G4VFG2_SCHMA Loading...

Metallophos domain-containing protein

AlphaFold DB , UniProt , Accession G4VFG2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 328 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	55.4	Low	80.8	Confident	204 Å²	204	87.8 Å²	87.8	100%	1.005	48%	0.475	S	S	*	.				0	131.8	0	-66.7	169	-156	0	0	106.2	S3	M1-S3 PolarHBondContact O-N 3.2Å
2	E	62.9	Low	82.2	Confident	157 Å²	157	83.1 Å²	83.1	73%	0.734	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-61	131.3	164.3	-72.2	174.1	170.6	0	0	107.3
3	S	68.7	Low	83.3	Confident	107 Å²	107	81.4 Å²	81.4	75%	0.748	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-80.1	134.7	176.5	52.4	0	0	0	0	109.2	M1	M1-S3 PolarHBondContact O-N 3.2Å
4	V	76.5	Confident	84.3	Confident	30 Å²	30	75.7 Å²	75.7	18%	0.182	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-89.1	129.1	171.4	-176.3	0	0	0	0	108.6	I6 T101 L105	V4-I6 PolarHBondContact O-N 2.99Å; V4-T101 HydrophobicContact CG1-CG2 4.39Å; V4-T101 HydrophobicContact CG2-CG2 4.22Å; V4-L105 HydrophobicContact CG1-CD1 3.71Å
5	D	77.7	Confident	85.2	Confident	120 Å²	120	79.9 Å²	79.9	64%	0.642	43%	0.428	S	S	*	.			trans	-74.5	113.4	171.6	-78.8	-28.3	0	0	0	109.5	H7	D5-H7 PolarHBondContact O-N 3.27Å
6	I	79.3	Confident	86	Confident	78 Å²	78	84.6 Å²	84.6	40%	0.4	45%	0.453	S	S	.	.			trans	-85.2	94.2	-177.4	-53.3	169.9	0	0	0	108.9	V4 L11 L105 V141	V4-I6 PolarHBondContact O-N 2.99Å; I6-L11 HydrophobicContact CG2-CD2 4.13Å; I6-L105 HydrophobicContact CG1-CD1 4.38Å; I6-L105 HydrophobicContact CG2-CD2 4.4Å; I6-V141 HydrophobicContact CD1-CG1 4.29Å; I6-V141 HydrophobicContact CG1-CG1 4.44Å
7	H	85.6	Confident	86.7	Confident	146 Å²	146	82.4 Å²	82.4	68%	0.676	44%	0.437	S	S	*	.			trans	-111.4	48.2	177.4	-70.5	-52.7	0	0	0	112.9	D5 S109	D5-H7 PolarHBondContact O-N 3.27Å; H7-S109 WeakPolarHBondContact O-CB 3.38Å
8	C	93.7	Very high	87.3	Confident	11 Å²	11	82.4 Å²	82.4	7%	0.074	43%	0.434	C	S	.	.			trans	-115.3	103.2	173	-178.1	0	0	0	0	110.1	A10 L11 L105 L108	C8-A10 VanDerWaalsContact C-N 3.3Å; C8-A10 PolarHBondContact O-N 2.86Å; C8-L11 HydrophobicContact CB-CB 3.96Å; C8-L11 WeakPolarHBondContact O-CB 3.28Å; C8-L11 PolarHBondContact O-N 3.37Å; C8-L105 HydrophobicContact CB-CD2 4.15Å; C8-L108 PolarHBondContact SG-O 2.76Å
9	S	94.1	Very high	87.9	Confident	91 Å²	91	78.7 Å²	78.7	64%	0.636	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-26.8	-175.9	56.2	0	0	0	0	113.7	L11	S9-L11 VanDerWaalsContact C-N 3.35Å
10	A	97	Very high	88.2	Confident	3 Å²	3	79.5 Å²	79.5	3%	0.025	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-24.2	175.7	0	0	0	0	0	112.9	C8 C12 L111 I115 L117	C8-A10 VanDerWaalsContact C-N 3.3Å; C8-A10 PolarHBondContact O-N 2.86Å; A10-C12 PolarHBondContact O-N 3.06Å; A10-C12 PolarHBondContact O-SG 2.86Å; A10-L111 HydrophobicContact CB-CB 4.23Å; A10-L111 HydrophobicContact CB-CD2 3.96Å; A10-L111 HydrophobicContact CB-CG 4.29Å; A10-I115 WeakPolarHBondContact CB-O 3.4Å; A10-L117 HydrophobicContact CB-CB 4.03Å; A10-L117 PolarHBondContact O-N 3.08Å
11	L	97.8	Very high	88.5	Confident	19 Å²	19	76.7 Å²	76.7	10%	0.099	41%	0.411	C	S	.	.	B	Isolated β-bridge	trans	-64.5	116.5	-174.8	-179.5	63.6	0	0	0	111.6	I6 C8 S9 T13 L105 L117 V119 W142	I6-L11 HydrophobicContact CG2-CD2 4.13Å; C8-L11 HydrophobicContact CB-CB 3.96Å; C8-L11 WeakPolarHBondContact O-CB 3.28Å; C8-L11 PolarHBondContact O-N 3.37Å; S9-L11 VanDerWaalsContact C-N 3.35Å; L11-T13 HydrophobicContact CG-CG2 4.5Å; L11-L105 HydrophobicContact CD2-CD2 4.03Å; L11-L117 HydrophobicContact CD1-CD2 4.33Å; L11-L117 HydrophobicContact CD1-CG 4.37Å; L11-V119 HydrophobicContact CD1-CG1 4.26Å; L11-V119 HydrophobicContact CD1-CG2 4.24Å; L11-W142 HydrophobicContact CD1-CE3 4.18Å; L11-W142 HydrophobicContact CD1-CZ3 4.43Å; L11-W142 HydrophobicContact CD2-CE3 3.98Å; L11-W142 HydrophobicContact CD2-CZ3 4.17Å
12	C	97.8	Very high	89.9	Confident	31 Å²	31	71.6 Å²	71.6	21%	0.209	40%	0.402	C	S	.	.			trans	-95.9	109	179.2	-73	0	0	0	0	110.3	A10 L19 L117 I118	A10-C12 PolarHBondContact O-N 3.06Å; A10-C12 PolarHBondContact O-SG 2.86Å; C12-L19 HydrophobicContact CB-CD1 3.69Å; C12-L19 HydrophobicContact CB-CD2 3.89Å; C12-L19 HydrophobicContact CB-CG 4.4Å; C12-L117 WeakPolarHBondContact CB-O 3.45Å; C12-L117 PolarHBondContact N-O 3.47Å; C12-I118 HydrophobicContact CB-CG1 4.47Å
13	T	96.2	Very high	90.9	Very high	61 Å²	61	67.2 Å²	67.2	37%	0.374	39%	0.386	S	S	.	.			trans	-88	113.8	179.1	53.3	0	0	0	0	111.2	L11	L11-T13 HydrophobicContact CG-CG2 4.5Å
14	A	98.3	Very high	91	Very high	2 Å²	2	65 Å²	65	2%	0.017	37%	0.371	C	S	.	.			trans	-66.8	141.2	171.1	0	0	0	0	0	110.6	L19 D144 F147	A14-L19 HydrophobicContact CB-CB 4.04Å; A14-D144 HydrophobicContact CB-CB 4Å; A14-D144 PolarHBondContact O-N 3.17Å; A14-F147 HydrophobicContact CB-CB 3.85Å; A14-F147 HydrophobicContact CB-CD1 3.39Å; A14-F147 HydrophobicContact CB-CD2 3.67Å; A14-F147 HydrophobicContact CB-CE1 3.75Å; A14-F147 HydrophobicContact CB-CE2 4Å; A14-F147 HydrophobicContact CB-CG 3.36Å; A14-F147 HydrophobicContact CB-CZ 4.04Å
15	K	97.5	Very high	90.6	Very high	139 Å²	139	69.9 Å²	69.9	60%	0.604	40%	0.4	S	S	*	.	B	Isolated β-bridge	trans	-139.8	140.7	177.8	-64.3	-177	-177.3	177.7	0	110.1	R17 H18 D144	K15-R17 PolarHBondContact O-N 2.81Å; K15-H18 PolarHBondContact N-O 2.83Å; K15-H18 PolarHBondContact O-N 2.66Å; K15-D144 WeakPolarHBondContact CA-OD2 3.43Å
16	N	97.7	Very high	90.2	Very high	154 Å²	154	68.1 Å²	68.1	82%	0.824	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	38.7	-177.9	-51.9	-54.9	0	0	0	112.6	H18 D144	N16-H18 PolarHBondContact O-N 2.79Å; N16-D144 PolarHBondContact N-OD2 2.97Å
17	R	98.1	Very high	89.6	Confident	48 Å²	48	66 Å²	66	18%	0.181	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.1	18.4	179.2	-44.3	-53.6	-178	176.7	2.9	114.9	K15 D144 D145 Y146 F147 T148	K15-R17 PolarHBondContact O-N 2.81Å; R17-D144 PolarHBondContact N-OD2 3.17Å; R17-D145 IonicContact CZ-OD1 3.32Å; R17-D145 IonicContact NH1-OD1 3.64Å; R17-D145 PolarHBondContact NH1-OD1 3.24Å; R17-D145 IonicContact NH2-OD1 2.83Å; R17-Y146 WeakPolarHBondContact CD-O 3.36Å; R17-Y146 HydrophobicContact CG-CE2 4.37Å; R17-Y146 VanDerWaalsContact CZ-CE2 3.48Å; R17-Y146 PolarHBondContact NH1-O 3.04Å; R17-Y146 PolarHBondContact NH2-OH 3.31Å; R17-F147 VanDerWaalsContact C-CB 3.43Å; R17-F147 CarbonylContact O-C 3.46Å; R17-F147 VanDerWaalsContact O-CA 3.29Å; R17-F147 WeakPolarHBondContact O-CA 3.47Å; R17-F147 WeakPolarHBondContact O-CB 3.43Å; R17-T148 PolarHBondContact O-N 3.02Å
18	H	97.6	Very high	88.9	Confident	83 Å²	83	62.4 Å²	62.4	38%	0.384	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	141.8	177.9	-171.7	-92.4	0	0	0	111.3	K15 N16 S20 T148	K15-H18 PolarHBondContact N-O 2.83Å; K15-H18 PolarHBondContact O-N 2.66Å; N16-H18 PolarHBondContact O-N 2.79Å; H18-S20 PolarHBondContact CE1-OG 2.93Å; H18-S20 PolarHBondContact ND1-OG 3.49Å; H18-T148 WeakPolarHBondContact CA-O 3.36Å
19	L	97.8	Very high	88.3	Confident	11 Å²	11	65.8 Å²	65.8	6%	0.058	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	131.6	165.1	172.9	71.2	0	0	0	109	C12 A14 L21 I118 F147 T148 F149	C12-L19 HydrophobicContact CB-CD1 3.69Å; C12-L19 HydrophobicContact CB-CD2 3.89Å; C12-L19 HydrophobicContact CB-CG 4.4Å; A14-L19 HydrophobicContact CB-CB 4.04Å; L19-L21 HydrophobicContact CD2-CD2 4.17Å; L19-L21 HydrophobicContact CG-CD2 4.3Å; L19-I118 HydrophobicContact CD2-CD1 3.74Å; L19-I118 HydrophobicContact CD2-CG1 3.76Å; L19-I118 HydrophobicContact CD2-CG2 4.36Å; L19-F147 HydrophobicContact CB-CD2 3.97Å; L19-F147 HydrophobicContact CB-CE2 4.07Å; L19-F147 HydrophobicContact CD2-CE2 4.17Å; L19-T148 PolarHBondContact N-O 2.85Å; L19-F149 HydrophobicContact CB-CB 4Å; L19-F149 HydrophobicContact CD2-CD1 4.49Å; L19-F149 HydrophobicContact CD2-CG 4.49Å; L19-F149 HydrophobicContact CG-CB 4.44Å; L19-F149 WeakPolarHBondContact O-CB 3.45Å
20	S	95	Very high	88.1	Confident	94 Å²	94	64.6 Å²	64.6	66%	0.657	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.4	123.4	178.1	-59.5	0	0	0	0	109.8	H18	H18-S20 PolarHBondContact CE1-OG 2.93Å; H18-S20 PolarHBondContact ND1-OG 3.49Å
21	L	93.3	Very high	88	Confident	21 Å²	21	65.3 Å²	65.3	11%	0.11	39%	0.386	C	S	.	.			trans	-112.1	145.7	169.8	-60.4	-177.6	0	0	0	109.6	L19 T23 F80 P116 I118 F149 F151	L19-L21 HydrophobicContact CD2-CD2 4.17Å; L19-L21 HydrophobicContact CG-CD2 4.3Å; L21-T23 PolarHBondContact O-N 2.82Å; L21-F80 HydrophobicContact CD1-CD1 4.34Å; L21-P116 HydrophobicContact CD2-CB 3.76Å; L21-P116 HydrophobicContact CD2-CG 3.99Å; L21-I118 HydrophobicContact CD1-CD1 4.14Å; L21-F149 HydrophobicContact CD1-CD2 3.69Å; L21-F149 HydrophobicContact CD1-CE2 3.89Å; L21-F149 HydrophobicContact CG-CD2 4.35Å; L21-F151 HydrophobicContact CB-CD2 4.31Å; L21-F151 HydrophobicContact CD1-CD2 4.4Å
22	A	86.2	Confident	87.9	Confident	98 Å²	98	65.9 Å²	65.9	81%	0.81	39%	0.391	S	S	*	.			trans	-63.1	126.5	167.3	0	0	0	0	0	108.2	F151	A22-F151 WeakPolarHBondContact O-CE2 3.45Å
23	T	82.7	Confident	88	Confident	64 Å²	64	64.4 Å²	64.4	39%	0.393	38%	0.382	S	S	.	.			trans	-147.2	150.6	-172.8	-170.6	0	0	0	0	111.4	L21 F151 N152	L21-T23 PolarHBondContact O-N 2.82Å; T23-F151 WeakPolarHBondContact OG1-CA 3.36Å; T23-N152 PolarHBondContact OG1-N 2.86Å; T23-N152 PolarHBondContact OG1-OD1 2.84Å
24	S	71.2	Confident	88.1	Confident	61 Å²	61	61.6 Å²	61.6	43%	0.427	36%	0.364	S	S	.	.			trans	-80.2	146.2	175	-171.9	0	0	0	0	110.1	D26 N152	S24-D26 VanDerWaalsContact C-N 3.28Å; S24-D26 WeakPolarHBondContact OG-CB 3.28Å; S24-D26 PolarHBondContact OG-N 2.92Å; S24-N152 PolarHBondContact N-OD1 3.42Å
25	T	68.7	Low	88.1	Confident	132 Å²	132	61.5 Å²	61.5	81%	0.81	36%	0.363	S	S	*	.	S	Bend	trans	-84.3	-8.5	166.1	51.1	0	0	0	0	112.1	V27	T25-V27 PolarHBondContact O-N 2.85Å
26	D	69.6	Low	88.2	Confident	83 Å²	83	55.2 Å²	55.2	44%	0.444	34%	0.336	S	S	.	.			trans	-79.1	112.2	176	-168.9	-13.6	0	0	0	110.7	S24 S28	S24-D26 VanDerWaalsContact C-N 3.28Å; S24-D26 WeakPolarHBondContact OG-CB 3.28Å; S24-D26 PolarHBondContact OG-N 2.92Å; D26-S28 VanDerWaalsContact C-N 3.29Å; D26-S28 PolarHBondContact O-N 3.49Å; D26-S28 WeakPolarHBondContact OD1-CB 3.19Å; D26-S28 PolarHBondContact OD1-N 2.61Å; D26-S28 VanDerWaalsContact OD1-N 3.1Å; D26-S28 PolarHBondContact OD1-OG 2.85Å
27	V	65.9	Low	88.2	Confident	33 Å²	33	47.9 Å²	47.9	20%	0.2	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-10	-174.8	-151.5	0	0	0	0	113.3	T25 T29 R153 G297 N298	T25-V27 PolarHBondContact O-N 2.85Å; V27-T29 VanDerWaalsContact C-N 3.35Å; V27-T29 PolarHBondContact O-N 3.07Å; V27-R153 HydrophobicContact CG1-CB 4.34Å; V27-R153 HydrophobicContact CG1-CG 4.48Å; V27-R153 HydrophobicContact CG2-CG 4.44Å; V27-G297 WeakPolarHBondContact O-CA 2.97Å; V27-N298 WeakPolarHBondContact CB-ND2 3.28Å; V27-N298 WeakPolarHBondContact CG1-OD1 3.41Å; V27-N298 PolarHBondContact O-N 2.89Å
28	S	69.9	Low	88.3	Confident	71 Å²	71	45.6 Å²	45.6	50%	0.497	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-17.1	-166.9	63.6	0	0	0	0	113.9	D26 P30	D26-S28 VanDerWaalsContact C-N 3.29Å; D26-S28 PolarHBondContact O-N 3.49Å; D26-S28 WeakPolarHBondContact OD1-CB 3.19Å; D26-S28 PolarHBondContact OD1-N 2.61Å; D26-S28 VanDerWaalsContact OD1-N 3.1Å; D26-S28 PolarHBondContact OD1-OG 2.85Å; S28-P30 WeakPolarHBondContact O-CD 3.44Å
29	T	82.2	Confident	88.3	Confident	83 Å²	83	41.7 Å²	41.7	51%	0.509	27%	0.271	S	S	.	.	S	Bend	trans	-98.9	118.7	-170.3	-54.1	0	0	0	0	110.9	V27	V27-T29 VanDerWaalsContact C-N 3.35Å; V27-T29 PolarHBondContact O-N 3.07Å
30	P	90.1	Very high	88.4	Confident	66 Å²	66	41.4 Å²	41.4	43%	0.429	27%	0.269	S	S	.	.			trans	-54.6	147.4	170.1	-24.2	33.3	0	0	0	111.7	S28 I295	S28-P30 WeakPolarHBondContact O-CD 3.44Å; P30-I295 VanDerWaalsContact CA-O 3.27Å; P30-I295 WeakPolarHBondContact CA-O 3.48Å
31	F	94	Very high	88.5	Confident	17 Å²	17	37 Å²	37	8%	0.075	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	152.6	173.4	70.3	-85	0	0	0	111.2	F33 A79 F80 F151 N152 F156 Q294 I295	F31-F33 HydrophobicContact CD2-CD1 4.37Å; F31-F33 AromaticContact CE2-CD1 3.92Å; F31-F33 HydrophobicContact CE2-CD1 3.92Å; F31-F33 HydrophobicContact CE2-CE1 4.39Å; F31-A79 HydrophobicContact CB-CB 4.48Å; F31-A79 HydrophobicContact CD2-CB 3.84Å; F31-F80 HydrophobicContact CE2-CE1 4.34Å; F31-F151 HydrophobicContact CB-CE1 3.99Å; F31-F151 HydrophobicContact CD1-CD1 4.3Å; F31-F151 HydrophobicContact CD1-CE1 4.19Å; F31-F151 AromaticContact CD2-CD1 3.69Å; F31-F151 HydrophobicContact CD2-CD1 3.69Å; F31-F151 AromaticContact CD2-CE1 3.63Å; F31-F151 HydrophobicContact CD2-CE1 3.63Å; F31-F151 HydrophobicContact CE1-CD1 4.26Å; F31-F151 AromaticContact CE2-CD1 3.64Å; F31-F151 HydrophobicContact CE2-CD1 3.64Å; F31-F151 HydrophobicContact CE2-CE1 4.1Å; F31-F151 HydrophobicContact CG-CD1 4.02Å; F31-F151 AromaticContact CG-CE1 3.67Å; F31-F151 HydrophobicContact CG-CE1 3.67Å; F31-F151 AromaticContact CZ-CD1 3.93Å; F31-F151 HydrophobicContact CZ-CD1 3.93Å; F31-N152 HydrophobicContact CD1-CB 3.78Å; F31-N152 HydrophobicContact CE1-CB 3.74Å; F31-F156 HydrophobicContact CE2-CE2 4.43Å; F31-F156 AromaticContact CE2-CZ 3.99Å; F31-F156 HydrophobicContact CE2-CZ 3.99Å; F31-F156 HydrophobicContact CZ-CE2 4.33Å; F31-F156 AromaticContact CZ-CZ 3.97Å; F31-F156 HydrophobicContact CZ-CZ 3.97Å; F31-Q294 WeakPolarHBondContact O-CA 3.34Å; F31-I295 HydrophobicContact CD1-CB 4.28Å; F31-I295 HydrophobicContact CE1-CB 3.74Å; F31-I295 HydrophobicContact CE1-CD1 4.45Å; F31-I295 HydrophobicContact CE1-CG2 3.8Å; F31-I295 HydrophobicContact CE2-CB 4.45Å; F31-I295 HydrophobicContact CE2-CD1 4.32Å; F31-I295 HydrophobicContact CZ-CB 3.85Å; F31-I295 HydrophobicContact CZ-CD1 3.77Å; F31-I295 HydrophobicContact CZ-CG1 4.25Å; F31-I295 HydrophobicContact CZ-CG2 4.18Å; F31-I295 PolarHBondContact N-O 3.02Å; F31-I295 PolarHBondContact O-N 3.28Å
32	C	96.7	Very high	88.8	Confident	31 Å²	31	36 Å²	36	21%	0.209	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	148.2	177.7	-55.1	0	0	0	0	110.7	P78 A79 V293 Q294 I328	C32-P78 CarbonylContact O-C 3.57Å; C32-P78 WeakPolarHBondContact O-CA 3.38Å; C32-A79 WeakPolarHBondContact O-CB 3.41Å; C32-A79 PolarHBondContact O-N 3.03Å; C32-V293 CarbonylContact C-O 3.57Å; C32-V293 WeakPolarHBondContact CA-O 3.48Å; C32-V293 WeakPolarHBondContact CB-O 3.25Å; C32-Q294 PolarHBondContact SG-OE1 3.21Å; C32-I328 HydrophobicContact CB-CD1 4.17Å
