarHBondContact O-N 2.97Å; M282-A286 PolarHBondContact O-N 3.18Å
283	F	53.4	Low	48.6	Very low	160 Å²	160	115.9 Å²	115.9	70%	0.702	61%	0.612	S	S	*	*	H	α-helix	trans	-69.5	-41.8	173	-133.5	-89.5	0	0	0	112	M279 G280 A285 A286 T287	M279-F283 PolarHBondContact O-N 2.87Å; G280-F283 PolarHBondContact O-N 3.44Å; F283-A285 VanDerWaalsContact C-N 3.35Å; F283-A286 WeakPolarHBondContact O-CB 3.37Å; F283-A286 PolarHBondContact O-N 3.46Å; F283-A286 VanDerWaalsContact O-N 3.13Å; F283-T287 PolarHBondContact O-N 2.79Å; F283-T287 VanDerWaalsContact O-N 3.17Å
284	M	49.8	Very low	48.6	Very low	136 Å²	136	112 Å²	112	67%	0.67	58%	0.582	S	S	*	*	H	α-helix	trans	-68.3	-31.3	174.9	-75.5	-173.4	165.9	0	0	113.1	G280 A286 T287 N288	G280-M284 PolarHBondContact O-N 2.86Å; M284-A286 PolarHBondContact O-N 2.85Å; M284-T287 WeakPolarHBondContact CA-OG1 3.16Å; M284-T287 PolarHBondContact O-N 2.97Å; M284-T287 PolarHBondContact O-OG1 2.96Å; M284-N288 PolarHBondContact O-N 3.08Å
285	A	49.4	Very low	48.3	Very low	51 Å²	51	110 Å²	110	42%	0.421	57%	0.572	S	S	.	*	H	α-helix	trans	-63.2	-31.2	170.5	0	0	0	0	0	112.2	K281 F283	K281-A285 WeakPolarHBondContact O-CB 3.15Å; K281-A285 PolarHBondContact O-N 3.08Å; F283-A285 VanDerWaalsContact C-N 3.35Å
286	A	47.5	Very low	48.1	Very low	61 Å²	61	104.5 Å²	104.5	50%	0.504	56%	0.56	S	S	.	*	H	α-helix	trans	-74.2	-35.1	173.2	0	0	0	0	0	112.7	M282 F283 M284 N288 Y289	M282-A286 PolarHBondContact O-N 3.18Å; F283-A286 WeakPolarHBondContact O-CB 3.37Å; F283-A286 PolarHBondContact O-N 3.46Å; F283-A286 VanDerWaalsContact O-N 3.13Å; M284-A286 PolarHBondContact O-N 2.85Å; A286-N288 PolarHBondContact O-N 2.75Å; A286-Y289 PolarHBondContact O-N 2.72Å; A286-Y289 VanDerWaalsContact O-N 3.12Å
287	T	46.9	Very low	47.7	Very low	58 Å²	58	106.3 Å²	106.3	36%	0.356	56%	0.56	S	S	.	*	H	α-helix	trans	-66.9	-22.6	175.7	51.9	0	0	0	0	113.5	F283 M284 Y289 L290	F283-T287 PolarHBondContact O-N 2.79Å; F283-T287 VanDerWaalsContact O-N 3.17Å; M284-T287 WeakPolarHBondContact CA-OG1 3.16Å; M284-T287 PolarHBondContact O-N 2.97Å; M284-T287 PolarHBondContact O-OG1 2.96Å; T287-Y289 PolarHBondContact O-N 3.05Å; T287-L290 WeakPolarHBondContact O-CB 3.06Å; T287-L290 PolarHBondContact O-N 2.79Å
288	N	43.1	Very low	47.3	Very low	139 Å²	139	111.4 Å²	111.4	74%	0.743	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	-9.1	172.2	-72.6	-15.6	0	0	0	114.2	M284 A286	M284-N288 PolarHBondContact O-N 3.08Å; A286-N288 PolarHBondContact O-N 2.75Å
289	Y	52.9	Low	46.8	Very low	210 Å²	210	109.8 Å²	109.8	82%	0.824	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96	-2.7	170.7	-75.7	-87.7	0	0	0	113.6	A286 T287	A286-Y289 PolarHBondContact O-N 2.72Å; A286-Y289 VanDerWaalsContact O-N 3.12Å; T287-Y289 PolarHBondContact O-N 3.05Å
290	L	44.8	Very low	46.6	Very low	83 Å²	83	107.2 Å²	107.2	44%	0.435	56%	0.562	S	S	.	*	S	Bend	trans	-88.5	138.9	168.9	-66.8	171.6	0	0	0	109.5	T287 V294	T287-L290 WeakPolarHBondContact O-CB 3.06Å; T287-L290 PolarHBondContact O-N 2.79Å; L290-V294 HydrophobicContact CD2-CG1 4.45Å
291	P	43.6	Very low	46.8	Very low	76 Å²	76	110 Å²	110	49%	0.494	57%	0.568	S	S	.	*			trans	-57	142.6	169.3	-21.7	32.4	0	0	0	110.4	Q293 V294 S295	P291-Q293 PolarHBondContact O-N 3.19Å; P291-Q293 VanDerWaalsContact O-N 3.17Å; P291-V294 HydrophobicContact CB-CG2 4.18Å; P291-V294 HydrophobicContact CG-CG2 4.17Å; P291-V294 WeakPolarHBondContact O-CA 3.18Å; P291-V294 WeakPolarHBondContact O-CB 3.37Å; P291-V294 PolarHBondContact O-N 2.9Å; P291-S295 PolarHBondContact O-N 2.56Å
292	T	48.7	Very low	47.9	Very low	108 Å²	108	115.5 Å²	115.5	66%	0.663	59%	0.586	S	S	*	*	H	α-helix	trans	-53.2	-39.7	177.9	47.1	0	0	0	0	112.1	V294 S295 D296	T292-V294 PolarHBondContact O-N 2.76Å; T292-S295 PolarHBondContact O-N 3.14Å; T292-D296 PolarHBondContact O-N 3.22Å
293	Q	47.3	Very low	49.7	Very low	162 Å²	162	109.2 Å²	109.2	76%	0.757	56%	0.558	S	S	*	*	H	α-helix	trans	-56.2	-20	173.1	-63.3	174.6	-7.8	0	0	114.8	P291 M297	P291-Q293 PolarHBondContact O-N 3.19Å; P291-Q293 VanDerWaalsContact O-N 3.17Å; Q293-M297 WeakPolarHBondContact O-CB 3.39Å
294	V	45.8	Very low	51.6	Low	44 Å²	44	103.6 Å²	103.6	27%	0.267	53%	0.533	S	S	.	.	H	α-helix	trans	-96.2	-33	176	-178.9	0	0	0	0	111.3	L290 P291 T292 M297 M298	L290-V294 HydrophobicContact CD2-CG1 4.45Å; P291-V294 HydrophobicContact CB-CG2 4.18Å; P291-V294 HydrophobicContact CG-CG2 4.17Å; P291-V294 WeakPolarHBondContact O-CA 3.18Å; P291-V294 WeakPolarHBondContact O-CB 3.37Å; P291-V294 PolarHBondContact O-N 2.9Å; T292-V294 PolarHBondContact O-N 2.76Å; V294-M297 HydrophobicContact CG1-CE 4.29Å; V294-M297 PolarHBondContact O-N 2.68Å; V294-M298 PolarHBondContact O-N 3.49Å; V294-M298 VanDerWaalsContact O-N 3.09Å
295	S	42.1	Very low	53.7	Low	47 Å²	47	97.1 Å²	97.1	33%	0.329	50%	0.502	S	S	.	.	H	α-helix	trans	-67.3	-47.3	174.4	-167	0	0	0	0	111.4	P291 T292 M297 M298 H299	P291-S295 PolarHBondContact O-N 2.56Å; T292-S295 PolarHBondContact O-N 3.14Å; S295-M297 PolarHBondContact O-N 2.77Å; S295-M297 VanDerWaalsContact O-N 3.16Å; S295-M298 PolarHBondContact O-N 3.06Å; S295-M298 VanDerWaalsContact O-N 3.09Å; S295-H299 PolarHBondContact O-N 2.8Å
296	D	40.7	Very low	55.9	Low	117 Å²	117	97 Å²	97	63%	0.626	50%	0.496	S	S	*	.	H	α-helix	trans	-63.6	-19.6	173.8	-67.1	-25.2	0	0	0	112.8	T292	T292-D296 PolarHBondContact O-N 3.22Å
297	M	43.4	Very low	58.3	Low	122 Å²	122	94.1 Å²	94.1	60%	0.601	47%	0.472	S	S	*	.	H	α-helix	trans	-86.3	-25.9	176.1	-175.3	174.7	64.7	0	0	113	Q293 V294 S295	Q293-M297 WeakPolarHBondContact O-CB 3.39Å; V294-M297 HydrophobicContact CG1-CE 4.29Å; V294-M297 PolarHBondContact O-N 2.68Å; S295-M297 PolarHBondContact O-N 2.77Å; S295-M297 VanDerWaalsContact O-N 3.16Å
298	M	39.4	Very low	60.5	Low	143 Å²	143	98.2 Å²	98.2	70%	0.704	48%	0.481	S	S	*	.	H	α-helix	trans	-74.3	-33	176.5	-79.4	-68.7	-160.6	0	0	112.7	V294 S295	V294-M298 PolarHBondContact O-N 3.49Å; V294-M298 VanDerWaalsContact O-N 3.09Å; S295-M298 PolarHBondContact O-N 3.06Å; S295-M298 VanDerWaalsContact O-N 3.09Å
299	H	43.8	Very low	63	Low	148 Å²	148	91.8 Å²	91.8	69%	0.685	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	21.2	-176.8	-67.2	-79.3	0	0	0	114	S295 D301	S295-H299 PolarHBondContact O-N 2.8Å; H299-D301 PolarHBondContact O-N 3.02Å
300	Q	46.2	Very low	64.7	Low	92 Å²	92	88.1 Å²	88.1	43%	0.43	44%	0.441	S	S	.	.	S	Bend	trans	-80.7	92.2	178.1	-158.1	163.6	68.5	0	0	110.2	R226 R302	R226-Q300 HydrophobicContact CB-CG 4.15Å; Q300-R302 PolarHBondContact O-N 3.02Å
301	D	53.8	Low	66.8	Low	94 Å²	94	85.4 Å²	85.4	50%	0.503	43%	0.426	S	S	.	.			trans	-41.1	115.7	-159.9	-70.4	-43.2	0	0	0	115.3	F225 H299	F225-D301 HydrophobicContact CD1-CB 4.37Å; H299-D301 PolarHBondContact O-N 3.02Å
302	R	73.6	Confident	68.9	Low	221 Å²	221	85.6 Å²	85.6	83%	0.834	43%	0.429	S	S	*	.			trans	-67	154.1	161.9	-59.4	-178.4	-175.4	-173.3	2.6	108.1	Q300 F304	Q300-R302 PolarHBondContact O-N 3.02Å; R302-F304 PolarHBondContact O-N 2.82Å
303	A	86.8	Confident	70.6	Confident	21 Å²	21	83.2 Å²	83.2	17%	0.174	43%	0.426	C	S	.	.			trans	-57	127.6	172	0	0	0	0	0	109.8	H257 I258 F259 A305 T306	H257-A303 HydrophobicContact CB-CB 3.84Å; I258-A303 CarbonylContact O-C 3.57Å; I258-A303 WeakPolarHBondContact O-CA 3.49Å; F259-A303 HydrophobicContact CD1-CB 4.27Å; F259-A303 HydrophobicContact CE1-CB 3.92Å; F259-A303 HydrophobicContact CZ-CB 4.31Å; A303-A305 PolarHBondContact O-N 3.37Å; A303-T306 HydrophobicContact CB-CG2 3.78Å