33	F	98.4	Very high	89.3	Confident	1 Å²	1	32.3 Å²	32.3	0%	0.004	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	164.1	168.7	60.6	-92.2	0	0	0	110	F31 V35 F80 F156 F198 V293 I295	F31-F33 HydrophobicContact CD2-CD1 4.37Å; F31-F33 AromaticContact CE2-CD1 3.92Å; F31-F33 HydrophobicContact CE2-CD1 3.92Å; F31-F33 HydrophobicContact CE2-CE1 4.39Å; F33-V35 HydrophobicContact CD2-CG2 4.09Å; F33-V35 HydrophobicContact CE2-CG2 3.84Å; F33-F80 WeakPolarHBondContact CA-O 3.41Å; F33-F80 HydrophobicContact CB-CD1 4.04Å; F33-F80 HydrophobicContact CB-CD2 3.83Å; F33-F80 HydrophobicContact CB-CE1 3.79Å; F33-F80 HydrophobicContact CB-CE2 3.58Å; F33-F80 HydrophobicContact CB-CG 4.05Å; F33-F80 HydrophobicContact CB-CZ 3.55Å; F33-F80 WeakPolarHBondContact CB-O 3.46Å; F33-F80 HydrophobicContact CD1-CE1 4.11Å; F33-F80 HydrophobicContact CD1-CE2 4.34Å; F33-F80 AromaticContact CD1-CZ 3.67Å; F33-F80 HydrophobicContact CD1-CZ 3.67Å; F33-F80 AromaticContact CD2-CE2 3.67Å; F33-F80 HydrophobicContact CD2-CE2 3.67Å; F33-F80 AromaticContact CD2-CZ 3.83Å; F33-F80 HydrophobicContact CD2-CZ 3.83Å; F33-F80 HydrophobicContact CE1-CZ 4.27Å; F33-F80 HydrophobicContact CE2-CE2 4.42Å; F33-F80 HydrophobicContact CE2-CZ 4.42Å; F33-F80 HydrophobicContact CG-CD2 4.37Å; F33-F80 HydrophobicContact CG-CE1 4.02Å; F33-F80 AromaticContact CG-CE2 3.61Å; F33-F80 HydrophobicContact CG-CE2 3.61Å; F33-F80 AromaticContact CG-CZ 3.4Å; F33-F80 HydrophobicContact CG-CZ 3.4Å; F33-F156 HydrophobicContact CD1-CZ 4.41Å; F33-F156 AromaticContact CE1-CE1 3.91Å; F33-F156 HydrophobicContact CE1-CE1 3.91Å; F33-F156 HydrophobicContact CE1-CZ 4.08Å; F33-F156 HydrophobicContact CZ-CE1 4.05Å; F33-F198 HydrophobicContact CD2-CZ 4.1Å; F33-F198 AromaticContact CE2-CE1 3.89Å; F33-F198 HydrophobicContact CE2-CE1 3.89Å; F33-F198 AromaticContact CE2-CZ 3.46Å; F33-F198 HydrophobicContact CE2-CZ 3.46Å; F33-F198 VanDerWaalsContact CE2-CZ 3.46Å; F33-F198 AromaticContact CZ-CZ 3.92Å; F33-F198 HydrophobicContact CZ-CZ 3.92Å; F33-V293 HydrophobicContact CD1-CB 4.23Å; F33-V293 HydrophobicContact CD1-CG1 4.42Å; F33-V293 HydrophobicContact CD2-CB 3.9Å; F33-V293 HydrophobicContact CD2-CG2 4.15Å; F33-V293 HydrophobicContact CE1-CB 3.84Å; F33-V293 HydrophobicContact CE1-CG1 3.59Å; F33-V293 HydrophobicContact CE2-CB 3.45Å; F33-V293 VanDerWaalsContact CE2-CB 3.45Å; F33-V293 HydrophobicContact CE2-CG1 3.77Å; F33-V293 HydrophobicContact CE2-CG2 3.57Å; F33-V293 HydrophobicContact CG-CB 4.28Å; F33-V293 HydrophobicContact CZ-CB 3.45Å; F33-V293 VanDerWaalsContact CZ-CB 3.45Å; F33-V293 HydrophobicContact CZ-CG1 3.23Å; F33-V293 HydrophobicContact CZ-CG2 3.97Å; F33-V293 PolarHBondContact N-O 3.01Å; F33-V293 PolarHBondContact O-N 3.05Å; F33-I295 HydrophobicContact CE1-CD1 3.84Å; F33-I295 HydrophobicContact CE1-CG1 4.1Å
34	V	98.9	Very high	90	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.006	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	132.9	-177.8	177.5	0	0	0	0	109.5	I36 V71 L74 P78 F80 V81 I82 I290 R291 L292	V34-I36 HydrophobicContact CG1-CG1 4.06Å; V34-V71 HydrophobicContact CG1-CG2 4.02Å; V34-V71 HydrophobicContact CG2-CG2 4.24Å; V34-L74 HydrophobicContact CG2-CD1 3.9Å; V34-P78 HydrophobicContact CG2-CB 3.93Å; V34-P78 HydrophobicContact CG2-CG 3.63Å; V34-F80 PolarHBondContact N-O 3.19Å; V34-F80 VanDerWaalsContact N-O 3.09Å; V34-V81 HydrophobicContact CB-CG2 4.13Å; V34-V81 CarbonylContact O-C 3.55Å; V34-V81 WeakPolarHBondContact O-CA 3.49Å; V34-I82 PolarHBondContact O-N 2.81Å; V34-I290 HydrophobicContact CG1-CB 4.14Å; V34-I290 HydrophobicContact CG1-CD1 3.89Å; V34-I290 HydrophobicContact CG1-CG1 4.39Å; V34-R291 WeakPolarHBondContact CA-O 3.25Å; V34-L292 HydrophobicContact CG2-CD2 3.8Å
35	V	98.9	Very high	91.3	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	123.3	169.5	-179.2	0	0	0	0	108.7	F33 I82 F198 F238 R291 V293	F33-V35 HydrophobicContact CD2-CG2 4.09Å; F33-V35 HydrophobicContact CE2-CG2 3.84Å; V35-I82 WeakPolarHBondContact CA-O 3.12Å; V35-I82 HydrophobicContact CB-CG2 4.48Å; V35-I82 HydrophobicContact CG2-CG2 3.92Å; V35-F198 HydrophobicContact CG2-CE1 3.87Å; V35-F238 HydrophobicContact CG2-CD1 4.31Å; V35-R291 HydrophobicContact CB-CB 4.18Å; V35-R291 PolarHBondContact N-O 3.22Å; V35-R291 PolarHBondContact O-N 2.68Å; V35-V293 HydrophobicContact CG2-CG2 4.03Å
36	I	98.9	Very high	92.5	Very high	7 Å²	7	25.3 Å²	25.3	4%	0.036	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	145.5	169.6	-61	-177.9	0	0	0	106.6	V34 P39 V81 I82 I83 C84 V279 I290	V34-I36 HydrophobicContact CG1-CG1 4.06Å; I36-P39 HydrophobicContact CG2-CG 4.24Å; I36-V81 HydrophobicContact CD1-CG1 3.78Å; I36-V81 HydrophobicContact CG1-CG1 4.12Å; I36-I82 PolarHBondContact N-O 3.33Å; I36-I83 HydrophobicContact CB-CG1 4.15Å; I36-I83 HydrophobicContact CG2-CG1 4.4Å; I36-I83 HydrophobicContact CG2-CG2 4.29Å; I36-I83 CarbonylContact O-C 3.53Å; I36-I83 VanDerWaalsContact O-CA 3.29Å; I36-I83 WeakPolarHBondContact O-CA 3.38Å; I36-C84 PolarHBondContact O-N 2.71Å; I36-V279 HydrophobicContact CG2-CB 3.8Å; I36-V279 HydrophobicContact CG2-CG1 3.64Å; I36-V279 HydrophobicContact CG2-CG2 4.2Å; I36-I290 HydrophobicContact CD1-CG2 4.37Å; I36-I290 HydrophobicContact CG1-CB 4.48Å; I36-I290 HydrophobicContact CG1-CG2 3.84Å
37	A	98.8	Very high	93.7	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.008	15%	0.149	C	C	.	.			trans	-131.3	142.4	178	0	0	0	0	0	110.5	C84 S278 V279	A37-C84 HydrophobicContact CB-CB 4.44Å; A37-S278 CarbonylContact O-C 3.5Å; A37-S278 WeakPolarHBondContact O-CA 3.46Å; A37-V279 PolarHBondContact O-N 2.74Å
38	D	98.8	Very high	95.1	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.165	C	C	.	.			trans	45.3	59.6	168.6	-41.9	-83.9	0	0	0	114.8	Q40 G85 D86 H200 G240 H241 H243 S278	D38-Q40 PolarHBondContact O-N 2.96Å; D38-G85 WeakPolarHBondContact CA-O 3Å; D38-G85 PolarHBondContact N-O 2.87Å; D38-D86 HydrophobicContact CB-CB 4.4Å; D38-H200 IonicContact OD1-CE1 3.51Å; D38-H200 PolarHBondContact OD1-CE1 3.25Å; D38-H200 IonicContact OD1-ND1 3.42Å; D38-G240 VanDerWaalsContact OD2-CA 3.25Å; D38-G240 WeakPolarHBondContact OD2-CA 3.48Å; D38-H241 VanDerWaalsContact CG-N 3.29Å; D38-H241 WeakPolarHBondContact OD1-CA 3.15Å; D38-H241 PolarHBondContact OD1-N 3.03Å; D38-H241 PolarHBondContact OD2-N 3.26Å; D38-H243 IonicContact OD1-NE2 2.65Å; D38-S278 PolarHBondContact O-OG 3.28Å
39	P	98.8	Very high	96.3	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.159	C	C	.	.			trans	-55	-38.5	169.2	-22.2	33	0	0	0	112.2	I36 L41 V64 I83 L104 V279 C280	I36-P39 HydrophobicContact CG2-CG 4.24Å; P39-L41 VanDerWaalsContact C-N 3.32Å; P39-L41 PolarHBondContact O-N 2.73Å; P39-L41 VanDerWaalsContact O-N 3.09Å; P39-V64 HydrophobicContact CB-CG2 3.88Å; P39-I83 HydrophobicContact CG-CD1 4.5Å; P39-I83 HydrophobicContact CG-CG2 3.63Å; P39-L104 HydrophobicContact CB-CD1 4.11Å; P39-V279 HydrophobicContact CB-CG1 4.06Å; P39-V279 HydrophobicContact CG-CG1 4.03Å; P39-C280 WeakPolarHBondContact O-CB 3.37Å; P39-C280 PolarHBondContact O-SG 3.05Å
40	Q	98.5	Very high	97	Very high	6 Å²	6	34.6 Å²	34.6	3%	0.028	17%	0.17	C	C	.	.			trans	38.6	53.1	166.9	-153	174.6	13.7	0	0	114.8	D38 G42 L43 D86 L87 N89 H124 H243	D38-Q40 PolarHBondContact O-N 2.96Å; Q40-G42 PolarHBondContact O-N 2.71Å; Q40-L43 HydrophobicContact CB-CB 4.4Å; Q40-L43 HydrophobicContact CG-CB 4.13Å; Q40-L43 HydrophobicContact CG-CD1 4.48Å; Q40-L43 WeakPolarHBondContact O-CB 3.2Å; Q40-L43 PolarHBondContact O-N 2.96Å; Q40-L43 VanDerWaalsContact O-N 3.14Å; Q40-D86 WeakPolarHBondContact CA-O 3.45Å; Q40-D86 HydrophobicContact CB-CB 4.3Å; Q40-D86 WeakPolarHBondContact CB-O 3.47Å; Q40-D86 HydrophobicContact CG-CB 4.06Å; Q40-D86 PolarHBondContact N-O 3.33Å; Q40-D86 PolarHBondContact NE2-OD2 2.91Å; Q40-L87 PolarHBondContact N-O 2.83Å; Q40-N89 HydrophobicContact CG-CB 4Å; Q40-H124 PolarHBondContact NE2-CD2 2.79Å; Q40-H124 PolarHBondContact NE2-CE1 2.76Å; Q40-H124 PolarHBondContact NE2-ND1 2.87Å; Q40-H124 PolarHBondContact NE2-NE2 2.86Å; Q40-H124 VanDerWaalsContact NE2-NE2 3.18Å; Q40-H243 PolarHBondContact OE1-CE1 3.17Å; Q40-H243 PolarHBondContact OE1-NE2 3.2Å; Q40-H243 VanDerWaalsContact OE1-NE2 3.08Å
41	L	98.5	Very high	97.2	Very high	1 Å²	1	37 Å²	37	1%	0.005	17%	0.17	C	C	.	.	B	Isolated β-bridge	trans	-54.6	124	-177.1	-57.2	-167.2	0	0	0	110.9	P39 W57 E60 V61 V64 N89 Q100 D103 L104	P39-L41 VanDerWaalsContact C-N 3.32Å; P39-L41 PolarHBondContact O-N 2.73Å; P39-L41 VanDerWaalsContact O-N 3.09Å; L41-W57 HydrophobicContact CB-CB 4.17Å; L41-W57 HydrophobicContact CB-CG 4.05Å; L41-E60 HydrophobicContact CD2-CB 3.42Å; L41-E60 VanDerWaalsContact CD2-CB 3.42Å; L41-V61 HydrophobicContact CD1-CG2 3.89Å; L41-V61 HydrophobicContact CD2-CG2 4.42Å; L41-V64 HydrophobicContact CD2-CG2 4.1Å; L41-N89 WeakPolarHBondContact O-CB 3.41Å; L41-N89 PolarHBondContact O-N 2.96Å; L41-Q100 HydrophobicContact CB-CB 4.35Å; L41-Q100 HydrophobicContact CB-CG 4.44Å; L41-Q100 WeakPolarHBondContact O-CG 3.05Å; L41-Q100 PolarHBondContact O-NE2 3.44Å; L41-Q100 PolarHBondContact O-OE1 2.68Å; L41-D103 HydrophobicContact CD1-CB 4.38Å; L41-L104 HydrophobicContact CD1-CB 3.71Å; L41-L104 HydrophobicContact CD1-CD1 4.22Å; L41-L104 HydrophobicContact CG-CB 4.38Å; L41-L104 HydrophobicContact CG-CD1 4.3Å
42	G	97.9	Very high	97.2	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	104.1	-1.4	179.8	0	0	0	0	0	114.3	Q40 Q46 E60 N89	Q40-G42 PolarHBondContact O-N 2.71Å; G42-Q46 WeakPolarHBondContact O-CB 3.49Å; G42-E60 PolarHBondContact N-OE1 3.41Å; G42-E60 VanDerWaalsContact N-OE1 3.12Å; G42-N89 PolarHBondContact O-ND2 2.95Å
43	L	97.8	Very high	97	Very high	20 Å²	20	46.8 Å²	46.8	11%	0.105	22%	0.217	C	C	.	.	H	α-helix	trans	-71.9	-41.7	176.5	-175.1	83.2	0	0	0	111.9	Q40 Q46 Y47 E60 N89 V281	Q40-L43 HydrophobicContact CB-CB 4.4Å; Q40-L43 HydrophobicContact CG-CB 4.13Å; Q40-L43 HydrophobicContact CG-CD1 4.48Å; Q40-L43 WeakPolarHBondContact O-CB 3.2Å; Q40-L43 PolarHBondContact O-N 2.96Å; Q40-L43 VanDerWaalsContact O-N 3.14Å; L43-Q46 PolarHBondContact O-N 3.29Å; L43-Y47 HydrophobicContact CD1-CD2 3.43Å; L43-Y47 VanDerWaalsContact CD1-CD2 3.43Å; L43-Y47 HydrophobicContact CD1-CE2 4.04Å; L43-Y47 HydrophobicContact CD1-CG 4.09Å; L43-Y47 HydrophobicContact CG-CD2 4.23Å; L43-Y47 PolarHBondContact O-N 2.91Å; L43-E60 PolarHBondContact N-OE1 3.48Å; L43-N89 HydrophobicContact CB-CB 4.42Å; L43-N89 WeakPolarHBondContact CD1-OD1 3.2Å; L43-V281 HydrophobicContact CD2-CB 3.73Å; L43-V281 HydrophobicContact CD2-CG1 3.75Å; L43-V281 HydrophobicContact CD2-CG2 4.15Å
44	Q	97.5	Very high	96.8	Very high	51 Å²	51	50.9 Å²	50.9	24%	0.238	24%	0.243	C	C	.	.	I	π-helix	trans	-62.8	-56.6	-166.8	-177.4	173.3	-31.2	0	0	111.7	Q46 V48 E49 E60 V281	Q44-Q46 VanDerWaalsContact C-N 3.28Å; Q44-Q46 PolarHBondContact O-N 2.93Å; Q44-V48 HydrophobicContact CG-CB 4.5Å; Q44-V48 WeakPolarHBondContact O-CA 3.24Å; Q44-V48 VanDerWaalsContact O-CB 3.31Å; Q44-V48 WeakPolarHBondContact O-CB 3.21Å; Q44-V48 PolarHBondContact O-N 3.24Å; Q44-E49 HydrophobicContact CG-CG 4.26Å; Q44-E49 PolarHBondContact NE2-OE1 2.98Å; Q44-E49 PolarHBondContact O-N 2.72Å; Q44-E60 VanDerWaalsContact CB-CD 3.49Å; Q44-E60 HydrophobicContact CB-CG 4.3Å; Q44-E60 VanDerWaalsContact CB-OE1 3.22Å; Q44-E60 WeakPolarHBondContact CB-OE1 3.17Å; Q44-E60 PolarHBondContact N-OE1 2.84Å; Q44-V281 HydrophobicContact CB-CG2 3.74Å; Q44-V281 HydrophobicContact CG-CG2 4.29Å
45	E	97.4	Very high	96.6	Very high	18 Å²	18	51.6 Å²	51.6	8%	0.084	25%	0.246	C	C	.	.	I	π-helix	trans	-64.5	-35.4	-179.1	-69.8	-159.2	164.8	0	0	112.1	K50 R51 H55 H56	E45-K50 CarbonylContact O-C 3.6Å; E45-K50 WeakPolarHBondContact O-CA 3.45Å; E45-K50 PolarHBondContact O-N 2.91Å; E45-R51 HydrophobicContact CB-CB 4.35Å; E45-R51 HydrophobicContact CB-CG 4.41Å; E45-R51 PolarHBondContact O-N 2.83Å; E45-R51 IonicContact OE1-CZ 3.55Å; E45-R51 IonicContact OE1-NE 3.06Å; E45-R51 IonicContact OE1-NH1 3.79Å; E45-R51 PolarHBondContact OE1-NH1 2.74Å; E45-H55 HydrophobicContact CB-CB 4.34Å; E45-H56 VanDerWaalsContact CD-O 3.3Å; E45-H56 VanDerWaalsContact CG-O 3.31Å; E45-H56 WeakPolarHBondContact CG-O 3.46Å; E45-H56 PolarHBondContact OE2-N 3.23Å
46	Q	95.8	Very high	96.5	Very high	42 Å²	42	56.2 Å²	56.2	20%	0.196	27%	0.268	C	S	.	.	I	π-helix	trans	-73.7	-50.6	-177.1	179.4	166.8	-37.4	0	0	113.1	G42 L43 Q44 H55 N89	G42-Q46 WeakPolarHBondContact O-CB 3.49Å; L43-Q46 PolarHBondContact O-N 3.29Å; Q44-Q46 VanDerWaalsContact C-N 3.28Å; Q44-Q46 PolarHBondContact O-N 2.93Å; Q46-H55 PolarHBondContact OE1-CE1 3.08Å; Q46-H55 PolarHBondContact OE1-ND1 3.15Å; Q46-N89 PolarHBondContact OE1-ND2 3.46Å
47	Y	94.2	Very high	96.4	Very high	129 Å²	129	56.7 Å²	56.7	51%	0.506	27%	0.269	S	S	.	.	I	π-helix	trans	-104.9	-37.3	-168	-73.7	-78.8	0	0	0	113.7	L43	L43-Y47 HydrophobicContact CD1-CD2 3.43Å; L43-Y47 VanDerWaalsContact CD1-CD2 3.43Å; L43-Y47 HydrophobicContact CD1-CE2 4.04Å; L43-Y47 HydrophobicContact CD1-CG 4.09Å; L43-Y47 HydrophobicContact CG-CD2 4.23Å; L43-Y47 PolarHBondContact O-N 2.91Å
48	V	94.8	Very high	96.4	Very high	88 Å²	88	61.2 Å²	61.2	53%	0.533	29%	0.294	S	S	.	.	I	π-helix	trans	-82.5	-56.1	-178.3	-175.2	0	0	0	0	109.8	Q44 V281	Q44-V48 HydrophobicContact CG-CB 4.5Å; Q44-V48 WeakPolarHBondContact O-CA 3.24Å; Q44-V48 VanDerWaalsContact O-CB 3.31Å; Q44-V48 WeakPolarHBondContact O-CB 3.21Å; Q44-V48 PolarHBondContact O-N 3.24Å; V48-V281 HydrophobicContact CG2-CG1 3.45Å; V48-V281 VanDerWaalsContact CG2-CG1 3.45Å
49	E	96.1	Very high	96.3	Very high	78 Å²	78	62.6 Å²	62.6	36%	0.364	31%	0.308	S	S	.	.	S	Bend	trans	-88.1	-19.5	-174.9	-55.9	-174.2	-165.8	0	0	113	Q44 R51	Q44-E49 HydrophobicContact CG-CG 4.26Å; Q44-E49 PolarHBondContact NE2-OE1 2.98Å; Q44-E49 PolarHBondContact O-N 2.72Å; E49-R51 VanDerWaalsContact C-N 3.29Å; E49-R51 HydrophobicContact CB-CG 4.07Å; E49-R51 PolarHBondContact O-N 3.43Å; E49-R51 IonicContact OE2-CZ 3.42Å; E49-R51 IonicContact OE2-NE 3.82Å; E49-R51 PolarHBondContact OE2-NE 3.4Å; E49-R51 IonicContact OE2-NH2 2.7Å; E49-R51 PolarHBondContact OE2-NH2 2.69Å
50	K	95.5	Very high	96.3	Very high	169 Å²	169	62.8 Å²	62.8	74%	0.735	31%	0.308	S	S	*	.			trans	55.1	41.7	178.3	-55.3	177.4	-177.2	175.4	0	112.8	E45	E45-K50 CarbonylContact O-C 3.6Å; E45-K50 WeakPolarHBondContact O-CA 3.45Å; E45-K50 PolarHBondContact O-N 2.91Å
51	R	95.6	Very high	96.3	Very high	118 Å²	118	64.2 Å²	64.2	45%	0.445	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-68.6	150.9	175.8	-65.5	-171.3	-175.1	-174.5	0.4	110.6	E45 E49 H55	E45-R51 HydrophobicContact CB-CB 4.35Å; E45-R51 HydrophobicContact CB-CG 4.41Å; E45-R51 PolarHBondContact O-N 2.83Å; E45-R51 IonicContact OE1-CZ 3.55Å; E45-R51 IonicContact OE1-NE 3.06Å; E45-R51 IonicContact OE1-NH1 3.79Å; E45-R51 PolarHBondContact OE1-NH1 2.74Å; E49-R51 VanDerWaalsContact C-N 3.29Å; E49-R51 HydrophobicContact CB-CG 4.07Å; E49-R51 PolarHBondContact O-N 3.43Å; E49-R51 IonicContact OE2-CZ 3.42Å; E49-R51 IonicContact OE2-NE 3.82Å; E49-R51 PolarHBondContact OE2-NE 3.4Å; E49-R51 IonicContact OE2-NH2 2.7Å; E49-R51 PolarHBondContact OE2-NH2 2.69Å; R51-H55 PolarHBondContact O-CD2 2.73Å; R51-H55 PolarHBondContact O-NE2 2.85Å
52	P	93.9	Very high	96.4	Very high	112 Å²	112	70.9 Å²	70.9	73%	0.727	35%	0.347	S	S	*	.	P	Polyproline II helix	trans	-70.3	155	169.6	31.2	-34.7	0	0	0	110.7
53	R	92.4	Very high	96.4	Very high	141 Å²	141	72.1 Å²	72.1	53%	0.532	35%	0.353	S	S	.	.	S	Bend	trans	-62.8	153.5	172.3	-76.3	-171.9	174.8	-160.9	-7	112.5	P95	R53-P95 VanDerWaalsContact NH1-CG 3.32Å
54	P	93.7	Very high	96.5	Very high	86 Å²	86	71.3 Å²	71.3	56%	0.558	35%	0.349	S	S	*	.	S	Bend	cis	-71.4	138.1	-2.1	30.9	-34.6	0	0	0	111.5
55	H	94.9	Very high	96.5	Very high	16 Å²	16	70.8 Å²	70.8	7%	0.074	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-80.8	146.1	172.4	-51.7	139.4	0	0	0	109.2	E45 Q46 R51	E45-H55 HydrophobicContact CB-CB 4.34Å; Q46-H55 PolarHBondContact OE1-CE1 3.08Å; Q46-H55 PolarHBondContact OE1-ND1 3.15Å; R51-H55 PolarHBondContact O-CD2 2.73Å; R51-H55 PolarHBondContact O-NE2 2.85Å
56	H	96.1	Very high	96.6	Very high	97 Å²	97	72.8 Å²	72.8	45%	0.449	36%	0.358	S	S	.	.			trans	-114.2	165.9	170.5	-62.2	-86.8	0	0	0	109.8	E45	E45-H56 VanDerWaalsContact CD-O 3.3Å; E45-H56 VanDerWaalsContact CG-O 3.31Å; E45-H56 WeakPolarHBondContact CG-O 3.46Å; E45-H56 PolarHBondContact OE2-N 3.23Å
57	W	97.8	Very high	96.7	Very high	17 Å²	17	70.9 Å²	70.9	6%	0.064	35%	0.349	C	S	.	.			trans	-141.5	28.8	-178.3	50.4	78.9	0	0	0	112	L41 G59 E60 V61 D96 R99 Q100 D103	L41-W57 HydrophobicContact CB-CB 4.17Å; L41-W57 HydrophobicContact CB-CG 4.05Å; W57-G59 PolarHBondContact O-N 3.25Å; W57-E60 VanDerWaalsContact CA-OE2 3.23Å; W57-E60 WeakPolarHBondContact CA-OE2 3.48Å; W57-E60 PolarHBondContact O-N 3.48Å; W57-V61 PolarHBondContact O-N 2.9Å; W57-D96 HydrophobicContact CH2-CB 4.18Å; W57-D96 HydrophobicContact CZ3-CB 3.99Å; W57-R99 HydrophobicContact CH2-CB 3.79Å; W57-R99 HydrophobicContact CZ2-CB 3.72Å; W57-Q100 HydrophobicContact CD2-CG 3.84Å; W57-Q100 HydrophobicContact CE3-CG 3.77Å; W57-Q100 HydrophobicContact CH2-CG 3.74Å; W57-Q100 HydrophobicContact CZ2-CB 4.49Å; W57-Q100 HydrophobicContact CZ2-CG 3.82Å; W57-Q100 HydrophobicContact CZ3-CG 3.72Å; W57-D103 WeakPolarHBondContact CZ2-OD2 3.29Å; W57-D103 PolarHBondContact NE1-OD2 3.46Å
58	D	98	Very high	97	Very high	97 Å²	97	64.9 Å²	64.9	52%	0.519	33%	0.326	S	S	.	.	H	α-helix	trans	-60.2	-29.9	178.5	-60.2	-81.5	0	0	0	112.3	K62	D58-K62 WeakPolarHBondContact O-CD 3.42Å; D58-K62 VanDerWaalsContact O-CG 3.25Å; D58-K62 WeakPolarHBondContact O-CG 3.32Å; D58-K62 PolarHBondContact O-N 2.74Å
59	G	98	Very high	97.2	Very high	29 Å²	29	64.6 Å²	64.6	30%	0.299	32%	0.321	S	S	.	.	H	α-helix	trans	-66.5	-53.1	176.4	0	0	0	0	0	111.3	W57 V61 K62 L63	W57-G59 PolarHBondContact O-N 3.25Å; G59-V61 PolarHBondContact O-N 2.83Å; G59-K62 WeakPolarHBondContact O-CB 3.44Å; G59-K62 PolarHBondContact O-N 2.68Å; G59-L63 PolarHBondContact O-N 3.44Å; G59-L63 VanDerWaalsContact O-N 3.12Å
60	E	98.7	Very high	97.3	Very high	3 Å²	3	61 Å²	61	1%	0.014	30%	0.304	C	S	.	.	H	α-helix	trans	-62.5	-41.9	177.6	-60.5	100.3	127	0	0	111.7	L41 G42 L43 Q44 W57 K62 L63 V64 C280	L41-E60 HydrophobicContact CD2-CB 3.42Å; L41-E60 VanDerWaalsContact CD2-CB 3.42Å; G42-E60 PolarHBondContact N-OE1 3.41Å; G42-E60 VanDerWaalsContact N-OE1 3.12Å; L43-E60 PolarHBondContact N-OE1 3.48Å; Q44-E60 VanDerWaalsContact CB-CD 3.49Å; Q44-E60 HydrophobicContact CB-CG 4.3Å; Q44-E60 VanDerWaalsContact CB-OE1 3.22Å; Q44-E60 WeakPolarHBondContact CB-OE1 3.17Å; Q44-E60 PolarHBondContact N-OE1 2.84Å; W57-E60 VanDerWaalsContact CA-OE2 3.23Å; W57-E60 WeakPolarHBondContact CA-OE2 3.48Å; W57-E60 PolarHBondContact O-N 3.48Å; E60-K62 VanDerWaalsContact C-N 3.29Å; E60-K62 PolarHBondContact O-N 3.1Å; E60-L63 PolarHBondContact O-N 3.18Å; E60-V64 WeakPolarHBondContact O-CG2 3.45Å; E60-V64 PolarHBondContact O-N 2.75Å; E60-C280 HydrophobicContact CB-CB 4.13Å; E60-C280 HydrophobicContact CG-CB 3.86Å
61	V	98.8	Very high	97.4	Very high	36 Å²	36	53 Å²	53	22%	0.218	27%	0.269	C	S	.	.	H	α-helix	trans	-55.1	-42.9	173.8	156.6	0	0	0	0	112	L41 W57 G59 S65 D103 V107	L41-V61 HydrophobicContact CD1-CG2 3.89Å; L41-V61 HydrophobicContact CD2-CG2 4.42Å; W57-V61 PolarHBondContact O-N 2.9Å; G59-V61 PolarHBondContact O-N 2.83Å; V61-S65 VanDerWaalsContact O-CB 3.32Å; V61-S65 WeakPolarHBondContact O-CB 3.5Å; V61-S65 PolarHBondContact O-N 3.12Å; V61-D103 HydrophobicContact CG2-CB 4.38Å; V61-V107 HydrophobicContact CB-CG2 4.46Å; V61-V107 HydrophobicContact CG1-CG2 3.79Å; V61-V107 HydrophobicContact CG2-CG2 4.37Å
62	K	98.7	Very high	97.6	Very high	142 Å²	142	49 Å²	49	62%	0.617	26%	0.257	S	S	*	.	H	α-helix	trans	-65.1	-40	176.1	-73.9	166.6	-173.5	168.8	0	112	D58 G59 E60 S65 R66	D58-K62 WeakPolarHBondContact O-CD 3.42Å; D58-K62 VanDerWaalsContact O-CG 3.25Å; D58-K62 WeakPolarHBondContact O-CG 3.32Å; D58-K62 PolarHBondContact O-N 2.74Å; G59-K62 WeakPolarHBondContact O-CB 3.44Å; G59-K62 PolarHBondContact O-N 2.68Å; E60-K62 VanDerWaalsContact C-N 3.29Å; E60-K62 PolarHBondContact O-N 3.1Å; K62-S65 PolarHBondContact O-N 3.06Å; K62-R66 VanDerWaalsContact O-CG 3.3Å; K62-R66 WeakPolarHBondContact O-CG 3.49Å; K62-R66 PolarHBondContact O-N 3.04Å
63	L	98.9	Very high	97.8	Very high	25 Å²	25	48.6 Å²	48.6	13%	0.131	24%	0.241	C	C	.	.	H	α-helix	trans	-67.4	-43.3	179.1	-68.9	171.5	0	0	0	111.8	G59 E60 S65 R66 A67 C280 P288 L313	G59-L63 PolarHBondContact O-N 3.44Å; G59-L63 VanDerWaalsContact O-N 3.12Å; E60-L63 PolarHBondContact O-N 3.18Å; L63-S65 VanDerWaalsContact C-N 3.32Å; L63-S65 PolarHBondContact O-N 3.44Å; L63-R66 WeakPolarHBondContact O-CB 3.37Å; L63-R66 PolarHBondContact O-N 3.17Å; L63-A67 PolarHBondContact O-N 3.42Å; L63-C280 HydrophobicContact CD1-CB 4.33Å; L63-C280 WeakPolarHBondContact CD1-O 3.46Å; L63-P288 HydrophobicContact CD1-CB 4.44Å; L63-P288 HydrophobicContact CD1-CG 4.18Å; L63-P288 HydrophobicContact CD2-CB 4.02Å; L63-P288 HydrophobicContact CD2-CG 4.12Å; L63-L313 HydrophobicContact CB-CD1 4.49Å; L63-L313 HydrophobicContact CD2-CD1 4.1Å
64	V	98.9	Very high	98.1	Very high	4 Å²	4	42.5 Å²	42.5	2%	0.024	22%	0.219	C	C	.	.	H	α-helix	trans	-62.9	-41.4	173.7	-177	0	0	0	0	110.6	P39 L41 E60 R66 A67 V68 L104 V107 L108 V279	P39-V64 HydrophobicContact CB-CG2 3.88Å; L41-V64 HydrophobicContact CD2-CG2 4.1Å; E60-V64 WeakPolarHBondContact O-CG2 3.45Å; E60-V64 PolarHBondContact O-N 2.75Å; V64-R66 VanDerWaalsContact C-N 3.33Å; V64-R66 PolarHBondContact O-N 3.03Å; V64-A67 PolarHBondContact O-N 3.41Å; V64-V68 HydrophobicContact CG1-CG2 4.45Å; V64-V68 WeakPolarHBondContact O-CG2 3.21Å; V64-V68 PolarHBondContact O-N 3.17Å; V64-L104 HydrophobicContact CG1-CD1 4.18Å; V64-L104 HydrophobicContact CG2-CD1 4.44Å; V64-V107 HydrophobicContact CB-CG1 3.97Å; V64-V107 HydrophobicContact CG1-CB 4.42Å; V64-V107 HydrophobicContact CG1-CG1 3.68Å; V64-L108 HydrophobicContact CG1-CD2 4.13Å; V64-V279 HydrophobicContact CG2-CG1 4.43Å
65	S	98.9	Very high	98.3	Very high	39 Å²	39	42.5 Å²	42.5	27%	0.273	22%	0.22	S	C	.	.	H	α-helix	trans	-60.9	-41.1	176.2	-175.5	0	0	0	0	112.2	V61 K62 L63 V68 N69	V61-S65 VanDerWaalsContact O-CB 3.32Å; V61-S65 WeakPolarHBondContact O-CB 3.5Å; V61-S65 PolarHBondContact O-N 3.12Å; K62-S65 PolarHBondContact O-N 3.06Å; L63-S65 VanDerWaalsContact C-N 3.32Å; L63-S65 PolarHBondContact O-N 3.44Å; S65-V68 PolarHBondContact O-N 3.2Å; S65-N69 WeakPolarHBondContact O-CB 3.33Å; S65-N69 VanDerWaalsContact O-CG 3.26Å; S65-N69 PolarHBondContact O-N 2.8Å; S65-N69 PolarHBondContact O-ND2 2.78Å
66	R	98.9	Very high	98.3	Very high	61 Å²	61	46.7 Å²	46.7	23%	0.23	25%	0.249	C	C	.	.	H	α-helix	trans	-61	-47.9	172.8	-72.2	174.5	69.6	-160	3.4	111.6	K62 L63 V64 V68 N69 I70 L313 D314 E317	K62-R66 VanDerWaalsContact O-CG 3.3Å; K62-R66 WeakPolarHBondContact O-CG 3.49Å; K62-R66 PolarHBondContact O-N 3.04Å; L63-R66 WeakPolarHBondContact O-CB 3.37Å; L63-R66 PolarHBondContact O-N 3.17Å; V64-R66 VanDerWaalsContact C-N 3.33Å; V64-R66 PolarHBondContact O-N 3.03Å; R66-V68 PolarHBondContact O-N 3.02Å; R66-N69 PolarHBondContact O-N 3.48Å; R66-I70 WeakPolarHBondContact O-CD1 3.41Å; R66-I70 VanDerWaalsContact O-CG1 3.32Å; R66-I70 WeakPolarHBondContact O-CG1 3.45Å; R66-I70 PolarHBondContact O-N 2.69Å; R66-L313 HydrophobicContact CB-CD1 4.12Å; R66-D314 IonicContact CZ-OD1 2.83Å; R66-D314 IonicContact NH1-OD1 3.67Å; R66-D314 PolarHBondContact NH1-OD1 3.2Å; R66-D314 IonicContact NH2-OD1 2.97Å; R66-D314 PolarHBondContact NH2-OD1 3.47Å; R66-E317 IonicContact CZ-OE1 3.44Å; R66-E317 IonicContact CZ-OE2 4Å; R66-E317 IonicContact NE-OE1 2.69Å; R66-E317 PolarHBondContact NE-OE1 3.44Å; R66-E317 IonicContact NE-OE2 2.83Å; R66-E317 IonicContact NH2-OE1 3.4Å; R66-E317 PolarHBondContact NH2-OE1 2.94Å; R66-E317 IonicContact NH2-OE2 3.84Å; R66-E317 PolarHBondContact NH2-OE2 3.41Å
67	A	98.9	Very high	98.3	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.008	25%	0.247	C	C	.	.	H	α-helix	trans	-58.1	-45.8	176.9	0	0	0	0	0	112.1	L63 V64 N69 I70 V71 V279 I290 L313	L63-A67 PolarHBondContact O-N 3.42Å; V64-A67 PolarHBondContact O-N 3.41Å; A67-N69 PolarHBondContact O-N 2.85Å; A67-I70 PolarHBondContact O-N 3.47Å; A67-V71 VanDerWaalsContact O-CG2 3.29Å; A67-V71 WeakPolarHBondContact O-CG2 3.4Å; A67-V71 PolarHBondContact O-N 2.83Å; A67-V279 HydrophobicContact CB-CG2 3.67Å; A67-I290 HydrophobicContact CB-CG2 4.09Å; A67-L313 HydrophobicContact CB-CD2 3.96Å
68	V	98.9	Very high	98.3	Very high	4 Å²	4	46 Å²	46	2%	0.024	25%	0.245	C	C	.	.	H	α-helix	trans	-59.4	-45.4	175.2	169.2	0	0	0	0	111.4	V64 S65 R66 I70 V71 N72 L108 H110 L111	V64-V68 HydrophobicContact CG1-CG2 4.45Å; V64-V68 WeakPolarHBondContact O-CG2 3.21Å; V64-V68 PolarHBondContact O-N 3.17Å; S65-V68 PolarHBondContact O-N 3.2Å; R66-V68 PolarHBondContact O-N 3.02Å; V68-I70 PolarHBondContact O-N 3.01Å; V68-V71 PolarHBondContact O-N 2.96Å; V68-N72 WeakPolarHBondContact O-CB 3.39Å; V68-N72 VanDerWaalsContact O-CG 3.27Å; V68-N72 PolarHBondContact O-N 2.92Å; V68-N72 PolarHBondContact O-ND2 2.91Å; V68-L108 HydrophobicContact CG2-CD2 4.14Å; V68-H110 HydrophobicContact CG1-CB 4.08Å; V68-L111 HydrophobicContact CG1-CB 4.18Å; V68-L111 HydrophobicContact CG1-CD1 4.45Å
69	N	98.8	Very high	98.3	Very high	82 Å²	82	42.1 Å²	42.1	44%	0.439	23%	0.227	S	C	.	.	H	α-helix	trans	-63.5	-39.8	177.8	-74.9	-36.2	0	0	0	112.7	S65 R66 A67 N72 R73	S65-N69 WeakPolarHBondContact O-CB 3.33Å; S65-N69 VanDerWaalsContact O-CG 3.26Å; S65-N69 PolarHBondContact O-N 2.8Å; S65-N69 PolarHBondContact O-ND2 2.78Å; R66-N69 PolarHBondContact O-N 3.48Å; A67-N69 PolarHBondContact O-N 2.85Å; N69-N72 PolarHBondContact O-N 2.94Å; N69-R73 WeakPolarHBondContact O-CD 3.35Å; N69-R73 VanDerWaalsContact O-CG 3.24Å; N69-R73 WeakPolarHBondContact O-CG 3.45Å; N69-R73 PolarHBondContact O-N 2.87Å
70	I	98.9	Very high	98.3	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-61.6	-52.3	174.1	-73.7	159.4	0	0	0	110.1	R66 A67 V68 N72 R73 L74 I290 L313 L316 E317 L320	R66-I70 WeakPolarHBondContact O-CD1 3.41Å; R66-I70 VanDerWaalsContact O-CG1 3.32Å; R66-I70 WeakPolarHBondContact O-CG1 3.45Å; R66-I70 PolarHBondContact O-N 2.69Å; A67-I70 PolarHBondContact O-N 3.47Å; V68-I70 PolarHBondContact O-N 3.01Å; I70-N72 VanDerWaalsContact C-N 3.26Å; I70-N72 PolarHBondContact O-N 3.01Å; I70-R73 WeakPolarHBondContact O-CA 3.47Å; I70-R73 WeakPolarHBondContact O-CB 3.45Å; I70-R73 PolarHBondContact O-N 3.25Å; I70-L74 PolarHBondContact O-N 3.03Å; I70-I290 HydrophobicContact CG2-CD1 4.01Å; I70-L313 HydrophobicContact CD1-CB 3.85Å; I70-L313 HydrophobicContact CD1-CD2 3.71Å; I70-L313 HydrophobicContact CD1-CG 4.31Å; I70-L316 HydrophobicContact CD1-CB 4.16Å; I70-L316 HydrophobicContact CG1-CB 4.35Å; I70-L316 HydrophobicContact CG2-CB 3.78Å; I70-L316 HydrophobicContact CG2-CD1 3.58Å; I70-L316 HydrophobicContact CG2-CG 4.24Å; I70-E317 HydrophobicContact CD1-CG 3.86Å; I70-E317 HydrophobicContact CG1-CG 3.82Å; I70-L320 HydrophobicContact CB-CD1 4.41Å; I70-L320 HydrophobicContact CG1-CD1 4.48Å; I70-L320 HydrophobicContact CG2-CD1 3.98Å
71	V	98.9	Very high	98.3	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.006	21%	0.213	C	C	.	.	H	α-helix	trans	-57.9	-41.2	179.7	171.6	0	0	0	0	111.3	V34 A67 V68 R73 L74 P78 V81 L111 I115 I290	V34-V71 HydrophobicContact CG1-CG2 4.02Å; V34-V71 HydrophobicContact CG2-CG2 4.24Å; A67-V71 VanDerWaalsContact O-CG2 3.29Å; A67-V71 WeakPolarHBondContact O-CG2 3.4Å; A67-V71 PolarHBondContact O-N 2.83Å; V68-V71 PolarHBondContact O-N 2.96Å; V71-R73 PolarHBondContact O-N 2.87Å; V71-L74 PolarHBondContact O-N 2.98Å; V71-P78 HydrophobicContact CG1-CG 4.23Å; V71-V81 HydrophobicContact CG1-CG2 3.65Å; V71-L111 HydrophobicContact CB-CD1 4.16Å; V71-L111 HydrophobicContact CG1-CD1 3.61Å; V71-I115 HydrophobicContact CG1-CD1 3.91Å; V71-I290 HydrophobicContact CG2-CD1 3.98Å
72	N	98.7	Very high	98.3	Very high	36 Å²	36	39 Å²	39	19%	0.193	20%	0.203	C	C	.	.	H	α-helix	trans	-62.5	-20.3	175.6	-78.5	-18.9	0	0	0	113.9	V68 N69 I70 K77 H110 N112	V68-N72 WeakPolarHBondContact O-CB 3.39Å; V68-N72 VanDerWaalsContact O-CG 3.27Å; V68-N72 PolarHBondContact O-N 2.92Å; V68-N72 PolarHBondContact O-ND2 2.91Å; N69-N72 PolarHBondContact O-N 2.94Å; I70-N72 VanDerWaalsContact C-N 3.26Å; I70-N72 PolarHBondContact O-N 3.01Å; N72-K77 PolarHBondContact O-NZ 2.83Å; N72-H110 PolarHBondContact ND2-O 2.93Å; N72-N112 WeakPolarHBondContact OD1-CB 3.27Å; N72-N112 PolarHBondContact OD1-N 3.27Å
73	R	98.7	Very high	98.3	Very high	102 Å²	102	32.3 Å²	32.3	39%	0.385	17%	0.173	S	C	.	.	H	α-helix	trans	-99.2	-8.1	-179.5	-68.8	167.1	65.2	-173	6.3	113.7	N69 I70 V71 L320 N321 Q325	N69-R73 WeakPolarHBondContact O-CD 3.35Å; N69-R73 VanDerWaalsContact O-CG 3.24Å; N69-R73 WeakPolarHBondContact O-CG 3.45Å; N69-R73 PolarHBondContact O-N 2.87Å; I70-R73 WeakPolarHBondContact O-CA 3.47Å; I70-R73 WeakPolarHBondContact O-CB 3.45Å; I70-R73 PolarHBondContact O-N 3.25Å; V71-R73 PolarHBondContact O-N 2.87Å; R73-L320 HydrophobicContact CB-CD1 3.94Å; R73-L320 HydrophobicContact CB-CD2 4.26Å; R73-L320 VanDerWaalsContact NH2-CB 3.29Å; R73-L320 PolarHBondContact NH2-O 3.34Å; R73-L320 VanDerWaalsContact NH2-O 3.1Å; R73-N321 PolarHBondContact NH1-OD1 2.84Å; R73-N321 PolarHBondContact NH2-OD1 3.47Å; R73-Q325 PolarHBondContact O-NE2 2.61Å
74	L	98.6	Very high	98.3	Very high	13 Å²	13	31.1 Å²	31.1	7%	0.068	17%	0.167	C	C	.	.			trans	-64.5	138.4	175.6	-63.7	177.6	0	0	0	110.9	V34 I70 V71 P76 P78 L292 L320 P326	V34-L74 HydrophobicContact CG2-CD1 3.9Å; I70-L74 PolarHBondContact O-N 3.03Å; V71-L74 PolarHBondContact O-N 2.98Å; L74-P76 CarbonylContact C-O 3.57Å; L74-P78 HydrophobicContact CB-CG 4.28Å; L74-P78 HydrophobicContact CD1-CG 3.77Å; L74-L292 HydrophobicContact CD1-CD2 3.91Å; L74-L320 HydrophobicContact CD2-CD2 4.49Å; L74-P326 HydrophobicContact CD2-CG 3.65Å
75	C	97.1	Very high	98.3	Very high	87 Å²	87	30.9 Å²	30.9	59%	0.588	17%	0.166	S	C	*	.	S	Bend	trans	-138.4	120.2	178.7	-169.9	0	0	0	0	109.9	Q325	C75-Q325 HydrophobicContact CB-CG 4.26Å; C75-Q325 WeakPolarHBondContact O-CG 3.18Å; C75-Q325 PolarHBondContact O-OE1 2.99Å
76	P	95	Very high	98.3	Very high	104 Å²	104	29.1 Å²	29.1	68%	0.675	15%	0.154	S	C	*	.	S	Bend	cis	-62.7	162.3	-1.7	29.8	-36.3	0	0	0	112.2	L74	L74-P76 CarbonylContact C-O 3.57Å
77	K	96.6	Very high	98.3	Very high	92 Å²	92	26.2 Å²	26.2	40%	0.4	14%	0.143	S	C	.	.	P	Polyproline II helix	trans	-61.4	138.6	174.9	-68.4	-70.7	-175.3	170.2	0	109.5	N72 I115	N72-K77 PolarHBondContact O-NZ 2.83Å; K77-I115 HydrophobicContact CD-CD1 3.97Å; K77-I115 HydrophobicContact CD-CG1 4.27Å
78	P	97.9	Very high	98.3	Very high	6 Å²	6	26.2 Å²	26.2	4%	0.039	14%	0.143	C	C	.	.	P	Polyproline II helix	trans	-57.6	140.5	170.9	-24.5	35.4	0	0	0	110.7	C32 V34 V71 L74 F80 I115	C32-P78 CarbonylContact O-C 3.57Å; C32-P78 WeakPolarHBondContact O-CA 3.38Å; V34-P78 HydrophobicContact CG2-CB 3.93Å; V34-P78 HydrophobicContact CG2-CG 3.63Å; V71-P78 HydrophobicContact CG1-CG 4.23Å; L74-P78 HydrophobicContact CB-CG 4.28Å; L74-P78 HydrophobicContact CD1-CG 3.77Å; P78-F80 PolarHBondContact O-N 2.91Å; P78-I115 HydrophobicContact CB-CG2 4.48Å
79	A	96.9	Very high	98.3	Very high	16 Å²	16	26.2 Å²	26.2	13%	0.132	14%	0.142	C	C	.	.	S	Bend	trans	-59.6	-32.3	174.7	0	0	0	0	0	112.3	F31 C32 P116 F151	F31-A79 HydrophobicContact CB-CB 4.48Å; F31-A79 HydrophobicContact CD2-CB 3.84Å; C32-A79 WeakPolarHBondContact O-CB 3.41Å; C32-A79 PolarHBondContact O-N 3.03Å; A79-P116 VanDerWaalsContact O-CD 3.31Å; A79-P116 WeakPolarHBondContact O-CD 3.48Å; A79-F151 HydrophobicContact CB-CD1 3.99Å; A79-F151 HydrophobicContact CB-CE1 3.39Å; A79-F151 HydrophobicContact CB-CE2 4.08Å; A79-F151 HydrophobicContact CB-CZ 3.45Å; A79-F151 VanDerWaalsContact CB-CZ 3.45Å