304	F	93.4	Very high	72.6	Confident	42 Å²	42	79.7 Å²	79.7	18%	0.184	41%	0.41	C	S	.	.	S	Bend	trans	-55	-40.1	177.1	164.6	-101.3	0	0	0	111.3	F246 I258 K260 R302 L343 D344 Q346 G348 G349	F246-F304 HydrophobicContact CD1-CD1 4.03Å; F246-F304 HydrophobicContact CD1-CE1 4.24Å; F246-F304 AromaticContact CE1-CD1 3.59Å; F246-F304 HydrophobicContact CE1-CD1 3.59Å; F246-F304 AromaticContact CE1-CE1 3.4Å; F246-F304 HydrophobicContact CE1-CE1 3.4Å; F246-F304 HydrophobicContact CE1-CG 4.45Å; F246-F304 HydrophobicContact CE1-CZ 4.13Å; F246-F304 HydrophobicContact CZ-CE1 4.03Å; I258-F304 PolarHBondContact O-N 2.93Å; K260-F304 HydrophobicContact CB-CB 3.97Å; K260-F304 HydrophobicContact CB-CD2 4.3Å; K260-F304 HydrophobicContact CB-CG 4.01Å; K260-F304 HydrophobicContact CD-CD2 3.78Å; K260-F304 HydrophobicContact CD-CE2 3.85Å; K260-F304 HydrophobicContact CD-CG 4.21Å; K260-F304 HydrophobicContact CD-CZ 4.33Å; R302-F304 PolarHBondContact O-N 2.82Å; F304-L343 HydrophobicContact CE1-CD1 4.44Å; F304-D344 WeakPolarHBondContact CE1-O 3.4Å; F304-Q346 WeakPolarHBondContact CE2-O 3.27Å; F304-Q346 WeakPolarHBondContact CZ-O 3.36Å; F304-G348 VanDerWaalsContact CZ-N 3.3Å; F304-G348 WeakPolarHBondContact O-CA 3.36Å; F304-G349 PolarHBondContact O-N 2.58Å
305	A	95.4	Very high	74.8	Confident	1 Å²	1	84.7 Å²	84.7	1%	0.008	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	155.8	169.6	0	0	0	0	0	111.4	I258 A303 L343 G349	I258-A305 HydrophobicContact CB-CB 4.19Å; I258-A305 HydrophobicContact CD1-CB 4.26Å; I258-A305 PolarHBondContact N-O 3Å; I258-A305 PolarHBondContact O-N 3.28Å; I258-A305 VanDerWaalsContact O-N 3.16Å; A303-A305 PolarHBondContact O-N 3.37Å; A305-L343 HydrophobicContact CB-CD1 3.43Å; A305-L343 VanDerWaalsContact CB-CD1 3.43Å; A305-G349 CarbonylContact C-O 3.4Å; A305-G349 WeakPolarHBondContact CA-O 3.24Å; A305-G349 WeakPolarHBondContact CB-O 3.47Å
306	T	95.4	Very high	77.4	Confident	47 Å²	47	82.5 Å²	82.5	29%	0.288	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	135.8	176.9	53.1	0	0	0	0	111.3	V256 A303 G349 E350 C351	V256-T306 VanDerWaalsContact O-CA 3.29Å; V256-T306 WeakPolarHBondContact O-CA 3.46Å; A303-T306 HydrophobicContact CB-CG2 3.78Å; T306-G349 PolarHBondContact N-O 3.24Å; T306-E350 CarbonylContact O-C 3.49Å; T306-E350 WeakPolarHBondContact O-CA 3.26Å; T306-C351 PolarHBondContact O-N 3.09Å
307	A	96.4	Very high	80.1	Confident	1 Å²	1	78 Å²	78	1%	0.008	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	136	170.7	0	0	0	0	0	110.3	T255 V256 L329 Y341 C351	T255-A307 WeakPolarHBondContact CA-O 3.45Å; V256-A307 HydrophobicContact CB-CB 4.35Å; V256-A307 PolarHBondContact N-O 3.19Å; V256-A307 PolarHBondContact O-N 3.08Å; A307-L329 HydrophobicContact CB-CD2 3.29Å; A307-Y341 HydrophobicContact CB-CD1 3.98Å; A307-Y341 HydrophobicContact CB-CD2 4.46Å; A307-Y341 HydrophobicContact CB-CE1 4.07Å; A307-Y341 HydrophobicContact CB-CG 4.19Å; A307-C351 HydrophobicContact CB-CB 3.74Å
308	R	95	Very high	82.7	Confident	145 Å²	145	72.2 Å²	72.2	55%	0.547	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	128.9	174.7	-162.5	174.7	-173.7	-175.6	-0.1	110.9	E254 Y341	E254-R308 CarbonylContact O-C 3.58Å; E254-R308 WeakPolarHBondContact O-CA 3.38Å; E254-R308 IonicContact OE2-CZ 3.19Å; E254-R308 IonicContact OE2-NE 2.84Å; E254-R308 PolarHBondContact OE2-NE 2.84Å; E254-R308 IonicContact OE2-NH2 2.7Å; E254-R308 PolarHBondContact OE2-NH2 2.88Å; R308-Y341 WeakPolarHBondContact O-CE1 3.29Å; R308-Y341 PolarHBondContact O-OH 2.78Å
309	L	93.8	Very high	85.4	Confident	4 Å²	4	65.5 Å²	65.5	2%	0.021	32%	0.322	C	S	.	.			trans	-93.9	138.1	177.9	-55.1	178.2	0	0	0	109.5	E254 V256 F311 V331 Y341	E254-L309 PolarHBondContact O-N 3.31Å; V256-L309 HydrophobicContact CG2-CD1 3.94Å; V256-L309 HydrophobicContact CG2-CD2 3.94Å; V256-L309 HydrophobicContact CG2-CG 4.08Å; L309-F311 HydrophobicContact CB-CD1 4.15Å; L309-F311 HydrophobicContact CB-CE1 3.96Å; L309-F311 HydrophobicContact CB-CE2 4.47Å; L309-F311 HydrophobicContact CB-CG 4.48Å; L309-F311 HydrophobicContact CB-CZ 4.14Å; L309-F311 HydrophobicContact CD1-CE1 4.43Å; L309-F311 HydrophobicContact CD1-CE2 3.93Å; L309-F311 HydrophobicContact CD1-CZ 3.79Å; L309-F311 HydrophobicContact CD2-CE1 4.3Å; L309-F311 HydrophobicContact CD2-CZ 4.25Å; L309-F311 HydrophobicContact CG-CE1 4.46Å; L309-F311 HydrophobicContact CG-CZ 4.28Å; L309-F311 PolarHBondContact O-N 2.87Å; L309-V331 HydrophobicContact CD2-CB 4.34Å; L309-V331 HydrophobicContact CD2-CG1 4.03Å; L309-V331 HydrophobicContact CD2-CG2 4.2Å; L309-Y341 HydrophobicContact CD2-CE2 4.31Å
310	N	90	Very high	88	Confident	132 Å²	132	58.9 Å²	58.9	71%	0.706	29%	0.292	S	S	*	.	S	Bend	trans	-76.6	21	176.5	-65.2	0.3	0	0	0	112.9
311	F	88.9	Confident	90.3	Very high	26 Å²	26	55.1 Å²	55.1	11%	0.114	28%	0.276	C	S	.	.			trans	-154.7	162.6	-177.5	62.2	-91.4	0	0	0	110.4	L309 Q314 N316 S333 Y339	L309-F311 HydrophobicContact CB-CD1 4.15Å; L309-F311 HydrophobicContact CB-CE1 3.96Å; L309-F311 HydrophobicContact CB-CE2 4.47Å; L309-F311 HydrophobicContact CB-CG 4.48Å; L309-F311 HydrophobicContact CB-CZ 4.14Å; L309-F311 HydrophobicContact CD1-CE1 4.43Å; L309-F311 HydrophobicContact CD1-CE2 3.93Å; L309-F311 HydrophobicContact CD1-CZ 3.79Å; L309-F311 HydrophobicContact CD2-CE1 4.3Å; L309-F311 HydrophobicContact CD2-CZ 4.25Å; L309-F311 HydrophobicContact CG-CE1 4.46Å; L309-F311 HydrophobicContact CG-CZ 4.28Å; L309-F311 PolarHBondContact O-N 2.87Å; F311-Q314 HydrophobicContact CD2-CB 3.78Å; F311-Q314 HydrophobicContact CD2-CG 4.26Å; F311-Q314 HydrophobicContact CE2-CB 4.12Å; F311-N316 HydrophobicContact CE2-CB 4.17Å; F311-N316 HydrophobicContact CZ-CB 4.3Å; F311-S333 WeakPolarHBondContact CE2-OG 3.43Å; F311-S333 WeakPolarHBondContact CZ-OG 3.42Å; F311-Y339 HydrophobicContact CD1-CE2 4.08Å; F311-Y339 AromaticContact CE1-CD2 3.91Å; F311-Y339 HydrophobicContact CE1-CD2 3.91Å; F311-Y339 AromaticContact CE1-CE2 3.38Å; F311-Y339 HydrophobicContact CE1-CE2 3.38Å; F311-Y339 AromaticContact CE1-CZ 3.79Å; F311-Y339 HydrophobicContact CZ-CE2 4.22Å
312	S	86.4	Confident	92.3	Very high	81 Å²	81	55.4 Å²	55.4	57%	0.566	28%	0.281	S	S	*	.	S	Bend	trans	-144	165.7	171.3	62	0	0	0	0	110	Q314	S312-Q314 PolarHBondContact O-N 3.21Å
313	G	85.3	Confident	93.2	Very high	58 Å²	58	45.1 Å²	45.1	60%	0.598	24%	0.243	S	C	*	.	S	Bend	trans	72.1	-23.6	-178.9	0	0	0	0	0	116.1	N252	N252-G313 PolarHBondContact O-N 2.8Å
314	Q	88.4	Confident	93.4	Very high	88 Å²	88	50.3 Å²	50.3	41%	0.411	26%	0.263	S	S	.	.	S	Bend	trans	-71	141.8	177	-64.5	-63.4	-32.7	0	0	112.2	F311 S312 N316 S334	F311-Q314 HydrophobicContact CD2-CB 3.78Å; F311-Q314 HydrophobicContact CD2-CG 4.26Å; F311-Q314 HydrophobicContact CE2-CB 4.12Å; S312-Q314 PolarHBondContact O-N 3.21Å; Q314-N316 PolarHBondContact O-N 2.81Å; Q314-N316 PolarHBondContact O-ND2 2.92Å; Q314-S334 PolarHBondContact OE1-OG 3.16Å