80	F	98.7	Very high	98.2	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.124	C	C	.	.			trans	-165	166.2	171.3	56.6	-90.2	0	0	0	109.9	L21 F31 F33 V34 P78 I82 P116 I118 F149 F156 F198	L21-F80 HydrophobicContact CD1-CD1 4.34Å; F31-F80 HydrophobicContact CE2-CE1 4.34Å; F33-F80 WeakPolarHBondContact CA-O 3.41Å; F33-F80 HydrophobicContact CB-CD1 4.04Å; F33-F80 HydrophobicContact CB-CD2 3.83Å; F33-F80 HydrophobicContact CB-CE1 3.79Å; F33-F80 HydrophobicContact CB-CE2 3.58Å; F33-F80 HydrophobicContact CB-CG 4.05Å; F33-F80 HydrophobicContact CB-CZ 3.55Å; F33-F80 WeakPolarHBondContact CB-O 3.46Å; F33-F80 HydrophobicContact CD1-CE1 4.11Å; F33-F80 HydrophobicContact CD1-CE2 4.34Å; F33-F80 AromaticContact CD1-CZ 3.67Å; F33-F80 HydrophobicContact CD1-CZ 3.67Å; F33-F80 AromaticContact CD2-CE2 3.67Å; F33-F80 HydrophobicContact CD2-CE2 3.67Å; F33-F80 AromaticContact CD2-CZ 3.83Å; F33-F80 HydrophobicContact CD2-CZ 3.83Å; F33-F80 HydrophobicContact CE1-CZ 4.27Å; F33-F80 HydrophobicContact CE2-CE2 4.42Å; F33-F80 HydrophobicContact CE2-CZ 4.42Å; F33-F80 HydrophobicContact CG-CD2 4.37Å; F33-F80 HydrophobicContact CG-CE1 4.02Å; F33-F80 AromaticContact CG-CE2 3.61Å; F33-F80 HydrophobicContact CG-CE2 3.61Å; F33-F80 AromaticContact CG-CZ 3.4Å; F33-F80 HydrophobicContact CG-CZ 3.4Å; V34-F80 PolarHBondContact N-O 3.19Å; V34-F80 VanDerWaalsContact N-O 3.09Å; P78-F80 PolarHBondContact O-N 2.91Å; F80-I82 HydrophobicContact CD2-CB 4.37Å; F80-I82 HydrophobicContact CE2-CB 4.43Å; F80-I82 HydrophobicContact CE2-CG2 4.27Å; F80-P116 CarbonylContact C-O 3.6Å; F80-P116 VanDerWaalsContact CA-O 3.26Å; F80-P116 WeakPolarHBondContact CA-O 3.27Å; F80-P116 HydrophobicContact CB-CB 3.99Å; F80-P116 WeakPolarHBondContact CB-O 3.29Å; F80-I118 HydrophobicContact CB-CD1 4.15Å; F80-I118 HydrophobicContact CD2-CD1 4Å; F80-I118 HydrophobicContact CG-CD1 4.11Å; F80-F149 HydrophobicContact CD1-CE2 4.25Å; F80-F149 HydrophobicContact CD2-CZ 4.47Å; F80-F149 AromaticContact CE1-CE2 3.95Å; F80-F149 HydrophobicContact CE1-CE2 3.95Å; F80-F149 HydrophobicContact CE1-CZ 4.44Å; F80-F149 HydrophobicContact CE2-CE2 4.37Å; F80-F149 HydrophobicContact CE2-CZ 4.07Å; F80-F149 HydrophobicContact CZ-CE2 4.02Å; F80-F149 HydrophobicContact CZ-CZ 4.06Å; F80-F156 HydrophobicContact CE1-CD2 4.42Å; F80-F156 HydrophobicContact CE1-CE1 4.49Å; F80-F156 AromaticContact CE1-CE2 3.86Å; F80-F156 HydrophobicContact CE1-CE2 3.86Å; F80-F156 AromaticContact CE1-CZ 3.88Å; F80-F156 HydrophobicContact CE1-CZ 3.88Å; F80-F156 HydrophobicContact CZ-CD1 4.22Å; F80-F156 HydrophobicContact CZ-CD2 4.32Å; F80-F156 AromaticContact CZ-CE1 3.81Å; F80-F156 HydrophobicContact CZ-CE1 3.81Å; F80-F156 AromaticContact CZ-CE2 3.95Å; F80-F156 HydrophobicContact CZ-CE2 3.95Å; F80-F156 HydrophobicContact CZ-CG 4.43Å; F80-F156 AromaticContact CZ-CZ 3.66Å; F80-F156 HydrophobicContact CZ-CZ 3.66Å; F80-F198 HydrophobicContact CE2-CE2 4.17Å; F80-F198 HydrophobicContact CE2-CZ 4.17Å; F80-F198 HydrophobicContact CZ-CE2 4.39Å; F80-F198 HydrophobicContact CZ-CZ 4.46Å
81	V	98.9	Very high	98.1	Very high	3 Å²	3	26 Å²	26	2%	0.018	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	137.9	164.2	176.4	0	0	0	0	107.4	V34 I36 V71 L111 I115 P116 L117 I118	V34-V81 HydrophobicContact CB-CG2 4.13Å; V34-V81 CarbonylContact O-C 3.55Å; V34-V81 WeakPolarHBondContact O-CA 3.49Å; I36-V81 HydrophobicContact CD1-CG1 3.78Å; I36-V81 HydrophobicContact CG1-CG1 4.12Å; V71-V81 HydrophobicContact CG1-CG2 3.65Å; V81-L111 HydrophobicContact CB-CD2 4.41Å; V81-L111 HydrophobicContact CG2-CD1 4.39Å; V81-L111 HydrophobicContact CG2-CD2 4.13Å; V81-I115 HydrophobicContact CG2-CG2 3.75Å; V81-P116 PolarHBondContact N-O 2.91Å; V81-L117 HydrophobicContact CB-CD1 4.11Å; V81-L117 HydrophobicContact CG1-CD1 3.91Å; V81-I118 PolarHBondContact O-N 3.14Å
82	I	98.9	Very high	98	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	133.2	168.9	-169.7	164.4	0	0	0	111.7	V34 V35 I36 F80 I118 L120 V158 F198	V34-I82 PolarHBondContact O-N 2.81Å; V35-I82 WeakPolarHBondContact CA-O 3.12Å; V35-I82 HydrophobicContact CB-CG2 4.48Å; V35-I82 HydrophobicContact CG2-CG2 3.92Å; I36-I82 PolarHBondContact N-O 3.33Å; F80-I82 HydrophobicContact CD2-CB 4.37Å; F80-I82 HydrophobicContact CE2-CB 4.43Å; F80-I82 HydrophobicContact CE2-CG2 4.27Å; I82-I118 CarbonylContact C-O 3.58Å; I82-I118 VanDerWaalsContact CA-O 3.25Å; I82-I118 WeakPolarHBondContact CA-O 3.26Å; I82-I118 HydrophobicContact CB-CB 4.24Å; I82-I118 HydrophobicContact CD1-CB 4.27Å; I82-I118 HydrophobicContact CD1-CG2 3.82Å; I82-I118 HydrophobicContact CG1-CB 4.04Å; I82-I118 HydrophobicContact CG1-CG2 4.03Å; I82-L120 HydrophobicContact CD1-CD2 4.31Å; I82-V158 HydrophobicContact CD1-CG2 4.2Å; I82-F198 HydrophobicContact CD1-CB 3.78Å; I82-F198 HydrophobicContact CD1-CD1 4.1Å; I82-F198 HydrophobicContact CD1-CD2 3.49Å; I82-F198 VanDerWaalsContact CD1-CD2 3.49Å; I82-F198 HydrophobicContact CD1-CE2 3.99Å; I82-F198 HydrophobicContact CD1-CG 3.55Å; I82-F198 HydrophobicContact CG2-CD1 3.94Å; I82-F198 HydrophobicContact CG2-CE1 3.65Å; I82-F198 HydrophobicContact CG2-CE2 4.25Å; I82-F198 HydrophobicContact CG2-CG 4.45Å; I82-F198 HydrophobicContact CG2-CZ 3.82Å
83	I	99	Very high	97.8	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.005	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	119.8	175.4	-49.9	-177.5	0	0	0	109.7	I36 P39 G85 L87 L108 L117 I118 V119 L120	I36-I83 HydrophobicContact CB-CG1 4.15Å; I36-I83 HydrophobicContact CG2-CG1 4.4Å; I36-I83 HydrophobicContact CG2-CG2 4.29Å; I36-I83 CarbonylContact O-C 3.53Å; I36-I83 VanDerWaalsContact O-CA 3.29Å; I36-I83 WeakPolarHBondContact O-CA 3.38Å; P39-I83 HydrophobicContact CG-CD1 4.5Å; P39-I83 HydrophobicContact CG-CG2 3.63Å; I83-G85 PolarHBondContact O-N 2.92Å; I83-G85 VanDerWaalsContact O-N 3.14Å; I83-L87 HydrophobicContact CB-CD2 3.97Å; I83-L87 HydrophobicContact CG2-CD2 3.53Å; I83-L108 HydrophobicContact CD1-CD1 3.9Å; I83-L108 HydrophobicContact CD1-CD2 3.93Å; I83-L117 HydrophobicContact CD1-CD1 3.92Å; I83-L117 HydrophobicContact CG1-CD1 3.95Å; I83-I118 PolarHBondContact N-O 3Å; I83-V119 HydrophobicContact CB-CG1 4.2Å; I83-V119 HydrophobicContact CD1-CG1 4.29Å; I83-V119 HydrophobicContact CG1-CG1 4.35Å; I83-L120 PolarHBondContact O-N 3.42Å
84	C	98.8	Very high	97.7	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	64.5	-174.8	-66.6	0	0	0	0	113.6	I36 A37 H200	I36-C84 PolarHBondContact O-N 2.71Å; A37-C84 HydrophobicContact CB-CB 4.44Å; C84-H200 PolarHBondContact O-ND1 3Å
85	G	98.8	Very high	97.6	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	19%	0.194	C	C	.	.	S	Bend	trans	71.7	177.3	171.2	0	0	0	0	0	115.4	D38 I83 L87 L120 H200	D38-G85 WeakPolarHBondContact CA-O 3Å; D38-G85 PolarHBondContact N-O 2.87Å; I83-G85 PolarHBondContact O-N 2.92Å; I83-G85 VanDerWaalsContact O-N 3.14Å; G85-L87 VanDerWaalsContact C-N 3.34Å; G85-L87 PolarHBondContact O-N 3.05Å; G85-L120 WeakPolarHBondContact CA-O 3.42Å; G85-L120 PolarHBondContact N-O 2.97Å; G85-H200 WeakPolarHBondContact CA-ND1 3.25Å
86	D	98.8	Very high	97.5	Very high	2 Å²	2	25.4 Å²	25.4	1%	0.011	17%	0.168	C	C	.	.			trans	46.5	58.6	-170.9	-77.5	7.5	0	0	0	110.8	D38 Q40 V88 G122 N123 H124 D125 H200	D38-D86 HydrophobicContact CB-CB 4.4Å; Q40-D86 WeakPolarHBondContact CA-O 3.45Å; Q40-D86 HydrophobicContact CB-CB 4.3Å; Q40-D86 WeakPolarHBondContact CB-O 3.47Å; Q40-D86 HydrophobicContact CG-CB 4.06Å; Q40-D86 PolarHBondContact N-O 3.33Å; Q40-D86 PolarHBondContact NE2-OD2 2.91Å; D86-V88 VanDerWaalsContact C-N 3.29Å; D86-V88 PolarHBondContact O-N 2.95Å; D86-G122 VanDerWaalsContact OD1-C 3.25Å; D86-G122 VanDerWaalsContact OD1-CA 3.3Å; D86-G122 WeakPolarHBondContact OD1-CA 3.48Å; D86-N123 PolarHBondContact OD1-N 2.86Å; D86-H124 HydrophobicContact CB-CB 4.36Å; D86-H124 WeakPolarHBondContact OD1-CB 3.39Å; D86-H124 IonicContact OD1-CD2 3.59Å; D86-H124 IonicContact OD1-CG 2.67Å; D86-H124 PolarHBondContact OD1-N 2.74Å; D86-H124 IonicContact OD2-CD2 3.43Å; D86-H124 PolarHBondContact OD2-CD2 2.87Å; D86-H124 IonicContact OD2-CG 3.87Å; D86-H124 IonicContact OD2-NE2 2.67Å; D86-D125 WeakPolarHBondContact CA-OD2 3.28Å; D86-D125 PolarHBondContact N-OD2 3.44Å; D86-H200 IonicContact OD1-CE1 3.53Å; D86-H200 PolarHBondContact OD1-CE1 3.32Å; D86-H200 IonicContact OD1-NE2 2.67Å; D86-H200 PolarHBondContact OD1-NE2 3.43Å; D86-H200 IonicContact OD2-CE1 2.71Å; D86-H200 IonicContact OD2-NE2 3.77Å
87	L	98.8	Very high	97.6	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	14%	0.139	C	C	.	.			trans	-61.8	-43.5	-179.2	-56.6	178.1	0	0	0	109.7	Q40 I83 G85 L104 V119 D125 Y138 W142	Q40-L87 PolarHBondContact N-O 2.83Å; I83-L87 HydrophobicContact CB-CD2 3.97Å; I83-L87 HydrophobicContact CG2-CD2 3.53Å; G85-L87 VanDerWaalsContact C-N 3.34Å; G85-L87 PolarHBondContact O-N 3.05Å; L87-L104 HydrophobicContact CB-CD2 3.68Å; L87-L104 VanDerWaalsContact O-CD2 3.3Å; L87-L104 WeakPolarHBondContact O-CD2 3.46Å; L87-V119 HydrophobicContact CD1-CB 4.15Å; L87-V119 HydrophobicContact CD1-CG1 4.45Å; L87-V119 HydrophobicContact CD1-CG2 4.33Å; L87-V119 HydrophobicContact CD2-CB 4.22Å; L87-V119 HydrophobicContact CD2-CG1 4.15Å; L87-D125 WeakPolarHBondContact CB-OD1 3.41Å; L87-D125 PolarHBondContact N-OD1 2.9Å; L87-D125 PolarHBondContact N-OD2 2.87Å; L87-Y138 HydrophobicContact CD1-CE2 4.1Å; L87-W142 HydrophobicContact CB-CZ2 4.43Å; L87-W142 HydrophobicContact CD1-CD2 3.65Å; L87-W142 VanDerWaalsContact CD1-CE2 3.49Å; L87-W142 HydrophobicContact CD1-CE3 4.05Å; L87-W142 HydrophobicContact CD1-CG 4.08Å; L87-W142 HydrophobicContact CD1-CH2 4.14Å; L87-W142 HydrophobicContact CD1-CZ2 3.75Å; L87-W142 HydrophobicContact CD1-CZ3 4.28Å
88	V	98.5	Very high	97.6	Very high	1 Å²	1	18.6 Å²	18.6	1%	0.006	13%	0.132	C	C	.	.	B	Isolated β-bridge	trans	-132.4	156.2	178.9	-61.6	0	0	0	0	111	D86 R97 Q100 L104 H124	D86-V88 VanDerWaalsContact C-N 3.29Å; D86-V88 PolarHBondContact O-N 2.95Å; V88-R97 HydrophobicContact CG2-CG 4.46Å; V88-Q100 HydrophobicContact CB-CB 3.77Å; V88-Q100 HydrophobicContact CG1-CB 3.71Å; V88-L104 HydrophobicContact CG1-CB 4.41Å; V88-L104 HydrophobicContact CG1-CD2 4.09Å; V88-H124 VanDerWaalsContact O-CB 3.25Å; V88-H124 WeakPolarHBondContact O-CB 3.46Å
89	N	98.3	Very high	97.5	Very high	4 Å²	4	24.2 Å²	24.2	2%	0.021	15%	0.152	C	C	.	.	S	Bend	trans	-79.7	-37.9	-175.6	-179.9	61.4	0	0	0	113.9	Q40 L41 G42 L43 Q46 Q91 H124	Q40-N89 HydrophobicContact CG-CB 4Å; L41-N89 WeakPolarHBondContact O-CB 3.41Å; L41-N89 PolarHBondContact O-N 2.96Å; G42-N89 PolarHBondContact O-ND2 2.95Å; L43-N89 HydrophobicContact CB-CB 4.42Å; L43-N89 WeakPolarHBondContact CD1-OD1 3.2Å; Q46-N89 PolarHBondContact OE1-ND2 3.46Å; N89-Q91 PolarHBondContact O-N 2.75Å; N89-H124 PolarHBondContact O-ND1 3.31Å
90	D	97.4	Very high	97.5	Very high	9 Å²	9	23.5 Å²	23.5	5%	0.048	15%	0.146	C	C	.	.	S	Bend	trans	-73	118	-178.1	-97.1	28.2	0	0	0	110.6	G94 P95 D96 R97	D90-G94 VanDerWaalsContact OD2-C 3.31Å; D90-G94 WeakPolarHBondContact OD2-CA 3.11Å; D90-P95 VanDerWaalsContact OD2-CD 3.26Å; D90-P95 WeakPolarHBondContact OD2-CD 3.37Å; D90-D96 HydrophobicContact CB-CB 4.46Å; D90-D96 WeakPolarHBondContact OD2-CB 3.23Å; D90-D96 PolarHBondContact OD2-N 2.95Å; D90-R97 HydrophobicContact CB-CB 3.89Å; D90-R97 PolarHBondContact O-NH1 3.29Å
91	Q	97.1	Very high	97.5	Very high	70 Å²	70	23.9 Å²	23.9	33%	0.327	15%	0.148	S	C	.	.	P	Polyproline II helix	trans	-56.8	163.8	174.2	-78.9	-174.5	-1	0	0	112.6	N89 G93 G94 H124 N128	N89-Q91 PolarHBondContact O-N 2.75Å; Q91-G93 PolarHBondContact O-N 3.4Å; Q91-G94 WeakPolarHBondContact O-CA 3.46Å; Q91-G94 PolarHBondContact O-N 3.33Å; Q91-H124 WeakPolarHBondContact CA-O 3.33Å; Q91-N128 PolarHBondContact NE2-ND2 3Å
92	P	96.8	Very high	97.4	Very high	27 Å²	27	26.2 Å²	26.2	18%	0.175	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46	128.9	172.8	-30.2	36.5	0	0	0	112.5	G94 D134	P92-G94 VanDerWaalsContact C-N 3.31Å; P92-G94 PolarHBondContact O-N 2.91Å; P92-D134 HydrophobicContact CB-CB 4.16Å; P92-D134 VanDerWaalsContact CB-OD1 3.23Å; P92-D134 WeakPolarHBondContact CB-OD1 3.29Å; P92-D134 HydrophobicContact CG-CB 3.98Å
93	G	95.1	Very high	97.4	Very high	82 Å²	82	29.1 Å²	29.1	85%	0.845	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.1	-1.7	-174.9	0	0	0	0	0	116	Q91	Q91-G93 PolarHBondContact O-N 3.4Å
94	G	95.8	Very high	97.4	Very high	22 Å²	22	29.1 Å²	29.1	23%	0.227	18%	0.18	C	C	.	.			trans	-66.2	142.2	173.8	0	0	0	0	0	112.6	D90 Q91 P92 D96 R97	D90-G94 VanDerWaalsContact OD2-C 3.31Å; D90-G94 WeakPolarHBondContact OD2-CA 3.11Å; Q91-G94 WeakPolarHBondContact O-CA 3.46Å; Q91-G94 PolarHBondContact O-N 3.33Å; P92-G94 VanDerWaalsContact C-N 3.31Å; P92-G94 PolarHBondContact O-N 2.91Å; G94-D96 VanDerWaalsContact C-N 3.29Å; G94-D96 PolarHBondContact O-N 3.43Å; G94-R97 WeakPolarHBondContact O-CB 3.33Å; G94-R97 PolarHBondContact O-N 3.05Å
95	P	95.5	Very high	97.3	Very high	86 Å²	86	29.3 Å²	29.3	56%	0.558	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-23.7	-174.7	27.2	-34.8	0	0	0	114.2	R53 D90	R53-P95 VanDerWaalsContact NH1-CG 3.32Å; D90-P95 VanDerWaalsContact OD2-CD 3.26Å; D90-P95 WeakPolarHBondContact OD2-CD 3.37Å
96	D	96.7	Very high	97.3	Very high	8 Å²	8	33.9 Å²	33.9	4%	0.043	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-9.6	-177.9	-60.1	-37.1	0	0	0	112.6	W57 D90 G94 C98 R99 Q100	W57-D96 HydrophobicContact CH2-CB 4.18Å; W57-D96 HydrophobicContact CZ3-CB 3.99Å; D90-D96 HydrophobicContact CB-CB 4.46Å; D90-D96 WeakPolarHBondContact OD2-CB 3.23Å; D90-D96 PolarHBondContact OD2-N 2.95Å; G94-D96 VanDerWaalsContact C-N 3.29Å; G94-D96 PolarHBondContact O-N 3.43Å; D96-C98 VanDerWaalsContact C-N 3.34Å; D96-C98 PolarHBondContact O-N 3.24Å; D96-R99 PolarHBondContact O-N 3.37Å; D96-R99 IonicContact OD1-CZ 3.59Å; D96-R99 IonicContact OD1-NE 3.87Å; D96-R99 IonicContact OD1-NH2 2.61Å; D96-R99 PolarHBondContact OD1-NH2 3.3Å; D96-Q100 HydrophobicContact CB-CG 4.4Å; D96-Q100 WeakPolarHBondContact O-CG 3.48Å; D96-Q100 PolarHBondContact O-N 3.46Å
97	R	96.2	Very high	97.3	Very high	19 Å²	19	34.2 Å²	34.2	7%	0.072	21%	0.208	C	C	.	.	H	α-helix	trans	-51.4	-47.4	-175.4	-176.3	178.5	-179.5	85.9	-4.5	113.3	V88 D90 G94 R99 T101 H124 D125 D137	V88-R97 HydrophobicContact CG2-CG 4.46Å; D90-R97 HydrophobicContact CB-CB 3.89Å; D90-R97 PolarHBondContact O-NH1 3.29Å; G94-R97 WeakPolarHBondContact O-CB 3.33Å; G94-R97 PolarHBondContact O-N 3.05Å; R97-R99 PolarHBondContact O-N 2.65Å; R97-T101 VanDerWaalsContact O-CB 3.25Å; R97-T101 WeakPolarHBondContact O-CB 3.12Å; R97-T101 PolarHBondContact O-N 2.67Å; R97-T101 PolarHBondContact O-OG1 3.36Å; R97-H124 PolarHBondContact NH1-O 2.79Å; R97-D125 PolarHBondContact NH1-O 2.88Å; R97-D125 PolarHBondContact NH2-O 2.83Å; R97-D137 IonicContact CZ-OD2 3.19Å; R97-D137 IonicContact NE-OD2 2.82Å; R97-D137 PolarHBondContact NE-OD2 2.78Å; R97-D137 IonicContact NH2-OD2 2.71Å; R97-D137 PolarHBondContact NH2-OD2 3.17Å
98	C	96	Very high	97.3	Very high	35 Å²	35	34.3 Å²	34.3	24%	0.236	21%	0.208	C	C	.	.	H	α-helix	trans	-61.2	-44.7	-179.1	-175.7	0	0	0	0	111.4	D96 T101 S102	D96-C98 VanDerWaalsContact C-N 3.34Å; D96-C98 PolarHBondContact O-N 3.24Å; C98-T101 PolarHBondContact O-N 2.81Å; C98-S102 WeakPolarHBondContact O-CB 3.19Å; C98-S102 PolarHBondContact O-N 3.14Å