315	R	92.8	Very high	93.2	Very high	148 Å²	148	57.7 Å²	57.7	56%	0.558	30%	0.296	S	S	*	.			trans	-64	131.2	173.8	-175.2	-172.1	-174.8	-165.5	4.3	108.6	F20 S333 S334	F20-R315 HydrophobicContact CZ-CB 4.49Å; F20-R315 HydrophobicContact CZ-CG 4.17Å; R315-S333 WeakPolarHBondContact O-CA 3.12Å; R315-S334 PolarHBondContact N-OG 2.95Å; R315-S334 VanDerWaalsContact N-OG 3.16Å; R315-S334 PolarHBondContact O-N 2.82Å; R315-S334 PolarHBondContact O-OG 3.16Å
316	N	96.1	Very high	93.1	Very high	2 Å²	2	61.9 Å²	61.9	1%	0.011	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	156.2	179.3	62.4	83.4	0	0	0	110.9	S236 S250 S251 F311 Q314 V331 A332	S236-N316 WeakPolarHBondContact CB-O 3.43Å; S250-N316 WeakPolarHBondContact CB-OD1 3.1Å; S250-N316 PolarHBondContact OG-OD1 2.92Å; S251-N316 PolarHBondContact O-ND2 2.82Å; F311-N316 HydrophobicContact CE2-CB 4.17Å; F311-N316 HydrophobicContact CZ-CB 4.3Å; Q314-N316 PolarHBondContact O-N 2.81Å; Q314-N316 PolarHBondContact O-ND2 2.92Å; N316-V331 HydrophobicContact CB-CG1 4.14Å; N316-A332 CarbonylContact C-O 3.59Å; N316-A332 WeakPolarHBondContact CA-O 3.43Å; N316-A332 WeakPolarHBondContact CB-O 3.15Å
317	I	97.3	Very high	93.1	Very high	23 Å²	23	60.9 Å²	60.9	12%	0.118	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	145.5	168.9	65.6	176.8	0	0	0	109.4	F20 F22 V331 A332	F20-I317 HydrophobicContact CD2-CD1 3.82Å; F20-I317 HydrophobicContact CD2-CG1 3.77Å; F20-I317 HydrophobicContact CE2-CD1 4.4Å; F20-I317 HydrophobicContact CE2-CG1 3.93Å; F20-I317 HydrophobicContact CE2-CG2 4.22Å; F22-I317 HydrophobicContact CD2-CD1 3.74Å; F22-I317 HydrophobicContact CD2-CG1 3.93Å; F22-I317 HydrophobicContact CE2-CD1 4.06Å; F22-I317 HydrophobicContact CE2-CG1 3.78Å; F22-I317 HydrophobicContact CG-CD1 4.45Å; I317-V331 CarbonylContact O-C 3.6Å; I317-V331 WeakPolarHBondContact O-CA 3.39Å; I317-A332 HydrophobicContact CG1-CB 4.11Å; I317-A332 PolarHBondContact N-O 3.27Å; I317-A332 PolarHBondContact O-N 3.18Å
318	C	97.6	Very high	93.1	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	154.3	178.6	57	0	0	0	0	111.6	V239 C248 V256 L329 L330 V331	V239-C318 VanDerWaalsContact CG2-O 3.22Å; V239-C318 WeakPolarHBondContact CG2-O 3.27Å; C248-C318 PolarHBondContact SG-SG 2.85Å; V256-C318 HydrophobicContact CG1-CB 4.2Å; C318-L329 HydrophobicContact CB-CD1 4.02Å; C318-L330 CarbonylContact C-O 3.06Å; C318-L330 VanDerWaalsContact CA-O 3.27Å; C318-L330 WeakPolarHBondContact CA-O 3.39Å; C318-V331 HydrophobicContact CB-CG2 4.47Å
319	T	97.9	Very high	93.3	Very high	1 Å²	1	54.8 Å²	54.8	1%	0.006	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	157	160.1	-171.4	0	0	0	0	112.2	F22 C26 L330	F22-T319 HydrophobicContact CB-CG2 4.42Å; F22-T319 HydrophobicContact CD1-CG2 3.82Å; F22-T319 HydrophobicContact CD2-CG2 3.56Å; F22-T319 HydrophobicContact CE1-CG2 3.88Å; F22-T319 HydrophobicContact CE2-CG2 3.61Å; F22-T319 HydrophobicContact CG-CG2 3.67Å; F22-T319 HydrophobicContact CZ-CG2 3.78Å; C26-T319 HydrophobicContact CB-CG2 4.06Å; C26-T319 WeakPolarHBondContact CB-OG1 3Å; C26-T319 PolarHBondContact SG-OG1 2.93Å; T319-L330 HydrophobicContact CG2-CB 3.88Å; T319-L330 PolarHBondContact N-O 3.01Å; T319-L330 PolarHBondContact O-N 3.22Å
320	L	97.3	Very high	93.5	Very high	9 Å²	9	54.6 Å²	54.6	5%	0.047	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	113	171.1	-65	177.3	0	0	0	109	F246 C248 I258 R328 L329 L343	F246-L320 HydrophobicContact CB-CD1 3.59Å; F246-L320 HydrophobicContact CG-CD1 4.48Å; C248-L320 HydrophobicContact CB-CD1 3.89Å; C248-L320 HydrophobicContact CB-CD2 4.41Å; C248-L320 HydrophobicContact CB-CG 3.85Å; I258-L320 HydrophobicContact CD1-CD2 3.99Å; I258-L320 HydrophobicContact CG1-CD2 4.45Å; I258-L320 HydrophobicContact CG2-CD1 4.3Å; L320-R328 WeakPolarHBondContact CA-O 3.44Å; L320-L329 HydrophobicContact CD2-CB 4.04Å; L320-L329 HydrophobicContact CD2-CD1 3.96Å; L320-L343 HydrophobicContact CD2-CD2 4.09Å
321	S	95.4	Very high	93.9	Very high	14 Å²	14	48.3 Å²	48.3	10%	0.098	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	151.9	-178	-167.7	0	0	0	0	111.1	C26 R328	C26-S321 WeakPolarHBondContact O-CB 3.46Å; C26-S321 PolarHBondContact O-OG 2.93Å; S321-R328 PolarHBondContact N-O 2.89Å; S321-R328 PolarHBondContact O-N 3.23Å
322	T	94.4	Very high	94.3	Very high	99 Å²	99	47 Å²	47	61%	0.607	25%	0.248	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-101.4	96.8	-177.3	-57.6	0	0	0	0	110.1	L326	T322-L326 CarbonylContact C-O 3.49Å; T322-L326 WeakPolarHBondContact CA-O 3.28Å
323	I	94	Very high	94.8	Very high	5 Å²	5	43.2 Å²	43.2	3%	0.026	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	131.7	179.6	-52.2	178.8	0	0	0	108.4	L42 V45 K325 L326 R328 L330	L42-I323 VanDerWaalsContact O-CD1 3.29Å; L42-I323 WeakPolarHBondContact O-CD1 3.04Å; V45-I323 HydrophobicContact CG2-CB 4.33Å; V45-I323 HydrophobicContact CG2-CG2 3.79Å; I323-K325 PolarHBondContact O-N 3.28Å; I323-L326 PolarHBondContact N-O 2.86Å; I323-L326 PolarHBondContact O-N 3.37Å; I323-R328 HydrophobicContact CB-CG 3.95Å; I323-R328 HydrophobicContact CD1-CB 4.4Å; I323-R328 HydrophobicContact CD1-CG 4.23Å; I323-R328 HydrophobicContact CG1-CB 4.49Å; I323-R328 HydrophobicContact CG1-CG 4.14Å; I323-L330 HydrophobicContact CD1-CD1 4.02Å; I323-L330 HydrophobicContact CD1-CD2 4.33Å
324	Q	90.1	Very high	95.2	Very high	130 Å²	130	41.9 Å²	41.9	61%	0.607	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.1	38.4	-179.2	-64.7	166.5	-17.3	0	0	113.6	L326	Q324-L326 PolarHBondContact O-N 3.33Å
325	K	90.2	Very high	95.3	Very high	198 Å²	198	40.4 Å²	40.4	86%	0.861	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.3	4.7	-175.4	-51.7	-178.9	-179.7	179.1	0	116.1	I323	I323-K325 PolarHBondContact O-N 3.28Å
326	L	93.4	Very high	95.3	Very high	88 Å²	88	33.4 Å²	33.4	46%	0.461	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	142.3	177.9	-62.2	174.7	0	0	0	110.5	T322 I323 Q324	T322-L326 CarbonylContact C-O 3.49Å; T322-L326 WeakPolarHBondContact CA-O 3.28Å; I323-L326 PolarHBondContact N-O 2.86Å; I323-L326 PolarHBondContact O-N 3.37Å; Q324-L326 PolarHBondContact O-N 3.33Å
327	P	94.9	Very high	95.3	Very high	27 Å²	27	36.4 Å²	36.4	18%	0.175	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	140.1	175.6	29	-33	0	0	0	110.6	L343 P345	P327-L343 HydrophobicContact CB-CB 4.4Å; P327-L343 HydrophobicContact CB-CD2 4.31Å; P327-L343 HydrophobicContact CG-CB 4.41Å; P327-L343 PolarHBondContact O-N 3.17Å; P327-P345 HydrophobicContact CG-CB 4.12Å; P327-P345 HydrophobicContact CG-CG 4Å
328	R	97.1	Very high	95.3	Very high	17 Å²	17	35.3 Å²	35.3	6%	0.064	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	135.1	179.5	-62.5	-68.5	172.7	-112.7	18.9	109.4	L320 S321 I323 L330 I340 Y341 N342	L320-R328 WeakPolarHBondContact CA-O 3.44Å; S321-R328 PolarHBondContact N-O 2.89Å; S321-R328 PolarHBondContact O-N 3.23Å; I323-R328 HydrophobicContact CB-CG 3.95Å; I323-R328 HydrophobicContact CD1-CB 4.4Å; I323-R328 HydrophobicContact CD1-CG 4.23Å; I323-R328 HydrophobicContact CG1-CB 4.49Å; I323-R328 HydrophobicContact CG1-CG 4.14Å; R328-L330 HydrophobicContact CB-CD1 3.51Å; R328-I340 HydrophobicContact CB-CG2 4.27Å; R328-I340 HydrophobicContact CG-CG2 4.39Å; R328-Y341 WeakPolarHBondContact CA-O 3.38Å; R328-Y341 WeakPolarHBondContact CD-O 3.39Å; R328-N342 PolarHBondContact NH1-OD1 2.88Å; R328-N342 PolarHBondContact NH2-OD1 2.88Å
329	L	98.1	Very high	95.3	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	122.1	162.9	170.9	72.3	0	0	0	108	C248 V256 I258 A307 C318 L320 V331 Y341	C248-L329 WeakPolarHBondContact SG-CD1 3.21Å; V256-L329 HydrophobicContact CB-CD2 4.11Å; V256-L329 HydrophobicContact CG1-CD1 4.13Å; V256-L329 HydrophobicContact CG1-CD2 4Å; I258-L329 HydrophobicContact CD1-CB 4.44Å; I258-L329 HydrophobicContact CD1-CD2 4.34Å; A307-L329 HydrophobicContact CB-CD2 3.29Å; C318-L329 HydrophobicContact CB-CD1 4.02Å; L320-L329 HydrophobicContact CD2-CB 4.04Å; L320-L329 HydrophobicContact CD2-CD1 3.96Å; L329-V331 HydrophobicContact CD1-CG2 4.25Å; L329-V331 HydrophobicContact CD2-CG2 4.09Å; L329-V331 HydrophobicContact CG-CG2 3.95Å; L329-Y341 HydrophobicContact CD2-CD2 4.3Å; L329-Y341 PolarHBondContact N-O 3.39Å; L329-Y341 VanDerWaalsContact N-O 3.1Å; L329-Y341 PolarHBondContact O-N 2.93Å
330	L	98.4	Very high	95.3	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	133.5	173.8	-79.2	70.1	0	0	0	108.4	F22 L42 C318 T319 I323 R328 L338 Y339 I340	F22-L330 HydrophobicContact CE1-CB 4.34Å; F22-L330 HydrophobicContact CE1-CD2 4.4Å; F22-L330 HydrophobicContact CZ-CB 3.96Å; L42-L330 HydrophobicContact CB-CD2 4.17Å; L42-L330 HydrophobicContact CD1-CD2 3.81Å; L42-L330 HydrophobicContact CD2-CD2 4Å; L42-L330 HydrophobicContact CG-CD2 4.21Å; C318-L330 CarbonylContact C-O 3.06Å; C318-L330 VanDerWaalsContact CA-O 3.27Å; C318-L330 WeakPolarHBondContact CA-O 3.39Å; T319-L330 HydrophobicContact CG2-CB 3.88Å; T319-L330 PolarHBondContact N-O 3.01Å; T319-L330 PolarHBondContact O-N 3.22Å; I323-L330 HydrophobicContact CD1-CD1 4.02Å; I323-L330 HydrophobicContact CD1-CD2 4.33Å; R328-L330 HydrophobicContact CB-CD1 3.51Å; L330-L338 HydrophobicContact CB-CD1 4.13Å; L330-L338 HydrophobicContact CG-CD1 4.47Å; L330-Y339 CarbonylContact C-O 3.55Å; L330-Y339 WeakPolarHBondContact CA-O 3.24Å; L330-I340 HydrophobicContact CD1-CG2 4.23Å; L330-I340 HydrophobicContact CG-CG1 4.35Å; L330-I340 HydrophobicContact CG-CG2 4.46Å
331	V	98.2	Very high	95.4	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	113.9	177.9	-172.8	0	0	0	0	109.6	V256 L309 N316 I317 C318 L329 L338 Y339 Y341	V256-V331 HydrophobicContact CG2-CG2 4.11Å; L309-V331 HydrophobicContact CD2-CB 4.34Å; L309-V331 HydrophobicContact CD2-CG1 4.03Å; L309-V331 HydrophobicContact CD2-CG2 4.2Å; N316-V331 HydrophobicContact CB-CG1 4.14Å; I317-V331 CarbonylContact O-C 3.6Å; I317-V331 WeakPolarHBondContact O-CA 3.39Å; C318-V331 HydrophobicContact CB-CG2 4.47Å; L329-V331 HydrophobicContact CD1-CG2 4.25Å; L329-V331 HydrophobicContact CD2-CG2 4.09Å; L329-V331 HydrophobicContact CG-CG2 3.95Å; V331-L338 WeakPolarHBondContact O-CA 3.48Å; V331-Y339 PolarHBondContact N-O 3.4Å; V331-Y339 PolarHBondContact O-N 2.94Å; V331-Y341 HydrophobicContact CG2-CE2 4.27Å
332	A	97.5	Very high	95.4	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	139.5	172.1	0	0	0	0	0	109.8	F20 F22 L29 N316 I317 L338	F20-A332 HydrophobicContact CD2-CB 3.88Å; F20-A332 HydrophobicContact CE2-CB 4.34Å; F20-A332 WeakPolarHBondContact CE2-O 2.95Å; F22-A332 HydrophobicContact CE2-CB 4.4Å; F22-A332 HydrophobicContact CZ-CB 4.05Å; L29-A332 HydrophobicContact CD1-CB 4.16Å; L29-A332 HydrophobicContact CD2-CB 4.3Å; N316-A332 CarbonylContact C-O 3.59Å; N316-A332 WeakPolarHBondContact CA-O 3.43Å; N316-A332 WeakPolarHBondContact CB-O 3.15Å; I317-A332 HydrophobicContact CG1-CB 4.11Å; I317-A332 PolarHBondContact N-O 3.27Å; I317-A332 PolarHBondContact O-N 3.18Å; A332-L338 HydrophobicContact CB-CD1 4.4Å
333	S	95.7	Very high	95.5	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	149.3	-172.1	-178.4	0	0	0	0	112.6	L17 F311 R315 N335 G336 H337	L17-S333 WeakPolarHBondContact CD1-O 3.3Å; F311-S333 WeakPolarHBondContact CE2-OG 3.43Å; F311-S333 WeakPolarHBondContact CZ-OG 3.42Å; R315-S333 WeakPolarHBondContact O-CA 3.12Å; S333-N335 VanDerWaalsContact CB-OD1 3.24Å; S333-N335 WeakPolarHBondContact CB-OD1 3.49Å; S333-N335 PolarHBondContact O-N 3.34Å; S333-N335 PolarHBondContact OG-OD1 3.01Å; S333-G336 PolarHBondContact O-N 2.9Å; S333-G336 VanDerWaalsContact O-N 3.08Å; S333-H337 PolarHBondContact N-O 3.5Å
334	S	94.1	Very high	95.5	Very high	30 Å²	30	36.2 Å²	36.2	21%	0.21	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-16.8	179.8	48.7	0	0	0	0	114.2	Q314 R315 G336	Q314-S334 PolarHBondContact OE1-OG 3.16Å; R315-S334 PolarHBondContact N-OG 2.95Å; R315-S334 VanDerWaalsContact N-OG 3.16Å; R315-S334 PolarHBondContact O-N 2.82Å; R315-S334 PolarHBondContact O-OG 3.16Å; S334-G336 PolarHBondContact O-N 2.97Å
335	N	91.1	Very high	95.6	Very high	58 Å²	58	32.2 Å²	32.2	31%	0.31	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	9.7	172.4	74.5	-9.7	0	0	0	114.1	S333 H337 Y339	S333-N335 VanDerWaalsContact CB-OD1 3.24Å; S333-N335 WeakPolarHBondContact CB-OD1 3.49Å; S333-N335 PolarHBondContact O-N 3.34Å; S333-N335 PolarHBondContact OG-OD1 3.01Å; N335-H337 PolarHBondContact O-CE1 2.87Å; N335-H337 PolarHBondContact O-ND1 2.92Å; N335-H337 WeakPolarHBondContact OD1-CB 3.12Å; N335-H337 PolarHBondContact OD1-N 3.39Å; N335-Y339 PolarHBondContact ND2-OH 3.26Å
336	G	93.6	Very high	95.6	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.01	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.5	13.8	177.3	0	0	0	0	0	115.2	S333 S334 L359	S333-G336 PolarHBondContact O-N 2.9Å; S333-G336 VanDerWaalsContact O-N 3.08Å; S334-G336 PolarHBondContact O-N 2.97Å; G336-L359 VanDerWaalsContact O-CB 3.32Å; G336-L359 WeakPolarHBondContact O-CB 3.49Å; G336-L359 PolarHBondContact O-N 2.93Å
337	H	95.6	Very high	95.5	Very high	64 Å²	64	32.2 Å²	32.2	30%	0.296	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	148.2	-175.3	-64.8	77.4	0	0	0	113.7	S333 N335 Y339 T356 H357	S333-H337 PolarHBondContact N-O 3.5Å; N335-H337 PolarHBondContact O-CE1 2.87Å; N335-H337 PolarHBondContact O-ND1 2.92Å; N335-H337 WeakPolarHBondContact OD1-CB 3.12Å; N335-H337 PolarHBondContact OD1-N 3.39Å; H337-Y339 HydrophobicContact CB-CD2 4.36Å; H337-Y339 HydrophobicContact CB-CE2 3.57Å; H337-T356 HydrophobicContact CB-CG2 4.14Å; H337-H357 WeakPolarHBondContact CA-O 3.48Å
338	L	97.4	Very high	95.3	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	121.6	168.3	168.4	67.3	0	0	0	109.3	F22 L29 L42 L48 L330 V331 A332 I340 T356 H357 L359	F22-L338 HydrophobicContact CE1-CD1 4.37Å; F22-L338 HydrophobicContact CZ-CD1 4.1Å; L29-L338 HydrophobicContact CD2-CB 4.46Å; L29-L338 HydrophobicContact CD2-CD1 4.44Å; L29-L338 HydrophobicContact CD2-CD2 4.09Å; L42-L338 HydrophobicContact CD2-CD2 3.81Å; L48-L338 HydrophobicContact CD1-CD2 3.79Å; L48-L338 HydrophobicContact CD2-CD2 4.44Å; L330-L338 HydrophobicContact CB-CD1 4.13Å; L330-L338 HydrophobicContact CG-CD1 4.47Å; V331-L338 WeakPolarHBondContact O-CA 3.48Å; A332-L338 HydrophobicContact CB-CD1 4.4Å; L338-I340 HydrophobicContact CG-CG1 4.39Å; L338-T356 CarbonylContact O-C 3.6Å; L338-T356 WeakPolarHBondContact O-CA 3.25Å; L338-H357 HydrophobicContact CB-CB 4.43Å; L338-H357 PolarHBondContact N-O 3.19Å; L338-H357 PolarHBondContact O-N 2.97Å; L338-L359 HydrophobicContact CB-CD1 4.25Å; L338-L359 HydrophobicContact CB-CD2 3.81Å; L338-L359 HydrophobicContact CB-CG 4.16Å