99	R	96.6	Very high	97.2	Very high	124 Å²	124	35.8 Å²	35.8	47%	0.468	22%	0.219	S	C	.	.	H	α-helix	trans	-70.9	-44.5	-178.8	-63.3	-171.9	-71.5	160.8	-4.2	111.7	W57 D96 R97 T101 S102 D103	W57-R99 HydrophobicContact CH2-CB 3.79Å; W57-R99 HydrophobicContact CZ2-CB 3.72Å; D96-R99 PolarHBondContact O-N 3.37Å; D96-R99 IonicContact OD1-CZ 3.59Å; D96-R99 IonicContact OD1-NE 3.87Å; D96-R99 IonicContact OD1-NH2 2.61Å; D96-R99 PolarHBondContact OD1-NH2 3.3Å; R97-R99 PolarHBondContact O-N 2.65Å; R99-T101 VanDerWaalsContact C-N 3.28Å; R99-T101 PolarHBondContact O-N 3.34Å; R99-S102 PolarHBondContact O-N 3.41Å; R99-D103 PolarHBondContact O-N 3.22Å
100	Q	97.9	Very high	97.2	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-59.4	-41.5	173.8	-67.8	167.4	-1.4	0	0	111.4	L41 W57 V88 D96 L104	L41-Q100 HydrophobicContact CB-CB 4.35Å; L41-Q100 HydrophobicContact CB-CG 4.44Å; L41-Q100 WeakPolarHBondContact O-CG 3.05Å; L41-Q100 PolarHBondContact O-NE2 3.44Å; L41-Q100 PolarHBondContact O-OE1 2.68Å; W57-Q100 HydrophobicContact CD2-CG 3.84Å; W57-Q100 HydrophobicContact CE3-CG 3.77Å; W57-Q100 HydrophobicContact CH2-CG 3.74Å; W57-Q100 HydrophobicContact CZ2-CB 4.49Å; W57-Q100 HydrophobicContact CZ2-CG 3.82Å; W57-Q100 HydrophobicContact CZ3-CG 3.72Å; V88-Q100 HydrophobicContact CB-CB 3.77Å; V88-Q100 HydrophobicContact CG1-CB 3.71Å; D96-Q100 HydrophobicContact CB-CG 4.4Å; D96-Q100 WeakPolarHBondContact O-CG 3.48Å; D96-Q100 PolarHBondContact O-N 3.46Å; Q100-L104 VanDerWaalsContact O-CB 3.3Å; Q100-L104 WeakPolarHBondContact O-CB 3.45Å; Q100-L104 PolarHBondContact O-N 3.17Å
101	T	98	Very high	97.3	Very high	7 Å²	7	40.6 Å²	40.6	4%	0.043	24%	0.241	C	C	.	.	H	α-helix	trans	-65.5	-44.4	178.4	-60.3	0	0	0	0	111.1	V4 R97 C98 R99 L104 L105 V141 W142	V4-T101 HydrophobicContact CG1-CG2 4.39Å; V4-T101 HydrophobicContact CG2-CG2 4.22Å; R97-T101 VanDerWaalsContact O-CB 3.25Å; R97-T101 WeakPolarHBondContact O-CB 3.12Å; R97-T101 PolarHBondContact O-N 2.67Å; R97-T101 PolarHBondContact O-OG1 3.36Å; C98-T101 PolarHBondContact O-N 2.81Å; R99-T101 VanDerWaalsContact C-N 3.28Å; R99-T101 PolarHBondContact O-N 3.34Å; T101-L104 PolarHBondContact O-N 3.03Å; T101-L105 HydrophobicContact CG2-CD1 4.06Å; T101-L105 WeakPolarHBondContact O-CB 3.38Å; T101-L105 WeakPolarHBondContact O-CG 3.39Å; T101-L105 PolarHBondContact O-N 3.32Å; T101-V141 HydrophobicContact CG2-CG1 4Å; T101-W142 HydrophobicContact CG2-CZ2 3.87Å
102	S	97.3	Very high	97.3	Very high	52 Å²	52	39.7 Å²	39.7	36%	0.364	24%	0.238	S	C	.	.	H	α-helix	trans	-60.9	-48.8	176.8	-172.2	0	0	0	0	111.7	C98 R99 L104 L105 D106	C98-S102 WeakPolarHBondContact O-CB 3.19Å; C98-S102 PolarHBondContact O-N 3.14Å; R99-S102 PolarHBondContact O-N 3.41Å; S102-L104 PolarHBondContact O-N 3.08Å; S102-L105 PolarHBondContact O-N 3.04Å; S102-D106 WeakPolarHBondContact O-CB 3.48Å; S102-D106 PolarHBondContact O-N 3.16Å
103	D	97.9	Very high	97.3	Very high	62 Å²	62	41.9 Å²	41.9	33%	0.332	25%	0.254	S	S	.	.	H	α-helix	trans	-68	-35.9	-178.6	-68.5	-14.1	0	0	0	111.8	L41 W57 V61 R99 D106 V107	L41-D103 HydrophobicContact CD1-CB 4.38Å; W57-D103 WeakPolarHBondContact CZ2-OD2 3.29Å; W57-D103 PolarHBondContact NE1-OD2 3.46Å; V61-D103 HydrophobicContact CG2-CB 4.38Å; R99-D103 PolarHBondContact O-N 3.22Å; D103-D106 PolarHBondContact O-N 3.35Å; D103-V107 WeakPolarHBondContact O-CG2 3.31Å; D103-V107 PolarHBondContact O-N 3.29Å
104	L	98.5	Very high	97.4	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-64	-47.1	173.5	-177.6	65.3	0	0	0	111.4	P39 L41 V64 L87 V88 Q100 T101 S102 D106 V107 L108 W142	P39-L104 HydrophobicContact CB-CD1 4.11Å; L41-L104 HydrophobicContact CD1-CB 3.71Å; L41-L104 HydrophobicContact CD1-CD1 4.22Å; L41-L104 HydrophobicContact CG-CB 4.38Å; L41-L104 HydrophobicContact CG-CD1 4.3Å; V64-L104 HydrophobicContact CG1-CD1 4.18Å; V64-L104 HydrophobicContact CG2-CD1 4.44Å; L87-L104 HydrophobicContact CB-CD2 3.68Å; L87-L104 VanDerWaalsContact O-CD2 3.3Å; L87-L104 WeakPolarHBondContact O-CD2 3.46Å; V88-L104 HydrophobicContact CG1-CB 4.41Å; V88-L104 HydrophobicContact CG1-CD2 4.09Å; Q100-L104 VanDerWaalsContact O-CB 3.3Å; Q100-L104 WeakPolarHBondContact O-CB 3.45Å; Q100-L104 PolarHBondContact O-N 3.17Å; T101-L104 PolarHBondContact O-N 3.03Å; S102-L104 PolarHBondContact O-N 3.08Å; L104-D106 VanDerWaalsContact C-N 3.29Å; L104-D106 PolarHBondContact O-N 2.67Å; L104-V107 PolarHBondContact O-N 3.35Å; L104-L108 HydrophobicContact CD1-CD1 3.89Å; L104-L108 HydrophobicContact CD1-CG 4.15Å; L104-L108 HydrophobicContact CD2-CD1 4.24Å; L104-L108 HydrophobicContact CG-CD1 3.66Å; L104-L108 HydrophobicContact CG-CG 4.29Å; L104-L108 WeakPolarHBondContact O-CB 3.49Å; L104-L108 WeakPolarHBondContact O-CG 3.12Å; L104-L108 PolarHBondContact O-N 2.99Å; L104-W142 HydrophobicContact CD2-CH2 4.06Å; L104-W142 HydrophobicContact CD2-CZ2 4.39Å
105	L	98.3	Very high	97.5	Very high	4 Å²	4	43.1 Å²	43.1	2%	0.021	24%	0.236	C	C	.	.	H	α-helix	trans	-61.4	-38.1	177	-78.9	168.7	0	0	0	111.9	V4 I6 C8 L11 T101 S102 L108 S109 V141 W142	V4-L105 HydrophobicContact CG1-CD1 3.71Å; I6-L105 HydrophobicContact CG1-CD1 4.38Å; I6-L105 HydrophobicContact CG2-CD2 4.4Å; C8-L105 HydrophobicContact CB-CD2 4.15Å; L11-L105 HydrophobicContact CD2-CD2 4.03Å; T101-L105 HydrophobicContact CG2-CD1 4.06Å; T101-L105 WeakPolarHBondContact O-CB 3.38Å; T101-L105 WeakPolarHBondContact O-CG 3.39Å; T101-L105 PolarHBondContact O-N 3.32Å; S102-L105 PolarHBondContact O-N 3.04Å; L105-L108 PolarHBondContact O-N 2.87Å; L105-S109 WeakPolarHBondContact O-CB 3.39Å; L105-S109 PolarHBondContact O-N 3.05Å; L105-V141 HydrophobicContact CD1-CG1 4.04Å; L105-W142 HydrophobicContact CD1-CH2 4.47Å; L105-W142 HydrophobicContact CD2-CE3 4.42Å; L105-W142 HydrophobicContact CD2-CH2 3.66Å; L105-W142 HydrophobicContact CD2-CZ3 3.51Å; L105-W142 HydrophobicContact CG-CH2 3.76Å; L105-W142 HydrophobicContact CG-CZ3 4.16Å
106	D	98	Very high	97.6	Very high	96 Å²	96	40.4 Å²	40.4	51%	0.513	22%	0.219	S	C	.	.	H	α-helix	trans	-61.2	-50.9	175.6	-174.3	58.2	0	0	0	111.1	S102 D103 L104 L108 S109	S102-D106 WeakPolarHBondContact O-CB 3.48Å; S102-D106 PolarHBondContact O-N 3.16Å; D103-D106 PolarHBondContact O-N 3.35Å; L104-D106 VanDerWaalsContact C-N 3.29Å; L104-D106 PolarHBondContact O-N 2.67Å; D106-L108 PolarHBondContact O-N 3.43Å; D106-S109 VanDerWaalsContact O-CB 3.25Å; D106-S109 WeakPolarHBondContact O-CB 3.19Å; D106-S109 PolarHBondContact O-N 2.89Å; D106-S109 VanDerWaalsContact O-N 3.12Å; D106-S109 PolarHBondContact O-OG 3.49Å
107	V	98.3	Very high	97.7	Very high	9 Å²	9	40.1 Å²	40.1	6%	0.055	22%	0.217	C	C	.	.	H	α-helix	trans	-62.7	-42.6	177.7	178.2	0	0	0	0	111.7	V61 V64 D103 L104 S109 H110	V61-V107 HydrophobicContact CB-CG2 4.46Å; V61-V107 HydrophobicContact CG1-CG2 3.79Å; V61-V107 HydrophobicContact CG2-CG2 4.37Å; V64-V107 HydrophobicContact CB-CG1 3.97Å; V64-V107 HydrophobicContact CG1-CB 4.42Å; V64-V107 HydrophobicContact CG1-CG1 3.68Å; D103-V107 WeakPolarHBondContact O-CG2 3.31Å; D103-V107 PolarHBondContact O-N 3.29Å; L104-V107 PolarHBondContact O-N 3.35Å; V107-S109 PolarHBondContact O-N 2.82Å; V107-H110 WeakPolarHBondContact O-CB 3.47Å; V107-H110 PolarHBondContact O-N 3.3Å
108	L	98.6	Very high	97.9	Very high	3 Å²	3	39.2 Å²	39.2	2%	0.016	21%	0.213	C	C	.	.	H	α-helix	trans	-68.8	-21.7	178.3	-67.5	173.2	0	0	0	112.6	C8 V64 V68 I83 L104 L105 D106 H110 L111 L117	C8-L108 PolarHBondContact SG-O 2.76Å; V64-L108 HydrophobicContact CG1-CD2 4.13Å; V68-L108 HydrophobicContact CG2-CD2 4.14Å; I83-L108 HydrophobicContact CD1-CD1 3.9Å; I83-L108 HydrophobicContact CD1-CD2 3.93Å; L104-L108 HydrophobicContact CD1-CD1 3.89Å; L104-L108 HydrophobicContact CD1-CG 4.15Å; L104-L108 HydrophobicContact CD2-CD1 4.24Å; L104-L108 HydrophobicContact CG-CD1 3.66Å; L104-L108 HydrophobicContact CG-CG 4.29Å; L104-L108 WeakPolarHBondContact O-CB 3.49Å; L104-L108 WeakPolarHBondContact O-CG 3.12Å; L104-L108 PolarHBondContact O-N 2.99Å; L105-L108 PolarHBondContact O-N 2.87Å; D106-L108 PolarHBondContact O-N 3.43Å; L108-H110 PolarHBondContact O-N 3.09Å; L108-L111 VanDerWaalsContact O-CB 3.29Å; L108-L111 WeakPolarHBondContact O-CB 3.31Å; L108-L111 PolarHBondContact O-N 3.4Å; L108-L117 HydrophobicContact CB-CD2 3.99Å; L108-L117 HydrophobicContact CD1-CD2 4.03Å; L108-L117 HydrophobicContact CD2-CD2 4.25Å; L108-L117 HydrophobicContact CG-CD2 4.31Å
109	S	98	Very high	98	Very high	32 Å²	32	37.7 Å²	37.7	22%	0.224	20%	0.203	C	C	.	.	H	α-helix	trans	-62.6	-21	174.2	82.7	0	0	0	0	113.2	H7 L105 D106 V107 L111	H7-S109 WeakPolarHBondContact O-CB 3.38Å; L105-S109 WeakPolarHBondContact O-CB 3.39Å; L105-S109 PolarHBondContact O-N 3.05Å; D106-S109 VanDerWaalsContact O-CB 3.25Å; D106-S109 WeakPolarHBondContact O-CB 3.19Å; D106-S109 PolarHBondContact O-N 2.89Å; D106-S109 VanDerWaalsContact O-N 3.12Å; D106-S109 PolarHBondContact O-OG 3.49Å; V107-S109 PolarHBondContact O-N 2.82Å; S109-L111 VanDerWaalsContact C-N 3.29Å
110	H	98.3	Very high	98.1	Very high	105 Å²	105	31.8 Å²	31.8	49%	0.486	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-6.1	176.1	-58.8	-49.2	0	0	0	113.6	V68 N72 V107 L108 N112	V68-H110 HydrophobicContact CG1-CB 4.08Å; N72-H110 PolarHBondContact ND2-O 2.93Å; V107-H110 WeakPolarHBondContact O-CB 3.47Å; V107-H110 PolarHBondContact O-N 3.3Å; L108-H110 PolarHBondContact O-N 3.09Å; H110-N112 PolarHBondContact O-N 3.11Å
111	L	98.7	Very high	98.2	Very high	8 Å²	8	31.8 Å²	31.8	4%	0.042	18%	0.181	C	C	.	.	S	Bend	trans	-63.4	134.3	169.3	-173.3	67.7	0	0	0	109	A10 V68 V71 V81 L108 S109 S113 I115 L117	A10-L111 HydrophobicContact CB-CB 4.23Å; A10-L111 HydrophobicContact CB-CD2 3.96Å; A10-L111 HydrophobicContact CB-CG 4.29Å; V68-L111 HydrophobicContact CG1-CB 4.18Å; V68-L111 HydrophobicContact CG1-CD1 4.45Å; V71-L111 HydrophobicContact CB-CD1 4.16Å; V71-L111 HydrophobicContact CG1-CD1 3.61Å; V81-L111 HydrophobicContact CB-CD2 4.41Å; V81-L111 HydrophobicContact CG2-CD1 4.39Å; V81-L111 HydrophobicContact CG2-CD2 4.13Å; L108-L111 VanDerWaalsContact O-CB 3.29Å; L108-L111 WeakPolarHBondContact O-CB 3.31Å; L108-L111 PolarHBondContact O-N 3.4Å; S109-L111 VanDerWaalsContact C-N 3.29Å; L111-S113 PolarHBondContact O-N 3.38Å; L111-I115 HydrophobicContact CD1-CD1 4.17Å; L111-I115 HydrophobicContact CD2-CB 4.42Å; L111-I115 HydrophobicContact CD2-CG2 4.34Å; L111-I115 HydrophobicContact CG-CB 4.35Å; L111-L117 HydrophobicContact CD2-CB 3.88Å; L111-L117 HydrophobicContact CD2-CD1 4.38Å
112	N	98	Very high	98.2	Very high	51 Å²	51	31.4 Å²	31.4	27%	0.273	18%	0.179	S	C	.	.			trans	-54.5	127.3	178.4	-179.2	-54.2	0	0	0	109.6	N72 H110 D114 I115	N72-N112 WeakPolarHBondContact OD1-CB 3.27Å; N72-N112 PolarHBondContact OD1-N 3.27Å; H110-N112 PolarHBondContact O-N 3.11Å; N112-D114 PolarHBondContact O-N 2.6Å; N112-D114 VanDerWaalsContact OD1-CB 3.29Å; N112-D114 WeakPolarHBondContact OD1-CB 3.47Å; N112-D114 PolarHBondContact OD1-N 3.36Å; N112-I115 HydrophobicContact CB-CD1 4.01Å; N112-I115 HydrophobicContact CB-CG1 4.23Å; N112-I115 WeakPolarHBondContact O-CB 3.34Å; N112-I115 PolarHBondContact O-N 3.06Å
113	S	96.8	Very high	98.3	Very high	74 Å²	74	29 Å²	29	52%	0.517	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-16.4	-173.8	55	0	0	0	0	114.7	L111 I115	L111-S113 PolarHBondContact O-N 3.38Å; S113-I115 VanDerWaalsContact C-N 3.26Å
114	D	96.4	Very high	98.3	Very high	130 Å²	130	26.6 Å²	26.6	70%	0.695	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-6	175.1	-57.2	-27.3	0	0	0	112.4	N112 P116	N112-D114 PolarHBondContact O-N 2.6Å; N112-D114 VanDerWaalsContact OD1-CB 3.29Å; N112-D114 WeakPolarHBondContact OD1-CB 3.47Å; N112-D114 PolarHBondContact OD1-N 3.36Å; D114-P116 WeakPolarHBondContact O-CD 3.5Å
115	I	98.1	Very high	98.3	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.149	C	C	.	.	S	Bend	trans	-104.6	104.4	176.5	-52.3	173.3	0	0	0	108.4	A10 V71 K77 P78 V81 L111 N112 S113 L117	A10-I115 WeakPolarHBondContact CB-O 3.4Å; V71-I115 HydrophobicContact CG1-CD1 3.91Å; K77-I115 HydrophobicContact CD-CD1 3.97Å; K77-I115 HydrophobicContact CD-CG1 4.27Å; P78-I115 HydrophobicContact CB-CG2 4.48Å; V81-I115 HydrophobicContact CG2-CG2 3.75Å; L111-I115 HydrophobicContact CD1-CD1 4.17Å; L111-I115 HydrophobicContact CD2-CB 4.42Å; L111-I115 HydrophobicContact CD2-CG2 4.34Å; L111-I115 HydrophobicContact CG-CB 4.35Å; N112-I115 HydrophobicContact CB-CD1 4.01Å; N112-I115 HydrophobicContact CB-CG1 4.23Å; N112-I115 WeakPolarHBondContact O-CB 3.34Å; N112-I115 PolarHBondContact O-N 3.06Å; S113-I115 VanDerWaalsContact C-N 3.26Å; I115-L117 PolarHBondContact O-N 2.73Å
116	P	98.4	Very high	98.3	Very high	29 Å²	29	26.5 Å²	26.5	19%	0.188	15%	0.148	C	C	.	.			trans	-55	129.5	174.5	-26.4	34.6	0	0	0	112	L21 A79 F80 V81 D114	L21-P116 HydrophobicContact CD2-CB 3.76Å; L21-P116 HydrophobicContact CD2-CG 3.99Å; A79-P116 VanDerWaalsContact O-CD 3.31Å; A79-P116 WeakPolarHBondContact O-CD 3.48Å; F80-P116 CarbonylContact C-O 3.6Å; F80-P116 VanDerWaalsContact CA-O 3.26Å; F80-P116 WeakPolarHBondContact CA-O 3.27Å; F80-P116 HydrophobicContact CB-CB 3.99Å; F80-P116 WeakPolarHBondContact CB-O 3.29Å; V81-P116 PolarHBondContact N-O 2.91Å; D114-P116 WeakPolarHBondContact O-CD 3.5Å
117	L	98.8	Very high	98.3	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.005	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	122.2	173.1	174	65.3	0	0	0	109.9	A10 L11 C12 V81 I83 L108 L111 I115	A10-L117 HydrophobicContact CB-CB 4.03Å; A10-L117 PolarHBondContact O-N 3.08Å; L11-L117 HydrophobicContact CD1-CD2 4.33Å; L11-L117 HydrophobicContact CD1-CG 4.37Å; C12-L117 WeakPolarHBondContact CB-O 3.45Å; C12-L117 PolarHBondContact N-O 3.47Å; V81-L117 HydrophobicContact CB-CD1 4.11Å; V81-L117 HydrophobicContact CG1-CD1 3.91Å; I83-L117 HydrophobicContact CD1-CD1 3.92Å; I83-L117 HydrophobicContact CG1-CD1 3.95Å; L108-L117 HydrophobicContact CB-CD2 3.99Å; L108-L117 HydrophobicContact CD1-CD2 4.03Å; L108-L117 HydrophobicContact CD2-CD2 4.25Å; L108-L117 HydrophobicContact CG-CD2 4.31Å; L111-L117 HydrophobicContact CD2-CB 3.88Å; L111-L117 HydrophobicContact CD2-CD1 4.38Å; I115-L117 PolarHBondContact O-N 2.73Å
118	I	98.8	Very high	98.3	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	141.9	-179.7	-54.6	174.4	0	0	0	107.8	C12 L19 L21 F80 V81 I82 I83 F147 F149	C12-I118 HydrophobicContact CB-CG1 4.47Å; L19-I118 HydrophobicContact CD2-CD1 3.74Å; L19-I118 HydrophobicContact CD2-CG1 3.76Å; L19-I118 HydrophobicContact CD2-CG2 4.36Å; L21-I118 HydrophobicContact CD1-CD1 4.14Å; F80-I118 HydrophobicContact CB-CD1 4.15Å; F80-I118 HydrophobicContact CD2-CD1 4Å; F80-I118 HydrophobicContact CG-CD1 4.11Å; V81-I118 PolarHBondContact O-N 3.14Å; I82-I118 CarbonylContact C-O 3.58Å; I82-I118 VanDerWaalsContact CA-O 3.25Å; I82-I118 WeakPolarHBondContact CA-O 3.26Å; I82-I118 HydrophobicContact CB-CB 4.24Å; I82-I118 HydrophobicContact CD1-CB 4.27Å; I82-I118 HydrophobicContact CD1-CG2 3.82Å; I82-I118 HydrophobicContact CG1-CB 4.04Å; I82-I118 HydrophobicContact CG1-CG2 4.03Å; I83-I118 PolarHBondContact N-O 3Å; I118-F147 HydrophobicContact CG2-CE2 3.93Å; I118-F147 HydrophobicContact CG2-CZ 3.64Å; I118-F149 HydrophobicContact CD1-CD1 4.32Å; I118-F149 HydrophobicContact CD1-CD2 4.29Å; I118-F149 HydrophobicContact CD1-CE1 3.73Å; I118-F149 HydrophobicContact CD1-CE2 3.7Å; I118-F149 HydrophobicContact CD1-CZ 3.38Å; I118-F149 HydrophobicContact CG2-CE1 4.41Å