339	Y	97.6	Very high	95.1	Very high	19 Å²	19	32.4 Å²	32.4	8%	0.075	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	133.8	179.3	-55.9	-93.5	0	0	0	109.5	F311 L330 V331 N335 H337 L353 T356	F311-Y339 HydrophobicContact CD1-CE2 4.08Å; F311-Y339 AromaticContact CE1-CD2 3.91Å; F311-Y339 HydrophobicContact CE1-CD2 3.91Å; F311-Y339 AromaticContact CE1-CE2 3.38Å; F311-Y339 HydrophobicContact CE1-CE2 3.38Å; F311-Y339 AromaticContact CE1-CZ 3.79Å; F311-Y339 HydrophobicContact CZ-CE2 4.22Å; L330-Y339 CarbonylContact C-O 3.55Å; L330-Y339 WeakPolarHBondContact CA-O 3.24Å; V331-Y339 PolarHBondContact N-O 3.4Å; V331-Y339 PolarHBondContact O-N 2.94Å; N335-Y339 PolarHBondContact ND2-OH 3.26Å; H337-Y339 HydrophobicContact CB-CD2 4.36Å; H337-Y339 HydrophobicContact CB-CE2 3.57Å; Y339-L353 HydrophobicContact CD1-CD1 4.27Å; Y339-T356 HydrophobicContact CD1-CG2 3.66Å; Y339-T356 WeakPolarHBondContact CD1-OG1 3.3Å; Y339-T356 HydrophobicContact CE1-CG2 3.53Å; Y339-T356 HydrophobicContact CG-CG2 4.37Å
340	I	97.9	Very high	95	Very high	3 Å²	3	39 Å²	39	2%	0.015	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	119.2	-178.6	-49.2	-177.2	0	0	0	109.1	V45 R328 L330 L338 I354 K355	V45-I340 HydrophobicContact CG1-CD1 4.35Å; V45-I340 HydrophobicContact CG1-CG2 4.24Å; R328-I340 HydrophobicContact CB-CG2 4.27Å; R328-I340 HydrophobicContact CG-CG2 4.39Å; L330-I340 HydrophobicContact CD1-CG2 4.23Å; L330-I340 HydrophobicContact CG-CG1 4.35Å; L330-I340 HydrophobicContact CG-CG2 4.46Å; L338-I340 HydrophobicContact CG-CG1 4.39Å; I340-I354 PolarHBondContact O-N 3.01Å; I340-K355 HydrophobicContact CB-CB 4.4Å; I340-K355 PolarHBondContact N-O 3.03Å; I340-K355 PolarHBondContact O-N 2.98Å
341	Y	98.1	Very high	94.9	Very high	4 Å²	4	39.3 Å²	39.3	2%	0.016	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	148.1	-178	-60.8	-105.2	0	0	0	111.9	A307 R308 L309 R328 L329 V331 C351 V352 L353	A307-Y341 HydrophobicContact CB-CD1 3.98Å; A307-Y341 HydrophobicContact CB-CD2 4.46Å; A307-Y341 HydrophobicContact CB-CE1 4.07Å; A307-Y341 HydrophobicContact CB-CG 4.19Å; R308-Y341 WeakPolarHBondContact O-CE1 3.29Å; R308-Y341 PolarHBondContact O-OH 2.78Å; L309-Y341 HydrophobicContact CD2-CE2 4.31Å; R328-Y341 WeakPolarHBondContact CA-O 3.38Å; R328-Y341 WeakPolarHBondContact CD-O 3.39Å; L329-Y341 HydrophobicContact CD2-CD2 4.3Å; L329-Y341 PolarHBondContact N-O 3.39Å; L329-Y341 VanDerWaalsContact N-O 3.1Å; L329-Y341 PolarHBondContact O-N 2.93Å; V331-Y341 HydrophobicContact CG2-CE2 4.27Å; Y341-C351 HydrophobicContact CD1-CB 4.39Å; Y341-C351 WeakPolarHBondContact CD1-O 3.42Å; Y341-V352 CarbonylContact C-O 3.58Å; Y341-V352 VanDerWaalsContact CA-O 3.23Å; Y341-V352 WeakPolarHBondContact CA-O 3.21Å; Y341-L353 HydrophobicContact CD1-CB 3.86Å; Y341-L353 HydrophobicContact CD1-CD1 4.21Å; Y341-L353 HydrophobicContact CD2-CD1 4.22Å; Y341-L353 HydrophobicContact CE1-CB 3.74Å; Y341-L353 HydrophobicContact CE1-CD1 3.97Å; Y341-L353 HydrophobicContact CE1-CG 4.4Å; Y341-L353 HydrophobicContact CE2-CD1 3.95Å; Y341-L353 HydrophobicContact CG-CD1 4.33Å
342	N	96.9	Very high	94.8	Very high	56 Å²	56	44 Å²	44	30%	0.299	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	127	167.1	-170.6	77.1	0	0	0	109.6	R328 C351 V352 I354	R328-N342 PolarHBondContact NH1-OD1 2.88Å; R328-N342 PolarHBondContact NH2-OD1 2.88Å; N342-C351 VanDerWaalsContact O-CA 3.3Å; N342-C351 WeakPolarHBondContact O-CA 3.46Å; N342-C351 WeakPolarHBondContact O-CB 3.37Å; N342-V352 PolarHBondContact N-O 3.05Å; N342-V352 PolarHBondContact O-N 3.31Å; N342-I354 HydrophobicContact CB-CD1 3.91Å; N342-I354 HydrophobicContact CB-CG1 4.07Å
343	L	95.8	Very high	94.8	Very high	4 Å²	4	47 Å²	47	2%	0.021	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-103.5	135.2	165.4	174	61.3	0	0	0	108.3	I258 F304 A305 L320 P327	I258-L343 HydrophobicContact CD1-CD1 3.92Å; I258-L343 HydrophobicContact CD1-CD2 4.21Å; F304-L343 HydrophobicContact CE1-CD1 4.44Å; A305-L343 HydrophobicContact CB-CD1 3.43Å; A305-L343 VanDerWaalsContact CB-CD1 3.43Å; L320-L343 HydrophobicContact CD2-CD2 4.09Å; P327-L343 HydrophobicContact CB-CB 4.4Å; P327-L343 HydrophobicContact CB-CD2 4.31Å; P327-L343 HydrophobicContact CG-CB 4.41Å; P327-L343 PolarHBondContact O-N 3.17Å
344	D	94.3	Very high	94.8	Very high	61 Å²	61	50.1 Å²	50.1	33%	0.326	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-88.7	122	162.3	-164.1	-69	0	0	0	109.5	F304 Q346 D347 G348	F304-D344 WeakPolarHBondContact CE1-O 3.4Å; D344-Q346 WeakPolarHBondContact OD1-CA 3.35Å; D344-Q346 WeakPolarHBondContact OD1-CB 3.39Å; D344-Q346 PolarHBondContact OD1-N 3.46Å; D344-D347 PolarHBondContact OD1-N 2.96Å; D344-G348 WeakPolarHBondContact O-CA 3.38Å; D344-G348 PolarHBondContact O-N 3.17Å
345	P	91.6	Very high	94.9	Very high	46 Å²	46	51.8 Å²	51.8	30%	0.299	28%	0.278	S	S	.	.	S	Bend	trans	-81.1	-14.3	-179.1	32	-33.8	0	0	0	114.1	F246 P327	F246-P345 HydrophobicContact CE2-CB 4.36Å; F246-P345 HydrophobicContact CZ-CB 4.19Å; P327-P345 HydrophobicContact CG-CB 4.12Å; P327-P345 HydrophobicContact CG-CG 4Å
346	Q	90.4	Very high	95.2	Very high	142 Å²	142	51.9 Å²	51.9	66%	0.664	28%	0.281	S	S	*	.	S	Bend	trans	-92.4	-61.6	179.9	-54.5	-60	-12.7	0	0	110.3	F304 D344	F304-Q346 WeakPolarHBondContact CE2-O 3.27Å; F304-Q346 WeakPolarHBondContact CZ-O 3.36Å; D344-Q346 WeakPolarHBondContact OD1-CA 3.35Å; D344-Q346 WeakPolarHBondContact OD1-CB 3.39Å; D344-Q346 PolarHBondContact OD1-N 3.46Å
347	D	90.3	Very high	95.3	Very high	145 Å²	145	53 Å²	53	78%	0.775	29%	0.285	S	S	*	.	S	Bend	trans	-96.9	-21.3	-169.3	-66.5	-27.3	0	0	0	113.3	D344 G349	D344-D347 PolarHBondContact OD1-N 2.96Å; D347-G349 PolarHBondContact O-N 3.03Å
348	G	92.4	Very high	95.3	Very high	12 Å²	12	52.9 Å²	52.9	12%	0.124	29%	0.292	C	S	.	.			trans	72.2	-121.4	176	0	0	0	0	0	113.5	F304 D344	F304-G348 VanDerWaalsContact CZ-N 3.3Å; F304-G348 WeakPolarHBondContact O-CA 3.36Å; D344-G348 WeakPolarHBondContact O-CA 3.38Å; D344-G348 PolarHBondContact O-N 3.17Å
349	G	93.2	Very high	95.1	Very high	36 Å²	36	53 Å²	53	37%	0.371	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	77.9	-150.6	174.2	0	0	0	0	0	115.3	F304 A305 T306 D347	F304-G349 PolarHBondContact O-N 2.58Å; A305-G349 CarbonylContact C-O 3.4Å; A305-G349 WeakPolarHBondContact CA-O 3.24Å; A305-G349 WeakPolarHBondContact CB-O 3.47Å; T306-G349 PolarHBondContact N-O 3.24Å; D347-G349 PolarHBondContact O-N 3.03Å
350	E	95.1	Very high	94.7	Very high	137 Å²	137	54.2 Å²	54.2	64%	0.64	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	120.3	-179.9	-171.6	164.4	-156.6	0	0	111.2	T306 V352	T306-E350 CarbonylContact O-C 3.49Å; T306-E350 WeakPolarHBondContact O-CA 3.26Å; E350-V352 PolarHBondContact O-N 3.2Å
351	C	96.5	Very high	93.4	Very high	7 Å²	7	56.5 Å²	56.5	5%	0.047	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	122	-179.4	-58.4	0	0	0	0	110.2	T306 A307 Y341 N342	T306-C351 PolarHBondContact O-N 3.09Å; A307-C351 HydrophobicContact CB-CB 3.74Å; Y341-C351 HydrophobicContact CD1-CB 4.39Å; Y341-C351 WeakPolarHBondContact CD1-O 3.42Å; N342-C351 VanDerWaalsContact O-CA 3.3Å; N342-C351 WeakPolarHBondContact O-CA 3.46Å; N342-C351 WeakPolarHBondContact O-CB 3.37Å
352	V	95.3	Very high	90.6	Very high	99 Å²	99	61.2 Å²	61.2	60%	0.6	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.7	128.7	-177.3	-179.1	0	0	0	0	110.6	Y341 N342 E350 I354	Y341-V352 CarbonylContact C-O 3.58Å; Y341-V352 VanDerWaalsContact CA-O 3.23Å; Y341-V352 WeakPolarHBondContact CA-O 3.21Å; N342-V352 PolarHBondContact N-O 3.05Å; N342-V352 PolarHBondContact O-N 3.31Å; E350-V352 PolarHBondContact O-N 3.2Å; V352-I354 PolarHBondContact O-N 2.79Å
353	L	97.4	Very high	87.8	Confident	63 Å²	63	61.5 Å²	61.5	33%	0.33	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	123.9	173.6	-179.4	66	0	0	0	110.1	Y339 Y341	Y339-L353 HydrophobicContact CD1-CD1 4.27Å; Y341-L353 HydrophobicContact CD1-CB 3.86Å; Y341-L353 HydrophobicContact CD1-CD1 4.21Å; Y341-L353 HydrophobicContact CD2-CD1 4.22Å; Y341-L353 HydrophobicContact CE1-CB 3.74Å; Y341-L353 HydrophobicContact CE1-CD1 3.97Å; Y341-L353 HydrophobicContact CE1-CG 4.4Å; Y341-L353 HydrophobicContact CE2-CD1 3.95Å; Y341-L353 HydrophobicContact CG-CD1 4.33Å
354	I	96.1	Very high	84.5	Confident	66 Å²	66	67 Å²	67	34%	0.338	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	-47.4	178	-48.6	165.3	0	0	0	110.5	V45 I340 N342 V352	V45-I354 HydrophobicContact CG1-CB 4.31Å; V45-I354 HydrophobicContact CG1-CG2 3.83Å; I340-I354 PolarHBondContact O-N 3.01Å; N342-I354 HydrophobicContact CB-CD1 3.91Å; N342-I354 HydrophobicContact CB-CG1 4.07Å; V352-I354 PolarHBondContact O-N 2.79Å
355	K	96.4	Very high	81.5	Confident	65 Å²	65	71.1 Å²	71.1	28%	0.283	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	148	-169.8	-159.8	81.2	173.2	-168.2	0	111.3	V45 E46 I340	V45-K355 HydrophobicContact CG1-CB 3.95Å; V45-K355 WeakPolarHBondContact O-CG 3.18Å; E46-K355 IonicContact OE2-NZ 2.68Å; E46-K355 PolarHBondContact OE2-NZ 3.31Å; I340-K355 HydrophobicContact CB-CB 4.4Å; I340-K355 PolarHBondContact N-O 3.03Å; I340-K355 PolarHBondContact O-N 2.98Å
356	T	96.8	Very high	78.5	Confident	59 Å²	59	76.6 Å²	76.6	36%	0.362	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	132.3	165.7	-52.7	0	0	0	0	108.5	H337 L338 Y339	H337-T356 HydrophobicContact CB-CG2 4.14Å; L338-T356 CarbonylContact O-C 3.6Å; L338-T356 WeakPolarHBondContact O-CA 3.25Å; Y339-T356 HydrophobicContact CD1-CG2 3.66Å; Y339-T356 WeakPolarHBondContact CD1-OG1 3.3Å; Y339-T356 HydrophobicContact CE1-CG2 3.53Å; Y339-T356 HydrophobicContact CG-CG2 4.37Å
357	H	96.5	Very high	75.6	Confident	24 Å²	24	76.6 Å²	76.6	11%	0.111	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	143.6	174.9	-70.9	-75.3	0	0	0	110.8	V45 E46 L48 H337 L338	V45-H357 PolarHBondContact O-NE2 3.13Å; E46-H357 PolarHBondContact O-CE1 2.93Å; L48-H357 HydrophobicContact CB-CB 4.46Å; L48-H357 HydrophobicContact CD2-CB 3.93Å; H337-H357 WeakPolarHBondContact CA-O 3.48Å; L338-H357 HydrophobicContact CB-CB 4.43Å; L338-H357 PolarHBondContact N-O 3.19Å; L338-H357 PolarHBondContact O-N 2.97Å
358	S	95	Very high	72.7	Confident	63 Å²	63	77.4 Å²	77.4	44%	0.441	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	124.8	167.8	-179.9	0	0	0	0	109.9	G361	S358-G361 PolarHBondContact OG-N 3.42Å
359	L	93.9	Very high	69.8	Low	1 Å²	1	84.8 Å²	84.8	1%	0.005	49%	0.49	C	S	.	.	S	Bend	trans	-86	-24.8	-178.2	-59.9	175.8	0	0	0	112.5	L17 L29 I31 F40 L48 G336 L338	L17-L359 HydrophobicContact CD1-CD1 4.17Å; L29-L359 HydrophobicContact CD2-CD1 3.99Å; L29-L359 HydrophobicContact CD2-CD2 3.61Å; L29-L359 HydrophobicContact CD2-CG 4.47Å; I31-L359 HydrophobicContact CD1-CB 4.23Å; I31-L359 WeakPolarHBondContact CD1-O 3.48Å; I31-L359 HydrophobicContact CG2-CD1 4.36Å; F40-L359 HydrophobicContact CD2-CD2 4.43Å; F40-L359 HydrophobicContact CE2-CD2 4.31Å; F40-L359 WeakPolarHBondContact CZ-O 3.42Å; L48-L359 HydrophobicContact CD2-CD2 3.56Å; G336-L359 VanDerWaalsContact O-CB 3.32Å; G336-L359 WeakPolarHBondContact O-CB 3.49Å; G336-L359 PolarHBondContact O-N 2.93Å; L338-L359 HydrophobicContact CB-CD1 4.25Å; L338-L359 HydrophobicContact CB-CD2 3.81Å; L338-L359 HydrophobicContact CB-CG 4.16Å
360	L	88.7	Confident	67	Low	46 Å²	46	91.5 Å²	91.5	24%	0.241	51%	0.512	C	S	.	.	S	Bend	trans	-83.7	-42.3	-176.4	-60.7	-179.4	0	0	0	110.9	S15 L17 T33 K38	S15-L360 VanDerWaalsContact O-CD1 3.27Å; S15-L360 WeakPolarHBondContact O-CD1 3.5Å; S15-L360 WeakPolarHBondContact O-CD2 3.25Å; L17-L360 HydrophobicContact CD2-CD2 3.54Å; L17-L360 HydrophobicContact CG-CD2 3.9Å; T33-L360 HydrophobicContact CG2-CD2 4.15Å; K38-L360 PolarHBondContact NZ-O 2.85Å
361	G	70.3	Confident	63.9	Low	50 Å²	50	91.9 Å²	91.9	52%	0.515	52%	0.518	S	S	.	.			trans	79.3	107.9	-179	0	0	0	0	0	112	S358	S358-G361 PolarHBondContact OG-N 3.42Å
362	S	40.4	Very low	60.7	Low	103 Å²	103	98.4 Å²	98.4	72%	0.72	55%	0.553	S	S	*	*			trans	-66.3	153.9	150.9	55.1	0	0	0	0	108.8
363	G	37	Very low	57.9	Low	63 Å²	63	101.4 Å²	101.4	65%	0.649	57%	0.565	S	S	*	*	S	Bend	trans	-61.3	157.9	154.7	0	0	0	0	0	109.8
364	T	27.7	Very low	54.7	Low	119 Å²	119	108.6 Å²	108.6	73%	0.73	59%	0.587	S	S	*	*	S	Bend	trans	55.6	121.5	177.5	42.9	0	0	0	0	117	E366	T364-E366 PolarHBondContact O-N 3.06Å
365	T	29.8	Very low	51.5	Low	147 Å²	147	111.8 Å²	111.8	90%	0.902	61%	0.612	S	S	*	*			trans	-68.5	94.5	155.8	-40	0	0	0	0	108.1	E367	T365-E367 PolarHBondContact O-N 2.8Å
366	E	28.5	Very low	48.3	Very low	161 Å²	161	114.1 Å²	114.1	75%	0.752	64%	0.637	S	S	*	*			trans	-70.5	129	165.7	-67.7	-155.3	142	0	0	109.2	T364 N368	T364-E366 PolarHBondContact O-N 3.06Å; E366-N368 PolarHBondContact O-N 2.99Å
367	E	30.1	Very low	45	Very low	142 Å²	142	119.4 Å²	119.4	66%	0.664	66%	0.662	S	S	*	*			trans	-68	114	171.4	-64.3	-178.4	149.6	0	0	108.5	T365 K369	T365-E367 PolarHBondContact O-N 2.8Å; E367-K369 PolarHBondContact O-N 2.93Å; E367-K369 WeakPolarHBondContact OE2-CE 3.42Å; E367-K369 IonicContact OE2-NZ 2.77Å; E367-K369 PolarHBondContact OE2-NZ 2.99Å
368	N	29.6	Very low	41.8	Very low	163 Å²	163	123.8 Å²	123.8	87%	0.872	69%	0.693	S	S	*	*			trans	-64.1	83.7	168.5	-86.4	-6.9	0	0	0	110.2	E366 E370	E366-N368 PolarHBondContact O-N 2.99Å; N368-E370 PolarHBondContact O-N 2.9Å
369	K	32.3	Very low	38.9	Very low	166 Å²	166	130.1 Å²	130.1	72%	0.722	72%	0.716	S	S	*	*			trans	-77.2	78.2	164	-75.4	174.4	-179	145	0	108	E367	E367-K369 PolarHBondContact O-N 2.93Å; E367-K369 WeakPolarHBondContact OE2-CE 3.42Å; E367-K369 IonicContact OE2-NZ 2.77Å; E367-K369 PolarHBondContact OE2-NZ 2.99Å
370	E	33.7	Very low	35.8	Very low	178 Å²	178	134.9 Å²	134.9	83%	0.832	75%	0.749	S	S	*	*			trans	-62.9	151.4	178.7	-165.9	162.6	-149.6	0	0	111.3	N368 D372	N368-E370 PolarHBondContact O-N 2.9Å; E370-D372 PolarHBondContact O-N 2.91Å; E370-D372 VanDerWaalsContact O-N 3.08Å
371	N	30.7	Very low	33.1	Very low	144 Å²	144	142.6 Å²	142.6	77%	0.77	78%	0.776	S	S	*	*			trans	-75.1	100	-165	-70.3	-78.1	0	0	0	112.9	L373	N371-L373 VanDerWaalsContact C-N 3.31Å; N371-L373 PolarHBondContact O-N 3.2Å
372	D	29	Very low	31.1	Very low	144 Å²	144	145.2 Å²	145.2	77%	0.77	79%	0.793	S	S	*	*			trans	-77	77.9	174.4	-148.4	-10.5	0	0	0	111.4	E370 R374	E370-D372 PolarHBondContact O-N 2.91Å; E370-D372 VanDerWaalsContact O-N 3.08Å; D372-R374 PolarHBondContact O-N 2.91Å