119	V	98.9	Very high	98.1	Very high	4 Å²	4	28.5 Å²	28.5	2%	0.024	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	158.3	176.4	-59.2	0	0	0	0	109.9	L11 I83 L87 W142	L11-V119 HydrophobicContact CD1-CG1 4.26Å; L11-V119 HydrophobicContact CD1-CG2 4.24Å; I83-V119 HydrophobicContact CB-CG1 4.2Å; I83-V119 HydrophobicContact CD1-CG1 4.29Å; I83-V119 HydrophobicContact CG1-CG1 4.35Å; L87-V119 HydrophobicContact CD1-CB 4.15Å; L87-V119 HydrophobicContact CD1-CG1 4.45Å; L87-V119 HydrophobicContact CD1-CG2 4.33Å; L87-V119 HydrophobicContact CD2-CB 4.22Å; L87-V119 HydrophobicContact CD2-CG1 4.15Å; V119-W142 HydrophobicContact CG1-CE3 4.41Å; V119-W142 HydrophobicContact CG2-CB 3.87Å; V119-W142 HydrophobicContact CG2-CD2 4.23Å; V119-W142 HydrophobicContact CG2-CE3 3.83Å; V119-W142 HydrophobicContact CG2-CG 4.29Å
120	L	98.9	Very high	98.1	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	157.9	170.6	66	83.4	0	0	0	108.9	I82 I83 G85 Y138 V158 F198 H200	I82-L120 HydrophobicContact CD1-CD2 4.31Å; I83-L120 PolarHBondContact O-N 3.42Å; G85-L120 WeakPolarHBondContact CA-O 3.42Å; G85-L120 PolarHBondContact N-O 2.97Å; L120-Y138 VanDerWaalsContact CA-OH 3.31Å; L120-Y138 WeakPolarHBondContact CA-OH 3.3Å; L120-V158 HydrophobicContact CB-CG1 3.4Å; L120-V158 HydrophobicContact CD2-CG1 3.95Å; L120-V158 HydrophobicContact CG-CG1 4.33Å; L120-F198 HydrophobicContact CD2-CB 3.67Å; L120-H200 HydrophobicContact CD1-CB 3.67Å
121	P	98.8	Very high	98.1	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.134	C	C	.	.			trans	-83.2	144.4	-177.3	31.3	-33.9	0	0	0	112.9	D125 V126 Y138 D145 N160 H200	P121-D125 HydrophobicContact CB-CB 4Å; P121-V126 HydrophobicContact CB-CG1 3.67Å; P121-V126 HydrophobicContact CB-CG2 4.33Å; P121-V126 HydrophobicContact CG-CG1 4.36Å; P121-Y138 HydrophobicContact CB-CD1 4.42Å; P121-Y138 HydrophobicContact CB-CD2 3.96Å; P121-Y138 HydrophobicContact CB-CE1 4.18Å; P121-Y138 HydrophobicContact CB-CE2 3.65Å; P121-Y138 HydrophobicContact CB-CG 4.32Å; P121-Y138 WeakPolarHBondContact CD-OH 3.45Å; P121-Y138 HydrophobicContact CG-CE1 4.23Å; P121-D145 WeakPolarHBondContact CD-O 3.33Å; P121-D145 HydrophobicContact CG-CB 4.02Å; P121-N160 HydrophobicContact CG-CB 4.03Å; P121-H200 WeakPolarHBondContact O-CB 3.47Å
122	G	98.7	Very high	98	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.159	C	C	.	.			trans	-105.5	-172.3	161.7	0	0	0	0	0	113.8	D86 H124 D125 V126 H200	D86-G122 VanDerWaalsContact OD1-C 3.25Å; D86-G122 VanDerWaalsContact OD1-CA 3.3Å; D86-G122 WeakPolarHBondContact OD1-CA 3.48Å; G122-H124 VanDerWaalsContact C-N 3.28Å; G122-H124 PolarHBondContact O-N 2.76Å; G122-D125 PolarHBondContact N-OD2 3.39Å; G122-D125 PolarHBondContact O-N 2.97Å; G122-V126 WeakPolarHBondContact O-CG2 3.31Å; G122-V126 PolarHBondContact O-N 2.68Å; G122-V126 VanDerWaalsContact O-N 3.16Å; G122-H200 WeakPolarHBondContact CA-CD2 3.15Å; G122-H200 WeakPolarHBondContact CA-NE2 3.45Å
123	N	98.6	Very high	97.9	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-73.9	-18.9	-178.6	67.8	-77.2	0	0	0	113.3	D86 G127 N128 Q162 H200 Y214 H241	D86-N123 PolarHBondContact OD1-N 2.86Å; N123-G127 CarbonylContact O-C 3.06Å; N123-G127 WeakPolarHBondContact O-CA 3.27Å; N123-G127 PolarHBondContact O-N 3.25Å; N123-N128 WeakPolarHBondContact CB-OD1 2.83Å; N123-N128 PolarHBondContact ND2-OD1 2.75Å; N123-Q162 VanDerWaalsContact CB-CD 3.43Å; N123-Q162 HydrophobicContact CB-CG 4.16Å; N123-H200 PolarHBondContact OD1-NE2 2.82Å; N123-Y214 PolarHBondContact ND2-OH 3.42Å; N123-H241 PolarHBondContact OD1-CE1 2.72Å; N123-H241 VanDerWaalsContact OD1-CE1 3.22Å; N123-H241 PolarHBondContact OD1-ND1 3.18Å
124	H	98.5	Very high	98	Very high	13 Å²	13	28.4 Å²	28.4	6%	0.06	16%	0.161	C	C	.	.	H	α-helix	trans	-80.8	-21.1	169.4	-71.1	-112	0	0	0	112.4	Q40 D86 V88 N89 Q91 R97 G122	Q40-H124 PolarHBondContact NE2-CD2 2.79Å; Q40-H124 PolarHBondContact NE2-CE1 2.76Å; Q40-H124 PolarHBondContact NE2-ND1 2.87Å; Q40-H124 PolarHBondContact NE2-NE2 2.86Å; Q40-H124 VanDerWaalsContact NE2-NE2 3.18Å; D86-H124 HydrophobicContact CB-CB 4.36Å; D86-H124 WeakPolarHBondContact OD1-CB 3.39Å; D86-H124 IonicContact OD1-CD2 3.59Å; D86-H124 IonicContact OD1-CG 2.67Å; D86-H124 PolarHBondContact OD1-N 2.74Å; D86-H124 IonicContact OD2-CD2 3.43Å; D86-H124 PolarHBondContact OD2-CD2 2.87Å; D86-H124 IonicContact OD2-CG 3.87Å; D86-H124 IonicContact OD2-NE2 2.67Å; V88-H124 VanDerWaalsContact O-CB 3.25Å; V88-H124 WeakPolarHBondContact O-CB 3.46Å; N89-H124 PolarHBondContact O-ND1 3.31Å; Q91-H124 WeakPolarHBondContact CA-O 3.33Å; R97-H124 PolarHBondContact NH1-O 2.79Å; G122-H124 VanDerWaalsContact C-N 3.28Å; G122-H124 PolarHBondContact O-N 2.76Å
125	D	98.7	Very high	98.1	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.005	13%	0.129	C	C	.	.	H	α-helix	trans	-84.6	-41.3	-179.9	-58.8	-49.3	0	0	0	112.8	D86 L87 R97 P121 G122 Y138	D86-D125 WeakPolarHBondContact CA-OD2 3.28Å; D86-D125 PolarHBondContact N-OD2 3.44Å; L87-D125 WeakPolarHBondContact CB-OD1 3.41Å; L87-D125 PolarHBondContact N-OD1 2.9Å; L87-D125 PolarHBondContact N-OD2 2.87Å; R97-D125 PolarHBondContact NH1-O 2.88Å; R97-D125 PolarHBondContact NH2-O 2.83Å; P121-D125 HydrophobicContact CB-CB 4Å; G122-D125 PolarHBondContact N-OD2 3.39Å; G122-D125 PolarHBondContact O-N 2.97Å; D125-Y138 HydrophobicContact CB-CD2 3.82Å; D125-Y138 HydrophobicContact CB-CE2 4.09Å
126	V	98.5	Very high	98	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-116.1	2.6	-179.9	-60.8	0	0	0	0	113.4	P121 G122 P130 D134 V135 Y138 Q162	P121-V126 HydrophobicContact CB-CG1 3.67Å; P121-V126 HydrophobicContact CB-CG2 4.33Å; P121-V126 HydrophobicContact CG-CG1 4.36Å; G122-V126 WeakPolarHBondContact O-CG2 3.31Å; G122-V126 PolarHBondContact O-N 2.68Å; G122-V126 VanDerWaalsContact O-N 3.16Å; V126-P130 HydrophobicContact CB-CB 4.35Å; V126-P130 HydrophobicContact CG2-CB 4.36Å; V126-P130 WeakPolarHBondContact O-CA 3.5Å; V126-P130 VanDerWaalsContact O-CB 3.26Å; V126-P130 WeakPolarHBondContact O-CB 3.38Å; V126-D134 VanDerWaalsContact O-CB 3.28Å; V126-D134 WeakPolarHBondContact O-CB 3.37Å; V126-V135 HydrophobicContact CB-CG2 4.46Å; V126-V135 HydrophobicContact CG1-CG2 4.49Å; V126-Y138 HydrophobicContact CG1-CD2 4.35Å; V126-Y138 HydrophobicContact CG1-CG 3.97Å; V126-Q162 HydrophobicContact CG2-CB 3.72Å; V126-Q162 HydrophobicContact CG2-CG 3.6Å
127	G	98	Very high	98	Very high	6 Å²	6	27.8 Å²	27.8	6%	0.062	15%	0.153	C	C	.	.			trans	87.6	159.4	-178.9	0	0	0	0	0	113.6	N123 H129 P130 Q162	N123-G127 CarbonylContact O-C 3.06Å; N123-G127 WeakPolarHBondContact O-CA 3.27Å; N123-G127 PolarHBondContact O-N 3.25Å; G127-H129 PolarHBondContact O-N 2.95Å; G127-P130 WeakPolarHBondContact O-CD 3.35Å; G127-Q162 PolarHBondContact O-OE1 3.11Å
128	N	97.2	Very high	97.9	Very high	52 Å²	52	27.8 Å²	27.8	28%	0.278	15%	0.152	S	C	.	.	S	Bend	trans	-70.6	-18	176.6	-73.4	-40.3	0	0	0	113.8	Q91 N123 N166	Q91-N128 PolarHBondContact NE2-ND2 3Å; N123-N128 WeakPolarHBondContact CB-OD1 2.83Å; N123-N128 PolarHBondContact ND2-OD1 2.75Å; N128-N166 WeakPolarHBondContact O-CB 3.47Å
129	H	96.1	Very high	97.9	Very high	92 Å²	92	30.8 Å²	30.8	43%	0.426	16%	0.164	S	C	.	.	S	Bend	trans	-143	63.1	-178.3	-52.2	82.7	0	0	0	108	G127 D131 N166	G127-H129 PolarHBondContact O-N 2.95Å; H129-D131 PolarHBondContact O-N 3.23Å; H129-N166 PolarHBondContact CD2-ND2 3.09Å; H129-N166 PolarHBondContact NE2-ND2 3.13Å; H129-N166 VanDerWaalsContact NE2-ND2 3.17Å
130	P	97.2	Very high	97.7	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.187	C	C	.	.			trans	-54.7	137.4	-167.8	19.7	-32.4	0	0	0	111.7	V126 G127 V135 Q162 N166 C170	V126-P130 HydrophobicContact CB-CB 4.35Å; V126-P130 HydrophobicContact CG2-CB 4.36Å; V126-P130 WeakPolarHBondContact O-CA 3.5Å; V126-P130 VanDerWaalsContact O-CB 3.26Å; V126-P130 WeakPolarHBondContact O-CB 3.38Å; G127-P130 WeakPolarHBondContact O-CD 3.35Å; P130-V135 HydrophobicContact CB-CG2 4.12Å; P130-Q162 HydrophobicContact CG-CB 3.83Å; P130-N166 WeakPolarHBondContact CD-O 3.44Å; P130-C170 VanDerWaalsContact O-CB 3.25Å; P130-C170 WeakPolarHBondContact O-CB 3.36Å; P130-C170 PolarHBondContact O-SG 2.82Å
131	D	97.8	Very high	97.6	Very high	46 Å²	46	35.2 Å²	35.2	25%	0.246	19%	0.194	C	C	.	.			trans	-104.4	-178.4	159.7	76.6	32.6	0	0	0	111.9	H129 N133 D134 V135 K169	H129-D131 PolarHBondContact O-N 3.23Å; D131-N133 VanDerWaalsContact C-N 3.29Å; D131-N133 PolarHBondContact O-N 3.25Å; D131-N133 WeakPolarHBondContact OD1-CA 3.33Å; D131-N133 WeakPolarHBondContact OD1-CB 3.36Å; D131-N133 PolarHBondContact OD1-N 3.38Å; D131-D134 PolarHBondContact N-OD2 3.5Å; D131-D134 PolarHBondContact O-N 3.24Å; D131-D134 PolarHBondContact OD1-N 3.13Å; D131-D134 VanDerWaalsContact OD1-N 3.1Å; D131-V135 WeakPolarHBondContact O-CG2 3.48Å; D131-V135 PolarHBondContact O-N 3.45Å; D131-K169 HydrophobicContact CB-CB 4.04Å; D131-K169 HydrophobicContact CB-CD 4.44Å
132	A	96.4	Very high	97.5	Very high	67 Å²	67	35.6 Å²	35.6	55%	0.554	20%	0.195	S	C	*	.	H	α-helix	trans	-65.5	-30.3	-177.7	0	0	0	0	0	113.3	Q136	A132-Q136 VanDerWaalsContact O-CB 3.25Å; A132-Q136 WeakPolarHBondContact O-CB 3.49Å; A132-Q136 PolarHBondContact O-N 3.16Å
133	N	97.5	Very high	97.5	Very high	122 Å²	122	36.1 Å²	36.1	65%	0.652	20%	0.2	S	C	*	.	H	α-helix	trans	-74.6	-40.1	178.3	-61.8	-49.1	0	0	0	110.8	D131 V135 Q136 D137	D131-N133 VanDerWaalsContact C-N 3.29Å; D131-N133 PolarHBondContact O-N 3.25Å; D131-N133 WeakPolarHBondContact OD1-CA 3.33Å; D131-N133 WeakPolarHBondContact OD1-CB 3.36Å; D131-N133 PolarHBondContact OD1-N 3.38Å; N133-V135 VanDerWaalsContact C-N 3.32Å; N133-V135 PolarHBondContact O-N 2.82Å; N133-Q136 PolarHBondContact O-N 2.97Å; N133-D137 WeakPolarHBondContact O-CB 3.39Å; N133-D137 PolarHBondContact O-N 3.45Å
134	D	98	Very high	97.5	Very high	33 Å²	33	37.3 Å²	37.3	18%	0.176	21%	0.207	C	C	.	.	H	α-helix	trans	-59.4	-44.5	177.3	-58.9	-38.3	0	0	0	111.4	P92 V126 D131 D137 Y138	P92-D134 HydrophobicContact CB-CB 4.16Å; P92-D134 VanDerWaalsContact CB-OD1 3.23Å; P92-D134 WeakPolarHBondContact CB-OD1 3.29Å; P92-D134 HydrophobicContact CG-CB 3.98Å; V126-D134 VanDerWaalsContact O-CB 3.28Å; V126-D134 WeakPolarHBondContact O-CB 3.37Å; D131-D134 PolarHBondContact N-OD2 3.5Å; D131-D134 PolarHBondContact O-N 3.24Å; D131-D134 PolarHBondContact OD1-N 3.13Å; D131-D134 VanDerWaalsContact OD1-N 3.1Å; D134-D137 PolarHBondContact O-N 2.91Å; D134-Y138 PolarHBondContact O-N 3.1Å
135	V	98.1	Very high	97.5	Very high	6 Å²	6	36.7 Å²	36.7	4%	0.036	20%	0.204	C	C	.	.	H	α-helix	trans	-68.4	-37.8	176.3	176	0	0	0	0	111.3	V126 P130 D131 N133 Y138 R139 D145 Y163	V126-V135 HydrophobicContact CB-CG2 4.46Å; V126-V135 HydrophobicContact CG1-CG2 4.49Å; P130-V135 HydrophobicContact CB-CG2 4.12Å; D131-V135 WeakPolarHBondContact O-CG2 3.48Å; D131-V135 PolarHBondContact O-N 3.45Å; N133-V135 VanDerWaalsContact C-N 3.32Å; N133-V135 PolarHBondContact O-N 2.82Å; V135-Y138 PolarHBondContact O-N 3.41Å; V135-R139 HydrophobicContact CG1-CG 4.4Å; V135-R139 WeakPolarHBondContact O-CB 3.33Å; V135-R139 WeakPolarHBondContact O-CG 3.38Å; V135-R139 PolarHBondContact O-N 3.39Å; V135-D145 HydrophobicContact CG1-CB 4.47Å; V135-Y163 WeakPolarHBondContact CG1-OH 3.33Å; V135-Y163 HydrophobicContact CG2-CE1 4.28Å; V135-Y163 WeakPolarHBondContact CG2-OH 3.12Å
136	Q	97.2	Very high	97.5	Very high	106 Å²	106	37 Å²	37	50%	0.495	21%	0.205	S	C	.	.	H	α-helix	trans	-69.1	-34.9	178.2	-175.9	55.5	67.1	0	0	112.2	A132 N133 R139 S140	A132-Q136 VanDerWaalsContact O-CB 3.25Å; A132-Q136 WeakPolarHBondContact O-CB 3.49Å; A132-Q136 PolarHBondContact O-N 3.16Å; N133-Q136 PolarHBondContact O-N 2.97Å; Q136-R139 PolarHBondContact O-N 3.38Å; Q136-S140 WeakPolarHBondContact O-CB 3.4Å; Q136-S140 PolarHBondContact O-N 2.95Å
137	D	96.6	Very high	97.5	Very high	34 Å²	34	37.1 Å²	37.1	18%	0.182	21%	0.206	C	C	.	.	H	α-helix	trans	-58.9	-52.9	172.3	178.7	78.2	0	0	0	110.1	R97 N133 D134 R139 S140	R97-D137 IonicContact CZ-OD2 3.19Å; R97-D137 IonicContact NE-OD2 2.82Å; R97-D137 PolarHBondContact NE-OD2 2.78Å; R97-D137 IonicContact NH2-OD2 2.71Å; R97-D137 PolarHBondContact NH2-OD2 3.17Å; N133-D137 WeakPolarHBondContact O-CB 3.39Å; N133-D137 PolarHBondContact O-N 3.45Å; D134-D137 PolarHBondContact O-N 2.91Å; D137-R139 PolarHBondContact O-N 3.08Å; D137-S140 PolarHBondContact O-N 3.36Å; D137-S140 PolarHBondContact O-OG 2.82Å
138	Y	98.2	Very high	97.6	Very high	1 Å²	1	37.5 Å²	37.5	0%	0.004	21%	0.207	C	C	.	.	H	α-helix	trans	-53.7	-52.7	173.4	175.8	-91.9	0	0	0	112.3	L87 L120 P121 D125 V126 D134 V135 S140 V141 W142 D145	L87-Y138 HydrophobicContact CD1-CE2 4.1Å; L120-Y138 VanDerWaalsContact CA-OH 3.31Å; L120-Y138 WeakPolarHBondContact CA-OH 3.3Å; P121-Y138 HydrophobicContact CB-CD1 4.42Å; P121-Y138 HydrophobicContact CB-CD2 3.96Å; P121-Y138 HydrophobicContact CB-CE1 4.18Å; P121-Y138 HydrophobicContact CB-CE2 3.65Å; P121-Y138 HydrophobicContact CB-CG 4.32Å; P121-Y138 WeakPolarHBondContact CD-OH 3.45Å; P121-Y138 HydrophobicContact CG-CE1 4.23Å; D125-Y138 HydrophobicContact CB-CD2 3.82Å; D125-Y138 HydrophobicContact CB-CE2 4.09Å; V126-Y138 HydrophobicContact CG1-CD2 4.35Å; V126-Y138 HydrophobicContact CG1-CG 3.97Å; D134-Y138 PolarHBondContact O-N 3.1Å; V135-Y138 PolarHBondContact O-N 3.41Å; Y138-S140 PolarHBondContact O-N 3.3Å; Y138-V141 PolarHBondContact O-N 3.14Å; Y138-V141 VanDerWaalsContact O-N 3.12Å; Y138-W142 HydrophobicContact CD1-CB 4.37Å; Y138-W142 HydrophobicContact CD2-CB 4.3Å; Y138-W142 AromaticContact CD2-CD1 3.43Å; Y138-W142 VanDerWaalsContact CD2-CD1 3.43Å; Y138-W142 HydrophobicContact CD2-CG 4.13Å; Y138-W142 HydrophobicContact CE1-CB 3.87Å; Y138-W142 HydrophobicContact CE2-CB 3.84Å; Y138-W142 AromaticContact CE2-CD1 3.51Å; Y138-W142 AromaticContact CE2-CG 3.79Å; Y138-W142 HydrophobicContact CE2-CG 3.79Å; Y138-W142 PolarHBondContact O-N 3.49Å; Y138-D145 HydrophobicContact CD1-CB 4.06Å; Y138-D145 HydrophobicContact CE1-CB 4.08Å
139	R	97.6	Very high	97.6	Very high	64 Å²	64	35 Å²	35	24%	0.242	19%	0.194	C	C	.	.	H	α-helix	trans	-62.5	-28.7	-176.7	-74.8	180	178.4	164.6	16.2	113.6	V135 Q136 D137 V141 G143 D145	V135-R139 HydrophobicContact CG1-CG 4.4Å; V135-R139 WeakPolarHBondContact O-CB 3.33Å; V135-R139 WeakPolarHBondContact O-CG 3.38Å; V135-R139 PolarHBondContact O-N 3.39Å; Q136-R139 PolarHBondContact O-N 3.38Å; D137-R139 PolarHBondContact O-N 3.08Å; R139-V141 PolarHBondContact O-N 2.89Å; R139-G143 VanDerWaalsContact CA-O 3.28Å; R139-G143 WeakPolarHBondContact CA-O 3.46Å; R139-G143 WeakPolarHBondContact CG-O 3.22Å; R139-G143 PolarHBondContact O-N 3.02Å; R139-D145 IonicContact CZ-OD1 3.26Å; R139-D145 IonicContact NE-OD1 2.99Å; R139-D145 PolarHBondContact NE-OD1 3.11Å; R139-D145 IonicContact NH2-OD1 3.31Å; R139-D145 PolarHBondContact NH2-OD1 2.87Å; R139-D145 IonicContact NH2-OD2 3.51Å
140	S	96	Very high	97.5	Very high	74 Å²	74	32.5 Å²	32.5	52%	0.517	18%	0.183	S	C	.	.	H	α-helix	trans	-65.7	-24.1	179.5	76.3	0	0	0	0	113.1	Q136 D137 Y138	Q136-S140 WeakPolarHBondContact O-CB 3.4Å; Q136-S140 PolarHBondContact O-N 2.95Å; D137-S140 PolarHBondContact O-N 3.36Å; D137-S140 PolarHBondContact O-OG 2.82Å; Y138-S140 PolarHBondContact O-N 3.3Å
141	V	96.2	Very high	97.3	Very high	22 Å²	22	33.7 Å²	33.7	13%	0.133	19%	0.188	C	C	.	.	H	α-helix	trans	-105	-46.8	179.5	-176.3	0	0	0	0	111.4	I6 T101 L105 Y138 R139	I6-V141 HydrophobicContact CD1-CG1 4.29Å; I6-V141 HydrophobicContact CG1-CG1 4.44Å; T101-V141 HydrophobicContact CG2-CG1 4Å; L105-V141 HydrophobicContact CD1-CG1 4.04Å; Y138-V141 PolarHBondContact O-N 3.14Å; Y138-V141 VanDerWaalsContact O-N 3.12Å; R139-V141 PolarHBondContact O-N 2.89Å