373	L	35.3	Very low	30.6	Very low	162 Å²	162	144.8 Å²	144.8	85%	0.848	80%	0.796	S	S	*	*			trans	-73.9	83	178.2	-82.8	171.4	0	0	0	111.7	N371	N371-L373 VanDerWaalsContact C-N 3.31Å; N371-L373 PolarHBondContact O-N 3.2Å
374	R	31.4	Very low	30.3	Very low	214 Å²	214	148.5 Å²	148.5	81%	0.808	81%	0.806	S	S	*	*			trans	-131.3	135.1	164.8	-68.9	-173.1	173.9	-171	-0.2	111.8	D372	D372-R374 PolarHBondContact O-N 2.91Å
375	P	28.9	Very low	30.3	Very low	133 Å²	133	149.2 Å²	149.2	86%	0.864	81%	0.81	S	S	*	*			trans	-72.6	146.7	-179.4	29.8	-34.6	0	0	0	112.2
376	S	28.4	Very low	30.2	Very low	114 Å²	114	146.9 Å²	146.9	80%	0.797	81%	0.805	S	S	*	*			trans	-84.6	138.3	-175.2	55.1	0	0	0	0	114.1
377	L	27.3	Very low	30.2	Very low	170 Å²	170	150.2 Å²	150.2	89%	0.89	81%	0.811	S	S	*	*			trans	-141	163.7	159	-88.1	178.5	0	0	0	109.3
378	P	30.1	Very low	30.7	Very low	117 Å²	117	148.8 Å²	148.8	76%	0.76	81%	0.814	S	S	*	*			trans	-96.7	175.9	-131.8	36.4	-40.1	0	0	0	117.4
379	Q	33.6	Very low	30.7	Very low	196 Å²	196	147.1 Å²	147.1	92%	0.916	82%	0.815	S	S	*	*			trans	-50.9	145.9	-179.6	-61.7	165.7	-39.4	0	0	114.6
380	S	29.7	Very low	30.5	Very low	101 Å²	101	143.8 Å²	143.8	71%	0.706	82%	0.818	S	S	*	*			trans	-139.2	160.4	153.7	-165.5	0	0	0	0	110.5
381	Y	30.4	Very low	30.4	Very low	208 Å²	208	140.9 Å²	140.9	82%	0.816	82%	0.818	S	S	*	*			trans	-96	145	-166.5	48.2	-87.9	0	0	0	112.3
382	A	29.1	Very low	30.4	Very low	105 Å²	105	139.6 Å²	139.6	87%	0.868	82%	0.82	S	S	*	*			trans	179.3	140.5	138.7	0	0	0	0	0	109.5
383	A	29.9	Very low	30.5	Very low	94 Å²	94	137.5 Å²	137.5	78%	0.777	82%	0.823	S	S	*	*			trans	-117.8	160	168	0	0	0	0	0	109.4
384	T	30.3	Very low	30.2	Very low	140 Å²	140	135.4 Å²	135.4	86%	0.859	82%	0.822	S	S	*	*			trans	-165.5	131.4	131.8	-77.7	0	0	0	0	112.3
385	V	29.2	Very low	30.2	Very low	135 Å²	135	131 Å²	131	82%	0.818	82%	0.819	S	S	*	*			trans	-35.1	137.6	167.9	-179	0	0	0	0	117
386	A	27.2	Very low	30.4	Very low	97 Å²	97	131.4 Å²	131.4	80%	0.802	82%	0.818	S	S	*	*			trans	-158.1	124.7	141.5	0	0	0	0	0	113.3
387	R	27.3	Very low	31.2	Very low	231 Å²	231	131.9 Å²	131.9	87%	0.872	82%	0.819	S	S	*	*			trans	-156.8	162.1	163.4	-82.5	-172.1	68.9	164.2	0.8	107.3
388	P	41.7	Very low	31.2	Very low	113 Å²	113	126.8 Å²	126.8	73%	0.734	81%	0.807	S	S	*	*			cis	-124.1	-171.2	-47.9	39.2	-24.8	0	0	0	110
389	S	28.8	Very low	31.3	Very low	127 Å²	127	132.3 Å²	132.3	89%	0.888	81%	0.814	S	S	*	*			trans	-144.3	162.9	157.3	59.4	0	0	0	0	110.7
390	A	29.2	Very low	31.1	Very low	96 Å²	96	127.4 Å²	127.4	79%	0.793	80%	0.802	S	S	*	*			trans	-149.3	157.6	-166.9	0	0	0	0	0	112.5
391	S	30.7	Very low	31.2	Very low	117 Å²	117	130.9 Å²	130.9	82%	0.818	81%	0.807	S	S	*	*			trans	158.7	154.7	162.2	40.9	0	0	0	0	108.6
392	S	31.3	Very low	31.4	Very low	118 Å²	118	128.5 Å²	128.5	83%	0.825	81%	0.808	S	S	*	*			cis	-160.1	162.1	-22.5	47.5	0	0	0	0	108.7
393	A	30.9	Very low	31.4	Very low	99 Å²	99	126.6 Å²	126.6	82%	0.818	80%	0.799	S	S	*	*			trans	-105.6	158.2	174.3	0	0	0	0	0	111.5
394	S	29.2	Very low	31.3	Very low	119 Å²	119	125.8 Å²	125.8	83%	0.832	80%	0.8	S	S	*	*			trans	-152.9	159.8	167.7	61.2	0	0	0	0	110.9
395	T	30.6	Very low	31.2	Very low	121 Å²	121	123.6 Å²	123.6	74%	0.742	80%	0.796	S	S	*	*			trans	-154	124.2	-156.1	47.6	0	0	0	0	114.8
396	V	33.2	Very low	31.2	Very low	141 Å²	141	125.1 Å²	125.1	86%	0.855	80%	0.799	S	S	*	*			trans	52.3	172.8	158.3	-84.9	0	0	0	0	119.1
397	P	46.2	Very low	31.2	Very low	125 Å²	125	132.4 Å²	132.4	81%	0.812	81%	0.806	S	S	*	*			cis	-113.7	-169.7	-6.2	36.2	-18	0	0	0	112.8
398	G	27	Very low	31.1	Very low	62 Å²	62	125.2 Å²	125.2	64%	0.639	80%	0.803	S	S	*	*			cis	120.8	127.7	-3.4	0	0	0	0	0	114.2
399	Y	31.9	Very low	30.4	Very low	233 Å²	233	128.8 Å²	128.8	91%	0.914	81%	0.81	S	S	*	*			trans	-159.5	151.6	175.6	37.9	-103.9	0	0	0	113.8
400	S	28.9	Very low	30.3	Very low	94 Å²	94	128.9 Å²	128.9	66%	0.657	81%	0.805	S	S	*	*			trans	-96.7	-158.7	175.8	-49.3	0	0	0	0	112.4
401	E	33	Very low	30.7	Very low	174 Å²	174	131.5 Å²	131.5	81%	0.813	80%	0.804	S	S	*	*			cis	-164.5	172.3	2.6	-127.1	125	-123.1	0	0	105.7
402	D	33.3	Very low	30.6	Very low	157 Å²	157	131.5 Å²	131.5	84%	0.84	80%	0.801	S	S	*	*			cis	-161.4	168.8	-1.9	-178.3	34.4	0	0	0	110.1
403	G	30	Very low	30.5	Very low	65 Å²	65	133.7 Å²	133.7	67%	0.67	80%	0.798	S	S	*	*			trans	86.8	153.6	154.6	0	0	0	0	0	118.7
404	G	26.9	Very low	30.6	Very low	77 Å²	77	136 Å²	136	79%	0.794	79%	0.792	S	S	*	*			cis	170.5	155.2	-9.1	0	0	0	0	0	114.9
405	A	28.2	Very low	30.5	Very low	95 Å²	95	139.7 Å²	139.7	79%	0.785	80%	0.796	S	S	*	*			trans	68.8	101.8	158.5	0	0	0	0	0	123.7
406	L	29.5	Very low	30.7	Very low	167 Å²	167	142 Å²	142	87%	0.874	80%	0.796	S	S	*	*				56.8	138.8	119.6	-71	168.6	0	0	0	125.2
407	R	27.2	Very low	30.5	Very low	250 Å²	250	140.2 Å²	140.2	94%	0.943	80%	0.796	S	S	*	*			trans	72.6	138.9	153.8	-78.5	-172.7	171.2	-156.7	-1.2	120
408	G	24.9	Very low	30.1	Very low	79 Å²	79	141 Å²	141	81%	0.814	80%	0.799	S	S	*	*			trans	151	122.5	155.8	0	0	0	0	0	113.9
409	E	27.3	Very low	30.2	Very low	189 Å²	189	140.4 Å²	140.4	88%	0.883	79%	0.793	S	S	*	*			trans	-80	155.8	168.7	-59.8	173.4	144.5	0	0	110.9
410	V	26.2	Very low	30.2	Very low	129 Å²	129	135.1 Å²	135.1	78%	0.782	79%	0.787	S	S	*	*				172.9	143.2	119.6	152.1	0	0	0	0	109.4
411	I	38.1	Very low	30.4	Very low	151 Å²	151	135 Å²	135	77%	0.774	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-94.3	126.4	171.9	-60.1	165.8	0	0	0	108.9
412	P	28.4	Very low	30.3	Very low	117 Å²	117	130.5 Å²	130.5	76%	0.76	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-91.7	140.7	157	-5.8	25.6	0	0	0	110.6
413	E	30.7	Very low	30.8	Very low	164 Å²	164	124.9 Å²	124.9	77%	0.766	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-92.6	154.3	179.8	-59.9	176	172.7	0	0	111.7
414	H	32.9	Very low	31.2	Very low	148 Å²	148	127.3 Å²	127.3	69%	0.685	74%	0.736	S	S	*	*			trans	50.5	92.8	163.1	-73.5	-72.8	0	0	0	119.1	F416	H414-F416 AromaticContact ND1-CE2 3.5Å; H414-F416 WeakPolarHBondContact ND1-CE2 3.33Å
415	E	26.5	Very low	31.7	Very low	196 Å²	196	128.7 Å²	128.7	92%	0.916	73%	0.725	S	S	*	*			trans	-114.3	124.3	138.7	-73.5	-159.7	135.9	0	0	110.4	A417	E415-A417 PolarHBondContact O-N 2.7Å
416	F	35	Very low	32.8	Very low	170 Å²	170	126.7 Å²	126.7	75%	0.746	70%	0.7	S	S	*	*			trans	-82.3	90.9	176.5	-88.8	-96.4	0	0	0	110.1	H414 T418	H414-F416 AromaticContact ND1-CE2 3.5Å; H414-F416 WeakPolarHBondContact ND1-CE2 3.33Å; F416-T418 VanDerWaalsContact C-N 3.32Å; F416-T418 PolarHBondContact O-N 3.23Å
417	A	28.7	Very low	33.5	Very low	102 Å²	102	125.5 Å²	125.5	84%	0.843	69%	0.694	S	S	*	*			trans	-71.6	81	174.2	0	0	0	0	0	112	E415 G419	E415-A417 PolarHBondContact O-N 2.7Å; A417-G419 PolarHBondContact O-N 2.84Å
418	T	36.6	Very low	34.3	Very low	142 Å²	142	118 Å²	118	87%	0.871	67%	0.67	S	S	*	*			trans	-72.3	89.9	169.1	51.5	0	0	0	0	110.5	F416	F416-T418 VanDerWaalsContact C-N 3.32Å; F416-T418 PolarHBondContact O-N 3.23Å
419	G	30.5	Very low	35.5	Very low	50 Å²	50	117.3 Å²	117.3	52%	0.515	65%	0.645	S	S	.	*			trans	-132.6	160	173.8	0	0	0	0	0	112.3	A417 V421	A417-G419 PolarHBondContact O-N 2.84Å; G419-V421 PolarHBondContact O-N 3.43Å