142	W	97.7	Very high	97	Very high	9 Å²	9	32.5 Å²	32.5	3%	0.034	18%	0.182	C	C	.	.	H	α-helix	trans	-104	-12	-163.9	-56.8	109.4	0	0	0	114.6	L11 L87 T101 L104 L105 V119 Y138	L11-W142 HydrophobicContact CD1-CE3 4.18Å; L11-W142 HydrophobicContact CD1-CZ3 4.43Å; L11-W142 HydrophobicContact CD2-CE3 3.98Å; L11-W142 HydrophobicContact CD2-CZ3 4.17Å; L87-W142 HydrophobicContact CB-CZ2 4.43Å; L87-W142 HydrophobicContact CD1-CD2 3.65Å; L87-W142 VanDerWaalsContact CD1-CE2 3.49Å; L87-W142 HydrophobicContact CD1-CE3 4.05Å; L87-W142 HydrophobicContact CD1-CG 4.08Å; L87-W142 HydrophobicContact CD1-CH2 4.14Å; L87-W142 HydrophobicContact CD1-CZ2 3.75Å; L87-W142 HydrophobicContact CD1-CZ3 4.28Å; T101-W142 HydrophobicContact CG2-CZ2 3.87Å; L104-W142 HydrophobicContact CD2-CH2 4.06Å; L104-W142 HydrophobicContact CD2-CZ2 4.39Å; L105-W142 HydrophobicContact CD1-CH2 4.47Å; L105-W142 HydrophobicContact CD2-CE3 4.42Å; L105-W142 HydrophobicContact CD2-CH2 3.66Å; L105-W142 HydrophobicContact CD2-CZ3 3.51Å; L105-W142 HydrophobicContact CG-CH2 3.76Å; L105-W142 HydrophobicContact CG-CZ3 4.16Å; V119-W142 HydrophobicContact CG1-CE3 4.41Å; V119-W142 HydrophobicContact CG2-CB 3.87Å; V119-W142 HydrophobicContact CG2-CD2 4.23Å; V119-W142 HydrophobicContact CG2-CE3 3.83Å; V119-W142 HydrophobicContact CG2-CG 4.29Å; Y138-W142 HydrophobicContact CD1-CB 4.37Å; Y138-W142 HydrophobicContact CD2-CB 4.3Å; Y138-W142 AromaticContact CD2-CD1 3.43Å; Y138-W142 VanDerWaalsContact CD2-CD1 3.43Å; Y138-W142 HydrophobicContact CD2-CG 4.13Å; Y138-W142 HydrophobicContact CE1-CB 3.87Å; Y138-W142 HydrophobicContact CE2-CB 3.84Å; Y138-W142 AromaticContact CE2-CD1 3.51Å; Y138-W142 AromaticContact CE2-CG 3.79Å; Y138-W142 HydrophobicContact CE2-CG 3.79Å; Y138-W142 PolarHBondContact O-N 3.49Å
143	G	97.8	Very high	96.7	Very high	10 Å²	10	32.3 Å²	32.3	10%	0.103	17%	0.167	C	C	.	.			trans	87.9	-165.4	-172.3	0	0	0	0	0	113	R139 D145	R139-G143 VanDerWaalsContact CA-O 3.28Å; R139-G143 WeakPolarHBondContact CA-O 3.46Å; R139-G143 WeakPolarHBondContact CG-O 3.22Å; R139-G143 PolarHBondContact O-N 3.02Å; G143-D145 PolarHBondContact O-N 3.46Å
144	D	98.6	Very high	96.5	Very high	26 Å²	26	26.7 Å²	26.7	14%	0.139	14%	0.137	C	C	.	.			trans	-57.6	139.9	-174.3	-72	-14.1	0	0	0	112.9	A14 K15 N16 R17 F147	A14-D144 HydrophobicContact CB-CB 4Å; A14-D144 PolarHBondContact O-N 3.17Å; K15-D144 WeakPolarHBondContact CA-OD2 3.43Å; N16-D144 PolarHBondContact N-OD2 2.97Å; R17-D144 PolarHBondContact N-OD2 3.17Å; D144-F147 HydrophobicContact CB-CD1 4.33Å; D144-F147 VanDerWaalsContact O-CD1 3.29Å; D144-F147 WeakPolarHBondContact O-CD1 3.36Å; D144-F147 WeakPolarHBondContact O-CE1 3.4Å
145	D	98.6	Very high	96.3	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.13	C	C	.	.	S	Bend	trans	-80.4	-15.8	-176.2	60.3	-43.6	0	0	0	114.2	R17 P121 V135 Y138 R139 G143 N160 Y163	R17-D145 IonicContact CZ-OD1 3.32Å; R17-D145 IonicContact NH1-OD1 3.64Å; R17-D145 PolarHBondContact NH1-OD1 3.24Å; R17-D145 IonicContact NH2-OD1 2.83Å; P121-D145 WeakPolarHBondContact CD-O 3.33Å; P121-D145 HydrophobicContact CG-CB 4.02Å; V135-D145 HydrophobicContact CG1-CB 4.47Å; Y138-D145 HydrophobicContact CD1-CB 4.06Å; Y138-D145 HydrophobicContact CE1-CB 4.08Å; R139-D145 IonicContact CZ-OD1 3.26Å; R139-D145 IonicContact NE-OD1 2.99Å; R139-D145 PolarHBondContact NE-OD1 3.11Å; R139-D145 IonicContact NH2-OD1 3.31Å; R139-D145 PolarHBondContact NH2-OD1 2.87Å; R139-D145 IonicContact NH2-OD2 3.51Å; G143-D145 PolarHBondContact O-N 3.46Å; D145-N160 HydrophobicContact CB-CB 4.3Å; D145-N160 WeakPolarHBondContact O-CB 3.13Å; D145-N160 PolarHBondContact OD2-ND2 3.12Å; D145-Y163 WeakPolarHBondContact OD2-CE2 3.15Å; D145-Y163 VanDerWaalsContact OD2-CZ 3.3Å; D145-Y163 PolarHBondContact OD2-OH 2.84Å
146	Y	98.9	Very high	96.3	Very high	6 Å²	6	25.3 Å²	25.3	2%	0.024	13%	0.129	C	C	.	.	S	Bend	trans	-151.7	141	170.9	59.8	-93.2	0	0	0	108.8	R17 V158 N160 Y163 F177 W180	R17-Y146 WeakPolarHBondContact CD-O 3.36Å; R17-Y146 HydrophobicContact CG-CE2 4.37Å; R17-Y146 VanDerWaalsContact CZ-CE2 3.48Å; R17-Y146 PolarHBondContact NH1-O 3.04Å; R17-Y146 PolarHBondContact NH2-OH 3.31Å; Y146-V158 VanDerWaalsContact CA-O 3.28Å; Y146-V158 WeakPolarHBondContact CA-O 3.45Å; Y146-V158 VanDerWaalsContact CB-O 3.31Å; Y146-V158 WeakPolarHBondContact CB-O 3Å; Y146-N160 HydrophobicContact CD1-CB 4.31Å; Y146-Y163 HydrophobicContact CD1-CD2 4.47Å; Y146-Y163 AromaticContact CD1-CE2 3.81Å; Y146-Y163 HydrophobicContact CD1-CE2 3.81Å; Y146-Y163 HydrophobicContact CE1-CD2 4.46Å; Y146-Y163 AromaticContact CE1-CE2 3.68Å; Y146-Y163 HydrophobicContact CE1-CE2 3.68Å; Y146-F177 AromaticContact CD1-CD2 3.83Å; Y146-F177 HydrophobicContact CD1-CD2 3.83Å; Y146-F177 AromaticContact CD2-CD2 3.94Å; Y146-F177 HydrophobicContact CD2-CD2 3.94Å; Y146-F177 HydrophobicContact CE1-CB 4.02Å; Y146-F177 HydrophobicContact CE1-CD2 4.15Å; Y146-F177 HydrophobicContact CE2-CD2 4.27Å; Y146-F177 AromaticContact CG-CD2 3.69Å; Y146-F177 HydrophobicContact CG-CD2 3.69Å; Y146-F177 HydrophobicContact CG-CE2 4.25Å; Y146-W180 AromaticContact CD2-CD2 3.63Å; Y146-W180 HydrophobicContact CD2-CD2 3.63Å; Y146-W180 AromaticContact CD2-CE2 3.95Å; Y146-W180 AromaticContact CD2-CE3 3.53Å; Y146-W180 HydrophobicContact CD2-CE3 3.53Å; Y146-W180 HydrophobicContact CD2-CG 4.24Å; Y146-W180 HydrophobicContact CD2-CH2 4.09Å; Y146-W180 HydrophobicContact CD2-CZ2 4.17Å; Y146-W180 AromaticContact CD2-CZ3 3.78Å; Y146-W180 HydrophobicContact CD2-CZ3 3.78Å; Y146-W180 HydrophobicContact CE2-CB 4.2Å; Y146-W180 AromaticContact CE2-CD2 3.78Å; Y146-W180 HydrophobicContact CE2-CD2 3.78Å; Y146-W180 AromaticContact CE2-CE3 3.96Å; Y146-W180 HydrophobicContact CE2-CE3 3.96Å; Y146-W180 AromaticContact CE2-CG 3.88Å; Y146-W180 HydrophobicContact CE2-CG 3.88Å; Y146-W180 HydrophobicContact CG-CE3 4.47Å; Y146-W180 HydrophobicContact CG-CZ3 4.42Å
147	F	98.9	Very high	96.4	Very high	4 Å²	4	20.3 Å²	20.3	2%	0.018	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169	174.9	-172.2	54.1	-87.8	0	0	0	110.9	A14 R17 L19 I118 D144 F149 V158	A14-F147 HydrophobicContact CB-CB 3.85Å; A14-F147 HydrophobicContact CB-CD1 3.39Å; A14-F147 HydrophobicContact CB-CD2 3.67Å; A14-F147 HydrophobicContact CB-CE1 3.75Å; A14-F147 HydrophobicContact CB-CE2 4Å; A14-F147 HydrophobicContact CB-CG 3.36Å; A14-F147 HydrophobicContact CB-CZ 4.04Å; R17-F147 VanDerWaalsContact C-CB 3.43Å; R17-F147 CarbonylContact O-C 3.46Å; R17-F147 VanDerWaalsContact O-CA 3.29Å; R17-F147 WeakPolarHBondContact O-CA 3.47Å; R17-F147 WeakPolarHBondContact O-CB 3.43Å; L19-F147 HydrophobicContact CB-CD2 3.97Å; L19-F147 HydrophobicContact CB-CE2 4.07Å; L19-F147 HydrophobicContact CD2-CE2 4.17Å; I118-F147 HydrophobicContact CG2-CE2 3.93Å; I118-F147 HydrophobicContact CG2-CZ 3.64Å; D144-F147 HydrophobicContact CB-CD1 4.33Å; D144-F147 VanDerWaalsContact O-CD1 3.29Å; D144-F147 WeakPolarHBondContact O-CD1 3.36Å; D144-F147 WeakPolarHBondContact O-CE1 3.4Å; F147-F149 HydrophobicContact CD2-CD1 4.25Å; F147-F149 AromaticContact CE2-CD1 3.93Å; F147-F149 HydrophobicContact CE2-CD1 3.93Å; F147-F149 HydrophobicContact CE2-CE1 4.32Å; F147-V158 HydrophobicContact CD1-CB 4.21Å; F147-V158 HydrophobicContact CD1-CG1 4.28Å; F147-V158 HydrophobicContact CD2-CB 4.24Å; F147-V158 HydrophobicContact CD2-CG2 4.13Å; F147-V158 HydrophobicContact CE1-CB 4.02Å; F147-V158 HydrophobicContact CE1-CG1 3.77Å; F147-V158 HydrophobicContact CE1-CG2 4.37Å; F147-V158 HydrophobicContact CE2-CB 4.06Å; F147-V158 HydrophobicContact CE2-CG2 3.64Å; F147-V158 HydrophobicContact CG-CB 4.31Å; F147-V158 HydrophobicContact CZ-CB 3.94Å; F147-V158 HydrophobicContact CZ-CG1 3.9Å; F147-V158 HydrophobicContact CZ-CG2 3.77Å; F147-V158 PolarHBondContact N-O 3.48Å; F147-V158 VanDerWaalsContact N-O 3.16Å; F147-V158 PolarHBondContact O-N 3.21Å
148	T	98.4	Very high	96.5	Very high	14 Å²	14	18.7 Å²	18.7	9%	0.086	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	157.5	166.9	59.6	0	0	0	0	111.3	R17 H18 L19 F156 I157 W180 Q184	R17-T148 PolarHBondContact O-N 3.02Å; H18-T148 WeakPolarHBondContact CA-O 3.36Å; L19-T148 PolarHBondContact N-O 2.85Å; T148-F156 VanDerWaalsContact CA-O 3.25Å; T148-F156 WeakPolarHBondContact CA-O 3.49Å; T148-I157 HydrophobicContact CG2-CB 4.47Å; T148-I157 HydrophobicContact CG2-CG1 4.17Å; T148-I157 HydrophobicContact CG2-CG2 4.31Å; T148-W180 HydrophobicContact CG2-CH2 4.25Å; T148-W180 HydrophobicContact CG2-CZ2 3.79Å; T148-Q184 HydrophobicContact CG2-CG 3.89Å
149	F	97.5	Very high	96.5	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	162.5	164.2	62.5	-81.2	0	0	0	109.7	L19 L21 F80 I118 F147 R155 F156 V158 F198	L19-F149 HydrophobicContact CB-CB 4Å; L19-F149 HydrophobicContact CD2-CD1 4.49Å; L19-F149 HydrophobicContact CD2-CG 4.49Å; L19-F149 HydrophobicContact CG-CB 4.44Å; L19-F149 WeakPolarHBondContact O-CB 3.45Å; L21-F149 HydrophobicContact CD1-CD2 3.69Å; L21-F149 HydrophobicContact CD1-CE2 3.89Å; L21-F149 HydrophobicContact CG-CD2 4.35Å; F80-F149 HydrophobicContact CD1-CE2 4.25Å; F80-F149 HydrophobicContact CD2-CZ 4.47Å; F80-F149 AromaticContact CE1-CE2 3.95Å; F80-F149 HydrophobicContact CE1-CE2 3.95Å; F80-F149 HydrophobicContact CE1-CZ 4.44Å; F80-F149 HydrophobicContact CE2-CE2 4.37Å; F80-F149 HydrophobicContact CE2-CZ 4.07Å; F80-F149 HydrophobicContact CZ-CE2 4.02Å; F80-F149 HydrophobicContact CZ-CZ 4.06Å; I118-F149 HydrophobicContact CD1-CD1 4.32Å; I118-F149 HydrophobicContact CD1-CD2 4.29Å; I118-F149 HydrophobicContact CD1-CE1 3.73Å; I118-F149 HydrophobicContact CD1-CE2 3.7Å; I118-F149 HydrophobicContact CD1-CZ 3.38Å; I118-F149 HydrophobicContact CG2-CE1 4.41Å; F147-F149 HydrophobicContact CD2-CD1 4.25Å; F147-F149 AromaticContact CE2-CD1 3.93Å; F147-F149 HydrophobicContact CE2-CD1 3.93Å; F147-F149 HydrophobicContact CE2-CE1 4.32Å; F149-R155 WeakPolarHBondContact O-CA 3.31Å; F149-F156 HydrophobicContact CD1-CB 3.78Å; F149-F156 HydrophobicContact CD2-CB 4.09Å; F149-F156 AromaticContact CD2-CD2 3.77Å; F149-F156 HydrophobicContact CD2-CD2 3.77Å; F149-F156 HydrophobicContact CD2-CG 4.29Å; F149-F156 HydrophobicContact CE1-CB 3.35Å; F149-F156 HydrophobicContact CE1-CG 4.14Å; F149-F156 HydrophobicContact CE2-CB 3.7Å; F149-F156 AromaticContact CE2-CD2 3.3Å; F149-F156 HydrophobicContact CE2-CD2 3.3Å; F149-F156 HydrophobicContact CE2-CE2 4.08Å; F149-F156 AromaticContact CE2-CG 3.63Å; F149-F156 HydrophobicContact CE2-CG 3.63Å; F149-F156 HydrophobicContact CG-CB 4.13Å; F149-F156 HydrophobicContact CZ-CB 3.3Å; F149-F156 HydrophobicContact CZ-CD1 4.36Å; F149-F156 AromaticContact CZ-CD2 3.76Å; F149-F156 HydrophobicContact CZ-CD2 3.76Å; F149-F156 AromaticContact CZ-CG 3.55Å; F149-F156 HydrophobicContact CZ-CG 3.55Å; F149-F156 PolarHBondContact N-O 3.32Å; F149-F156 VanDerWaalsContact N-O 3.09Å; F149-F156 PolarHBondContact O-N 2.94Å; F149-V158 HydrophobicContact CD1-CG2 4.38Å; F149-V158 HydrophobicContact CE1-CG2 3.93Å; F149-F198 HydrophobicContact CZ-CE2 4.36Å
150	I	94.2	Very high	96.6	Very high	38 Å²	38	15.6 Å²	15.6	20%	0.195	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	133	177	-61.9	171.6	0	0	0	108.1	T154 R155 N191 F192	I150-T154 WeakPolarHBondContact CA-O 3.34Å; I150-R155 HydrophobicContact CG1-CB 4.19Å; I150-R155 HydrophobicContact CG1-CG 4.35Å; I150-N191 HydrophobicContact CD1-CB 3.9Å; I150-F192 HydrophobicContact CD1-CD1 3.85Å; I150-F192 HydrophobicContact CG1-CD1 4.45Å; I150-F192 HydrophobicContact CG2-CB 4.48Å
151	F	93.4	Very high	96.7	Very high	25 Å²	25	12 Å²	12	11%	0.11	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	128.1	170.4	-175.7	-85.5	0	0	0	109.3	L21 A22 T23 F31 A79 R153 T154 F156	L21-F151 HydrophobicContact CB-CD2 4.31Å; L21-F151 HydrophobicContact CD1-CD2 4.4Å; A22-F151 WeakPolarHBondContact O-CE2 3.45Å; T23-F151 WeakPolarHBondContact OG1-CA 3.36Å; F31-F151 HydrophobicContact CB-CE1 3.99Å; F31-F151 HydrophobicContact CD1-CD1 4.3Å; F31-F151 HydrophobicContact CD1-CE1 4.19Å; F31-F151 AromaticContact CD2-CD1 3.69Å; F31-F151 HydrophobicContact CD2-CD1 3.69Å; F31-F151 AromaticContact CD2-CE1 3.63Å; F31-F151 HydrophobicContact CD2-CE1 3.63Å; F31-F151 HydrophobicContact CE1-CD1 4.26Å; F31-F151 AromaticContact CE2-CD1 3.64Å; F31-F151 HydrophobicContact CE2-CD1 3.64Å; F31-F151 HydrophobicContact CE2-CE1 4.1Å; F31-F151 HydrophobicContact CG-CD1 4.02Å; F31-F151 AromaticContact CG-CE1 3.67Å; F31-F151 HydrophobicContact CG-CE1 3.67Å; F31-F151 AromaticContact CZ-CD1 3.93Å; F31-F151 HydrophobicContact CZ-CD1 3.93Å; A79-F151 HydrophobicContact CB-CD1 3.99Å; A79-F151 HydrophobicContact CB-CE1 3.39Å; A79-F151 HydrophobicContact CB-CE2 4.08Å; A79-F151 HydrophobicContact CB-CZ 3.45Å; A79-F151 VanDerWaalsContact CB-CZ 3.45Å; F151-R153 VanDerWaalsContact C-N 3.29Å; F151-R153 PolarHBondContact O-N 2.98Å; F151-T154 PolarHBondContact N-O 3.09Å; F151-T154 WeakPolarHBondContact O-CA 3.48Å; F151-T154 WeakPolarHBondContact O-CB 3.38Å; F151-T154 PolarHBondContact O-N 2.88Å; F151-F156 HydrophobicContact CB-CE2 4.09Å
152	N	91.1	Very high	96.8	Very high	22 Å²	22	11.1 Å²	11.1	12%	0.118	5%	0.054	C	C	.	.	T	Hydrogen-bonded Turn	trans	44.6	54.2	-179.8	-73.8	8.5	0	0	0	111.3	T23 S24 F31 T154	T23-N152 PolarHBondContact OG1-N 2.86Å; T23-N152 PolarHBondContact OG1-OD1 2.84Å; S24-N152 PolarHBondContact N-OD1 3.42Å; F31-N152 HydrophobicContact CD1-CB 3.78Å; F31-N152 HydrophobicContact CE1-CB 3.74Å; N152-T154 PolarHBondContact O-N 2.84Å
153	R	90.2	Very high	96.9	Very high	63 Å²	63	10.7 Å²	10.7	24%	0.238	5%	0.052	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	18.5	-179	-58	178.7	62.9	74.2	10.1	115.3	V27 F151 E190 N191 F192 D193	V27-R153 HydrophobicContact CG1-CB 4.34Å; V27-R153 HydrophobicContact CG1-CG 4.48Å; V27-R153 HydrophobicContact CG2-CG 4.44Å; F151-R153 VanDerWaalsContact C-N 3.29Å; F151-R153 PolarHBondContact O-N 2.98Å; R153-E190 VanDerWaalsContact CZ-O 3.29Å; R153-E190 PolarHBondContact NH1-O 3.46Å; R153-E190 PolarHBondContact NH2-O 2.9Å; R153-N191 WeakPolarHBondContact CA-O 3.39Å; R153-F192 CarbonylContact O-C 3.43Å; R153-F192 WeakPolarHBondContact O-CA 3.45Å; R153-F192 VanDerWaalsContact O-CB 3.26Å; R153-F192 WeakPolarHBondContact O-CB 3.31Å; R153-D193 IonicContact CZ-OD1 3.88Å; R153-D193 IonicContact CZ-OD2 2.73Å; R153-D193 IonicContact NE-OD1 3.6Å; R153-D193 IonicContact NE-OD2 2.72Å; R153-D193 PolarHBondContact NE-OD2 3.19Å; R153-D193 IonicContact NH2-OD1 3.13Å; R153-D193 PolarHBondContact NH2-OD1 3.38Å; R153-D193 IonicContact NH2-OD2 3.56Å; R153-D193 PolarHBondContact NH2-OD2 3.16Å; R153-D193 PolarHBondContact O-N 3Å
154	T	92.8	Very high	96.9	Very high	4 Å²	4	10.2 Å²	10.2	3%	0.025	5%	0.048	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	125.8	164.9	-61.4	0	0	0	0	109	I150 F151 N152 F156 M194 V196 I295	I150-T154 WeakPolarHBondContact CA-O 3.34Å; F151-T154 PolarHBondContact N-O 3.09Å; F151-T154 WeakPolarHBondContact O-CA 3.48Å; F151-T154 WeakPolarHBondContact O-CB 3.38Å; F151-T154 PolarHBondContact O-N 2.88Å; N152-T154 PolarHBondContact O-N 2.84Å; T154-F156 HydrophobicContact CG2-CD1 4.29Å; T154-F156 HydrophobicContact CG2-CD2 4.14Å; T154-F156 HydrophobicContact CG2-CE1 3.77Å; T154-F156 HydrophobicContact CG2-CE2 3.56Å; T154-F156 HydrophobicContact CG2-CG 4.49Å; T154-F156 HydrophobicContact CG2-CZ 3.38Å; T154-M194 HydrophobicContact CG2-CE 4.48Å; T154-M194 HydrophobicContact CG2-CG 3.92Å; T154-M194 HydrophobicContact CG2-SD 4.47Å; T154-V196 HydrophobicContact CG2-CG2 4.15Å; T154-I295 HydrophobicContact CG2-CD1 3.82Å