420	P	32.3	Very low	36	Very low	122 Å²	122	111.8 Å²	111.8	79%	0.792	63%	0.625	S	S	*	*			trans	-68.3	128.6	176.1	29.1	-33.5	0	0	0	110.4	C422	P420-C422 PolarHBondContact O-N 3.34Å
421	V	31.9	Very low	36.4	Very low	90 Å²	90	111.2 Å²	111.2	55%	0.545	62%	0.624	S	S	.	*			trans	-75.2	98.7	-176.6	-178	0	0	0	0	110.6	G419 L423 E428	G419-V421 PolarHBondContact O-N 3.43Å; V421-L423 PolarHBondContact O-N 3.29Å; V421-L423 VanDerWaalsContact O-N 3.11Å; V421-E428 VanDerWaalsContact CG1-OE2 3.3Å; V421-E428 WeakPolarHBondContact CG1-OE2 3.48Å
422	C	31.7	Very low	36.6	Very low	81 Å²	81	109.2 Å²	109.2	55%	0.547	61%	0.614	S	S	.	*			trans	-71	99	175.2	-70.4	0	0	0	0	111.1	P420 D424 D425	P420-C422 PolarHBondContact O-N 3.34Å; C422-D424 PolarHBondContact O-N 3.13Å; C422-D425 PolarHBondContact O-N 3.39Å
423	L	43.2	Very low	37.2	Very low	39 Å²	39	109.1 Å²	109.1	20%	0.204	61%	0.606	C	S	.	*	T	Hydrogen-bonded Turn	trans	-71.4	30.5	175.5	-76.4	166.8	0	0	0	114.1	R110 V421 E428	R110-L423 HydrophobicContact CB-CD1 3.98Å; R110-L423 PolarHBondContact NH1-O 2.81Å; R110-L423 WeakPolarHBondContact O-CD1 3.4Å; V421-L423 PolarHBondContact O-N 3.29Å; V421-L423 VanDerWaalsContact O-N 3.11Å; L423-E428 WeakPolarHBondContact CD2-OE2 3.4Å
424	D	39.2	Very low	37.2	Very low	115 Å²	115	108 Å²	108	62%	0.615	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.3	-13.9	172.7	-61.9	-40.4	0	0	0	111.5	R110 C422 E426	R110-D424 IonicContact CZ-OD1 2.66Å; R110-D424 IonicContact NH1-OD1 2.75Å; R110-D424 PolarHBondContact NH1-OD1 3.31Å; R110-D424 IonicContact NH2-OD1 2.67Å; R110-D424 PolarHBondContact NH2-OD1 2.84Å; R110-D424 IonicContact NH2-OD2 2.71Å; C422-D424 PolarHBondContact O-N 3.13Å; D424-E426 PolarHBondContact O-N 3.24Å
425	D	37.3	Very low	37.3	Very low	107 Å²	107	105.9 Å²	105.9	57%	0.572	61%	0.605	S	S	*	*			trans	-74.8	118.1	169.6	-82.3	-49.2	0	0	0	111.7	C422 N427 E428	C422-D425 PolarHBondContact O-N 3.39Å; D425-N427 PolarHBondContact O-N 3.03Å; D425-E428 PolarHBondContact O-N 3.09Å
426	E	51	Low	37.6	Very low	53 Å²	53	107.3 Å²	107.3	25%	0.248	60%	0.602	C	S	.	*	T	Hydrogen-bonded Turn	trans	-66.9	7.7	179.9	-61.1	-108.7	160	0	0	114.2	S70 H87 K89 K90 D424	S70-E426 WeakPolarHBondContact CB-OE2 3.39Å; S70-E426 PolarHBondContact OG-OE1 3.02Å; S70-E426 PolarHBondContact OG-OE2 2.96Å; H87-E426 IonicContact CE1-OE2 3.9Å; H87-E426 PolarHBondContact CE1-OE2 3.06Å; H87-E426 IonicContact NE2-OE2 2.68Å; K89-E426 IonicContact NZ-OE1 2.72Å; K89-E426 PolarHBondContact NZ-OE1 3.17Å; K89-E426 IonicContact NZ-OE2 3.87Å; K90-E426 PolarHBondContact NZ-O 3.17Å; D424-E426 PolarHBondContact O-N 3.24Å
427	N	43.5	Very low	37.4	Very low	142 Å²	142	102.8 Å²	102.8	76%	0.759	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.8	-19.9	-173.6	-67.6	-31.7	0	0	0	114	D425 F429	D425-N427 PolarHBondContact O-N 3.03Å; N427-F429 PolarHBondContact O-N 3.16Å
428	E	45	Very low	37.5	Very low	91 Å²	91	105 Å²	105	43%	0.425	60%	0.601	S	S	.	*			trans	-91.7	58.9	-176.6	-155.6	-153.9	-152.9	0	0	113.3	K127 V421 L423 D425	K127-E428 IonicContact NZ-OE1 2.73Å; K127-E428 PolarHBondContact NZ-OE1 3.09Å; K127-E428 IonicContact NZ-OE2 2.66Å; K127-E428 PolarHBondContact NZ-OE2 3.14Å; V421-E428 VanDerWaalsContact CG1-OE2 3.3Å; V421-E428 WeakPolarHBondContact CG1-OE2 3.48Å; L423-E428 WeakPolarHBondContact CD2-OE2 3.4Å; D425-E428 PolarHBondContact O-N 3.09Å
429	F	49.6	Very low	37.3	Very low	65 Å²	65	107.2 Å²	107.2	29%	0.285	60%	0.601	S	S	.	*			trans	-126.4	138.1	169.1	-66.8	-78.9	0	0	0	110.8	L71 N427	L71-F429 HydrophobicContact CD1-CE1 4.02Å; L71-F429 HydrophobicContact CD1-CZ 4.43Å; N427-F429 PolarHBondContact O-N 3.16Å
430	P	38.9	Very low	37.4	Very low	74 Å²	74	114.2 Å²	114.2	48%	0.481	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-72.2	161.9	-171.9	28.4	-34.3	0	0	0	113.4	K127 D128	K127-P430 WeakPolarHBondContact O-CD 3.45Å; K127-P430 WeakPolarHBondContact O-CG 3.4Å; D128-P430 HydrophobicContact CB-CG 4.27Å
431	P	34.2	Very low	37.4	Very low	117 Å²	117	112 Å²	112	76%	0.76	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-62.8	148.7	-177.9	25.6	-35.6	0	0	0	113.4	I433	P431-I433 PolarHBondContact O-N 3.3Å
432	I	42.4	Very low	37.5	Very low	109 Å²	109	117.6 Å²	117.6	56%	0.559	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-57.2	116.2	-175.9	-57.2	167.5	0	0	0	111.1	L434	I432-L434 HydrophobicContact CG2-CD1 4.06Å; I432-L434 PolarHBondContact O-N 2.72Å
433	I	39.3	Very low	37.5	Very low	115 Å²	115	120.6 Å²	120.6	59%	0.59	65%	0.649	S	S	*	*			trans	-92.4	95.6	172.2	-57	-178.8	0	0	0	108.9	P431 C435	P431-I433 PolarHBondContact O-N 3.3Å; I433-C435 PolarHBondContact O-N 3.12Å
434	L	31.7	Very low	37.1	Very low	140 Å²	140	128.3 Å²	128.3	73%	0.733	68%	0.681	S	S	*	*			trans	-67.9	101.1	166.3	-83	110.2	0	0	0	110.2	I432 R436	I432-L434 HydrophobicContact CG2-CD1 4.06Å; I432-L434 PolarHBondContact O-N 2.72Å; L434-R436 PolarHBondContact O-N 3.44Å
435	C	34.3	Very low	37	Very low	104 Å²	104	132 Å²	132	70%	0.703	70%	0.695	S	S	*	*			trans	-65.7	74.4	170.6	-71.1	0	0	0	0	111.9	I433 G437	I433-C435 PolarHBondContact O-N 3.12Å; C435-G437 PolarHBondContact O-N 2.81Å
436	R	32.8	Very low	37.3	Very low	226 Å²	226	136.2 Å²	136.2	85%	0.853	73%	0.732	S	S	*	*			trans	-66.1	104	172.6	-83	-173.1	168.5	179.9	-2.2	110.5	L434 N438	L434-R436 PolarHBondContact O-N 3.44Å; R436-N438 PolarHBondContact O-N 3.17Å
437	G	31.7	Very low	36.7	Very low	74 Å²	74	140.4 Å²	140.4	76%	0.763	76%	0.757	S	S	*	*			trans	-56.3	118.6	172.1	0	0	0	0	0	111.7	C435 Q439	C435-G437 PolarHBondContact O-N 2.81Å; G437-Q439 PolarHBondContact O-N 3.25Å; G437-Q439 VanDerWaalsContact O-N 3.07Å
438	N	30.4	Very low	36.3	Very low	148 Å²	148	140.3 Å²	140.3	79%	0.791	76%	0.756	S	S	*	*			trans	-87.5	71.2	-169.5	-169.4	17	0	0	0	112.5	R436 K440	R436-N438 PolarHBondContact O-N 3.17Å; N438-K440 PolarHBondContact O-N 3.34Å
439	Q	32.1	Very low	35.8	Very low	190 Å²	190	143 Å²	143	89%	0.888	78%	0.775	S	S	*	*			trans	-87.1	101.4	172.2	-73.5	-166.4	-4.1	0	0	111.7	G437	G437-Q439 PolarHBondContact O-N 3.25Å; G437-Q439 VanDerWaalsContact O-N 3.07Å
440	K	32.8	Very low	35	Very low	197 Å²	197	147.6 Å²	147.6	86%	0.857	80%	0.804	S	S	*	*			trans	-126.1	80	162.8	-83.3	-174.8	174	176.1	0	110.5	N438	N438-K440 PolarHBondContact O-N 3.34Å
441	G	31.6	Very low	34.8	Very low	74 Å²	74	152.2 Å²	152.2	76%	0.763	82%	0.824	S	S	*	*			trans	-111.6	120.3	166.5	0	0	0	0	0	109.5
442	K	34.3	Very low	34.8	Very low	209 Å²	209	154.5 Å²	154.5	91%	0.909	83%	0.828	S	S	*	*			trans	-81.4	123.7	-173.7	-68.6	175	179	173.6	0	111.5
443	T	32.4	Very low	34.3	Very low	143 Å²	143	157.8 Å²	157.8	88%	0.877	85%	0.847	S	S	*	*			trans	-63	137.7	154.5	-24.9	0	0	0	0	108.9
444	K	35.3	Very low	33.9	Very low	201 Å²	201	161.1 Å²	161.1	87%	0.874	87%	0.867	S	S	*	*			trans	-136.6	134.5	165.5	-133.4	-169.3	-179.8	-163	0	108
445	Q	36.8	Very low	34	Very low	194 Å²	194	162.8 Å²	162.8	91%	0.907	88%	0.878	S	S	*	*			trans	-81.2	143.1	177.6	-66.8	166.7	-55.3	0	0	110.8
446	S	43.9	Very low	34	Very low	194 Å²	194	168.2 Å²	168.2	100%	1.357	89%	0.894	S	S	*	*			trans	-156.7	0	151.3	60.1	0	0	0	0	107.2

Retrieved 446 of 446 residues in 110.6 ms (Link to these results)

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