155	R	94.7	Very high	96.9	Very high	10 Å²	10	11.2 Å²	11.2	4%	0.038	5%	0.054	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	130.5	169.7	178.7	-179	62.9	177.4	-1.5	110.1	F149 I150 I157 Q184 F192 M194 S195 V196	F149-R155 WeakPolarHBondContact O-CA 3.31Å; I150-R155 HydrophobicContact CG1-CB 4.19Å; I150-R155 HydrophobicContact CG1-CG 4.35Å; R155-I157 HydrophobicContact CG-CG1 4.29Å; R155-Q184 PolarHBondContact NH1-O 3.27Å; R155-F192 HydrophobicContact CB-CB 4.01Å; R155-F192 HydrophobicContact CB-CD1 3.83Å; R155-F192 HydrophobicContact CB-CD2 3.93Å; R155-F192 HydrophobicContact CB-CE1 4.27Å; R155-F192 HydrophobicContact CB-CE2 4.39Å; R155-F192 HydrophobicContact CB-CG 3.65Å; R155-F192 HydrophobicContact CG-CD1 4.44Å; R155-F192 HydrophobicContact CG-CE1 4.5Å; R155-F192 VanDerWaalsContact NH1-CZ 3.31Å; R155-M194 PolarHBondContact N-O 3.26Å; R155-S195 PolarHBondContact NE-OG 3.43Å; R155-S195 PolarHBondContact NH2-OG 2.78Å; R155-S195 CarbonylContact O-C 3.52Å; R155-S195 WeakPolarHBondContact O-CA 3.42Å; R155-V196 PolarHBondContact O-N 3.22Å
156	F	98.2	Very high	96.8	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	130.3	173.1	-62.2	-82.7	0	0	0	109.2	F31 F33 F80 T148 F149 F151 T154 V196 F198 I295	F31-F156 HydrophobicContact CE2-CE2 4.43Å; F31-F156 AromaticContact CE2-CZ 3.99Å; F31-F156 HydrophobicContact CE2-CZ 3.99Å; F31-F156 HydrophobicContact CZ-CE2 4.33Å; F31-F156 AromaticContact CZ-CZ 3.97Å; F31-F156 HydrophobicContact CZ-CZ 3.97Å; F33-F156 HydrophobicContact CD1-CZ 4.41Å; F33-F156 AromaticContact CE1-CE1 3.91Å; F33-F156 HydrophobicContact CE1-CE1 3.91Å; F33-F156 HydrophobicContact CE1-CZ 4.08Å; F33-F156 HydrophobicContact CZ-CE1 4.05Å; F80-F156 HydrophobicContact CE1-CD2 4.42Å; F80-F156 HydrophobicContact CE1-CE1 4.49Å; F80-F156 AromaticContact CE1-CE2 3.86Å; F80-F156 HydrophobicContact CE1-CE2 3.86Å; F80-F156 AromaticContact CE1-CZ 3.88Å; F80-F156 HydrophobicContact CE1-CZ 3.88Å; F80-F156 HydrophobicContact CZ-CD1 4.22Å; F80-F156 HydrophobicContact CZ-CD2 4.32Å; F80-F156 AromaticContact CZ-CE1 3.81Å; F80-F156 HydrophobicContact CZ-CE1 3.81Å; F80-F156 AromaticContact CZ-CE2 3.95Å; F80-F156 HydrophobicContact CZ-CE2 3.95Å; F80-F156 HydrophobicContact CZ-CG 4.43Å; F80-F156 AromaticContact CZ-CZ 3.66Å; F80-F156 HydrophobicContact CZ-CZ 3.66Å; T148-F156 VanDerWaalsContact CA-O 3.25Å; T148-F156 WeakPolarHBondContact CA-O 3.49Å; F149-F156 HydrophobicContact CD1-CB 3.78Å; F149-F156 HydrophobicContact CD2-CB 4.09Å; F149-F156 AromaticContact CD2-CD2 3.77Å; F149-F156 HydrophobicContact CD2-CD2 3.77Å; F149-F156 HydrophobicContact CD2-CG 4.29Å; F149-F156 HydrophobicContact CE1-CB 3.35Å; F149-F156 HydrophobicContact CE1-CG 4.14Å; F149-F156 HydrophobicContact CE2-CB 3.7Å; F149-F156 AromaticContact CE2-CD2 3.3Å; F149-F156 HydrophobicContact CE2-CD2 3.3Å; F149-F156 HydrophobicContact CE2-CE2 4.08Å; F149-F156 AromaticContact CE2-CG 3.63Å; F149-F156 HydrophobicContact CE2-CG 3.63Å; F149-F156 HydrophobicContact CG-CB 4.13Å; F149-F156 HydrophobicContact CZ-CB 3.3Å; F149-F156 HydrophobicContact CZ-CD1 4.36Å; F149-F156 AromaticContact CZ-CD2 3.76Å; F149-F156 HydrophobicContact CZ-CD2 3.76Å; F149-F156 AromaticContact CZ-CG 3.55Å; F149-F156 HydrophobicContact CZ-CG 3.55Å; F149-F156 PolarHBondContact N-O 3.32Å; F149-F156 VanDerWaalsContact N-O 3.09Å; F149-F156 PolarHBondContact O-N 2.94Å; F151-F156 HydrophobicContact CB-CE2 4.09Å; T154-F156 HydrophobicContact CG2-CD1 4.29Å; T154-F156 HydrophobicContact CG2-CD2 4.14Å; T154-F156 HydrophobicContact CG2-CE1 3.77Å; T154-F156 HydrophobicContact CG2-CE2 3.56Å; T154-F156 HydrophobicContact CG2-CG 4.49Å; T154-F156 HydrophobicContact CG2-CZ 3.38Å; F156-V196 CarbonylContact C-O 3.59Å; F156-V196 WeakPolarHBondContact CA-O 3.47Å; F156-V196 HydrophobicContact CD1-CB 3.76Å; F156-V196 HydrophobicContact CD1-CG1 4.26Å; F156-V196 HydrophobicContact CD1-CG2 4.47Å; F156-V196 HydrophobicContact CE1-CB 3.9Å; F156-V196 HydrophobicContact CE1-CG1 4.36Å; F156-V196 HydrophobicContact CE1-CG2 4.15Å; F156-F198 HydrophobicContact CB-CD2 4.26Å; F156-F198 HydrophobicContact CB-CE2 4.09Å; F156-F198 HydrophobicContact CD1-CD2 4.12Å; F156-F198 AromaticContact CD1-CE2 3.27Å; F156-F198 HydrophobicContact CD1-CE2 3.27Å; F156-F198 AromaticContact CD1-CZ 3.92Å; F156-F198 HydrophobicContact CD1-CZ 3.92Å; F156-F198 AromaticContact CE1-CE2 3.96Å; F156-F198 HydrophobicContact CE1-CE2 3.96Å; F156-F198 HydrophobicContact CE1-CZ 4.17Å; F156-F198 AromaticContact CG-CE2 3.97Å; F156-F198 HydrophobicContact CG-CE2 3.97Å; F156-I295 HydrophobicContact CE1-CD1 4.27Å; F156-I295 HydrophobicContact CZ-CD1 4.04Å
157	I	98.7	Very high	96.7	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	114	-179.1	-51.3	177.1	0	0	0	107.8	T148 R155 L159 W180 V196 V197 F198 I234	T148-I157 HydrophobicContact CG2-CB 4.47Å; T148-I157 HydrophobicContact CG2-CG1 4.17Å; T148-I157 HydrophobicContact CG2-CG2 4.31Å; R155-I157 HydrophobicContact CG-CG1 4.29Å; I157-L159 HydrophobicContact CG2-CD2 3.71Å; I157-W180 HydrophobicContact CG2-CH2 3.86Å; I157-W180 HydrophobicContact CG2-CZ3 4.31Å; I157-V196 PolarHBondContact N-O 3.21Å; I157-V197 HydrophobicContact CB-CG2 4.45Å; I157-V197 CarbonylContact O-C 3.43Å; I157-V197 WeakPolarHBondContact O-CA 3.37Å; I157-F198 PolarHBondContact O-N 2.85Å; I157-I234 HydrophobicContact CD1-CD1 3.95Å
158	V	98.9	Very high	96.6	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	123.8	-179	-180	0	0	0	0	109.1	I82 L120 Y146 F147 F149 F198	I82-V158 HydrophobicContact CD1-CG2 4.2Å; L120-V158 HydrophobicContact CB-CG1 3.4Å; L120-V158 HydrophobicContact CD2-CG1 3.95Å; L120-V158 HydrophobicContact CG-CG1 4.33Å; Y146-V158 VanDerWaalsContact CA-O 3.28Å; Y146-V158 WeakPolarHBondContact CA-O 3.45Å; Y146-V158 VanDerWaalsContact CB-O 3.31Å; Y146-V158 WeakPolarHBondContact CB-O 3Å; F147-V158 HydrophobicContact CD1-CB 4.21Å; F147-V158 HydrophobicContact CD1-CG1 4.28Å; F147-V158 HydrophobicContact CD2-CB 4.24Å; F147-V158 HydrophobicContact CD2-CG2 4.13Å; F147-V158 HydrophobicContact CE1-CB 4.02Å; F147-V158 HydrophobicContact CE1-CG1 3.77Å; F147-V158 HydrophobicContact CE1-CG2 4.37Å; F147-V158 HydrophobicContact CE2-CB 4.06Å; F147-V158 HydrophobicContact CE2-CG2 3.64Å; F147-V158 HydrophobicContact CG-CB 4.31Å; F147-V158 HydrophobicContact CZ-CB 3.94Å; F147-V158 HydrophobicContact CZ-CG1 3.9Å; F147-V158 HydrophobicContact CZ-CG2 3.77Å; F147-V158 PolarHBondContact N-O 3.48Å; F147-V158 VanDerWaalsContact N-O 3.16Å; F147-V158 PolarHBondContact O-N 3.21Å; F149-V158 HydrophobicContact CD1-CG2 4.38Å; F149-V158 HydrophobicContact CE1-CG2 3.93Å; V158-F198 WeakPolarHBondContact CA-O 3.23Å; V158-F198 HydrophobicContact CG2-CB 4.37Å; V158-F198 HydrophobicContact CG2-CD2 4.46Å
159	L	98.9	Very high	96.6	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.123	C	C	.	.			trans	-111.5	139.2	-174.9	-52.9	-176.8	0	0	0	111.8	I157 T161 F177 W180 F181 V197 F198 Q199 F203	I157-L159 HydrophobicContact CG2-CD2 3.71Å; L159-T161 PolarHBondContact O-N 2.8Å; L159-F177 HydrophobicContact CB-CE2 4.21Å; L159-F177 HydrophobicContact CB-CZ 4.09Å; L159-F177 HydrophobicContact CD2-CE2 3.87Å; L159-F177 HydrophobicContact CD2-CZ 3.97Å; L159-F177 HydrophobicContact CG-CZ 4.46Å; L159-W180 HydrophobicContact CD2-CH2 4.47Å; L159-W180 HydrophobicContact CD2-CZ3 3.93Å; L159-F181 HydrophobicContact CD1-CE2 4.5Å; L159-F181 HydrophobicContact CD2-CD2 3.92Å; L159-F181 HydrophobicContact CD2-CE2 4.28Å; L159-V197 HydrophobicContact CD1-CG1 3.56Å; L159-V197 HydrophobicContact CG-CG1 3.9Å; L159-F198 PolarHBondContact N-O 3.22Å; L159-Q199 HydrophobicContact CB-CB 4.16Å; L159-F203 HydrophobicContact CD1-CZ 4.35Å
160	N	98.8	Very high	96.5	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.125	C	C	.	.			trans	-87	98.8	160.8	-178.8	-11.6	0	0	0	108.7	P121 D145 Y146 Q162 Y163	P121-N160 HydrophobicContact CG-CB 4.03Å; D145-N160 HydrophobicContact CB-CB 4.3Å; D145-N160 WeakPolarHBondContact O-CB 3.13Å; D145-N160 PolarHBondContact OD2-ND2 3.12Å; Y146-N160 HydrophobicContact CD1-CB 4.31Å; N160-Q162 VanDerWaalsContact C-N 3.26Å; N160-Q162 PolarHBondContact O-N 2.91Å; N160-Q162 WeakPolarHBondContact OD1-CB 3.02Å; N160-Q162 PolarHBondContact OD1-N 2.78Å; N160-Q162 VanDerWaalsContact OD1-N 3.08Å; N160-Y163 HydrophobicContact CB-CD2 3.77Å; N160-Y163 HydrophobicContact CB-CE2 3.75Å; N160-Y163 VanDerWaalsContact ND2-CE2 3.29Å; N160-Y163 WeakPolarHBondContact ND2-CE2 3.47Å
161	T	98.7	Very high	96.7	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-17.9	-177.6	39.1	0	0	0	0	114.3	L159 Y163 L164 V165 Q199 T201 I217	L159-T161 PolarHBondContact O-N 2.8Å; T161-Y163 PolarHBondContact O-N 2.9Å; T161-L164 WeakPolarHBondContact O-CA 3.35Å; T161-L164 WeakPolarHBondContact O-CB 3.29Å; T161-L164 PolarHBondContact O-N 2.92Å; T161-V165 PolarHBondContact O-N 2.86Å; T161-Q199 HydrophobicContact CG2-CB 3.64Å; T161-Q199 HydrophobicContact CG2-CG 4.14Å; T161-T201 PolarHBondContact OG1-N 3.06Å; T161-T201 VanDerWaalsContact OG1-N 3.12Å; T161-T201 PolarHBondContact OG1-OG1 2.89Å; T161-I217 HydrophobicContact CG2-CD1 3.95Å
162	Q	98.4	Very high	96.9	Very high	2 Å²	2	29.6 Å²	29.6	1%	0.009	16%	0.161	C	C	.	.	H	α-helix	trans	-65.5	-23.3	180	-69.2	-56.3	-58.9	0	0	113	N123 V126 G127 P130 N160 L164 V165 N166	N123-Q162 VanDerWaalsContact CB-CD 3.43Å; N123-Q162 HydrophobicContact CB-CG 4.16Å; V126-Q162 HydrophobicContact CG2-CB 3.72Å; V126-Q162 HydrophobicContact CG2-CG 3.6Å; G127-Q162 PolarHBondContact O-OE1 3.11Å; P130-Q162 HydrophobicContact CG-CB 3.83Å; N160-Q162 VanDerWaalsContact C-N 3.26Å; N160-Q162 PolarHBondContact O-N 2.91Å; N160-Q162 WeakPolarHBondContact OD1-CB 3.02Å; N160-Q162 PolarHBondContact OD1-N 2.78Å; N160-Q162 VanDerWaalsContact OD1-N 3.08Å; Q162-L164 PolarHBondContact O-N 2.89Å; Q162-V165 PolarHBondContact O-N 2.82Å; Q162-N166 CarbonylContact O-C 3.59Å; Q162-N166 PolarHBondContact O-N 2.81Å
163	Y	98.5	Very high	97.2	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-66.5	-17.6	168.9	-64.3	-42.9	0	0	0	114.5	V135 D145 Y146 N160 T161 N167 C170 A174 F177	V135-Y163 WeakPolarHBondContact CG1-OH 3.33Å; V135-Y163 HydrophobicContact CG2-CE1 4.28Å; V135-Y163 WeakPolarHBondContact CG2-OH 3.12Å; D145-Y163 WeakPolarHBondContact OD2-CE2 3.15Å; D145-Y163 VanDerWaalsContact OD2-CZ 3.3Å; D145-Y163 PolarHBondContact OD2-OH 2.84Å; Y146-Y163 HydrophobicContact CD1-CD2 4.47Å; Y146-Y163 AromaticContact CD1-CE2 3.81Å; Y146-Y163 HydrophobicContact CD1-CE2 3.81Å; Y146-Y163 HydrophobicContact CE1-CD2 4.46Å; Y146-Y163 AromaticContact CE1-CE2 3.68Å; Y146-Y163 HydrophobicContact CE1-CE2 3.68Å; N160-Y163 HydrophobicContact CB-CD2 3.77Å; N160-Y163 HydrophobicContact CB-CE2 3.75Å; N160-Y163 VanDerWaalsContact ND2-CE2 3.29Å; N160-Y163 WeakPolarHBondContact ND2-CE2 3.47Å; T161-Y163 PolarHBondContact O-N 2.9Å; Y163-N167 WeakPolarHBondContact O-CB 3.15Å; Y163-N167 PolarHBondContact O-ND2 2.91Å; Y163-C170 HydrophobicContact CE1-CB 4.34Å; Y163-A174 HydrophobicContact CD1-CB 4.01Å; Y163-A174 HydrophobicContact CG-CB 4.12Å; Y163-F177 HydrophobicContact CD2-CB 3.68Å; Y163-F177 HydrophobicContact CD2-CD1 4.02Å; Y163-F177 HydrophobicContact CD2-CD2 4.16Å; Y163-F177 AromaticContact CD2-CG 3.67Å; Y163-F177 HydrophobicContact CD2-CG 3.67Å; Y163-F177 HydrophobicContact CE2-CB 4.17Å; Y163-F177 HydrophobicContact CE2-CG 4.44Å; Y163-F177 HydrophobicContact CG-CB 4.39Å; Y163-F177 HydrophobicContact CG-CD1 4.41Å; Y163-F177 HydrophobicContact CG-CG 4.44Å
164	L	98.4	Very high	97.6	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-101.1	-33.3	175.8	-56.1	-177.7	0	0	0	111.8	T161 Q162 F177 R178 F203 I217 Y221 F225	T161-L164 WeakPolarHBondContact O-CA 3.35Å; T161-L164 WeakPolarHBondContact O-CB 3.29Å; T161-L164 PolarHBondContact O-N 2.92Å; Q162-L164 PolarHBondContact O-N 2.89Å; L164-F177 HydrophobicContact CD1-CE1 4.23Å; L164-F177 HydrophobicContact CD2-CD1 4.44Å; L164-F177 HydrophobicContact CD2-CE1 3.9Å; L164-F177 HydrophobicContact CG-CE1 3.94Å; L164-R178 HydrophobicContact CD2-CG 4.42Å; L164-F203 HydrophobicContact CD1-CE1 4.39Å; L164-I217 HydrophobicContact CB-CD1 4.17Å; L164-I217 HydrophobicContact CB-CG2 4.03Å; L164-Y221 HydrophobicContact CB-CD2 4.34Å; L164-Y221 HydrophobicContact CB-CG 4.29Å; L164-Y221 HydrophobicContact CD2-CD1 3.92Å; L164-Y221 HydrophobicContact CD2-CE1 4.41Å; L164-Y221 HydrophobicContact CD2-CG 4.04Å; L164-Y221 WeakPolarHBondContact O-CD2 3.32Å; L164-Y221 WeakPolarHBondContact O-CE2 3.36Å; L164-F225 HydrophobicContact CD1-CD1 3.96Å; L164-F225 HydrophobicContact CD1-CD2 4.18Å; L164-F225 HydrophobicContact CD1-CE1 3.79Å; L164-F225 HydrophobicContact CD1-CE2 4.02Å; L164-F225 HydrophobicContact CD1-CG 4.16Å; L164-F225 HydrophobicContact CD1-CZ 3.83Å; L164-F225 HydrophobicContact CD2-CD2 4.45Å; L164-F225 HydrophobicContact CD2-CE1 4.45Å; L164-F225 HydrophobicContact CD2-CE2 3.66Å; L164-F225 HydrophobicContact CD2-CZ 3.67Å; L164-F225 HydrophobicContact CG-CZ 4.33Å
165	V	98.2	Very high	97.8	Very high	47 Å²	47	30.5 Å²	30.5	29%	0.285	17%	0.173	S	C	.	.	H	α-helix	trans	-67.6	-56.7	176.8	175.7	0	0	0	0	110.6	T161 Q162 T201 I217	T161-V165 PolarHBondContact O-N 2.86Å; Q162-V165 PolarHBondContact O-N 2.82Å; V165-T201 HydrophobicContact CG2-CG2 4.07Å; V165-I217 HydrophobicContact CG2-CD1 3.48Å; V165-I217 VanDerWaalsContact CG2-CD1 3.48Å
166	N	97.3	Very high	98	Very high	48 Å²	48	34.9 Å²	34.9	26%	0.257	19%	0.193	S	C	.	.			trans	-155.9	96.6	179.9	-161.4	-34	0	0	0	112.8	N128 H129 P130 Q162 S168	N128-N166 WeakPolarHBondContact O-CB 3.47Å; H129-N166 PolarHBondContact CD2-ND2 3.09Å; H129-N166 PolarHBondContact NE2-ND2 3.13Å; H129-N166 VanDerWaalsContact NE2-ND2 3.17Å; P130-N166 WeakPolarHBondContact CD-O 3.44Å; Q162-N166 CarbonylContact O-C 3.59Å; Q162-N166 PolarHBondContact O-N 2.81Å; N166-S168 VanDerWaalsContact OD1-CB 3.31Å; N166-S168 WeakPolarHBondContact OD1-CB 3.17Å; N166-S168 PolarHBondContact OD1-N 2.79Å; N166-S168 PolarHBondContact OD1-OG 3.02Å
167	N	96.3	Very high	98	Very high	23 Å²	23	34.9 Å²	34.9	12%	0.123	19%	0.193	C	C	.	.			trans	-96.1	19.6	179.8	58.7	33	0	0	0	114.4	Y163 K169 C170 L171 A174 R178 Y221	Y163-N167 WeakPolarHBondContact O-CB 3.15Å; Y163-N167 PolarHBondContact O-ND2 2.91Å; N167-K169 PolarHBondContact O-N 3.39Å; N167-C170 CarbonylContact O-C 3.58Å; N167-C170 PolarHBondContact O-N 2.89Å; N167-L171 PolarHBondContact O-N 2.92Å; N167-A174 HydrophobicContact CB-CB 3.47Å; N167-A174 VanDerWaalsContact CB-CB 3.47Å; N167-R178 PolarHBondContact ND2-NH1 2.65Å; N167-R178 VanDerWaalsContact ND2-NH1 3.18Å; N167-Y221 PolarHBondContact ND2-OH 2.91Å
168	S	97.5	Very high	98	Very high	84 Å²	84	36.5 Å²	36.5	59%	0.587	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-25.4	-172.6	69.5	0	0	0	0	114	N166	N166-S168 VanDerWaalsContact OD1-CB 3.31Å; N166-S168 WeakPolarHBondContact OD1-CB 3.17Å; N166-S168 PolarHBondContact OD1-N 2.79Å; N166-S168 PolarHBondContact OD1-OG 3.02Å
169	K	98	Very high	98	Very high	136 Å²	136	42.2 Å²	42.2	59%	0.591	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108	-1.2	179.3	-66.7	-173.9	-179.2	177.2	0	114.6	D131 N167	D131-K169 HydrophobicContact CB-CB 4.04Å; D131-K169 HydrophobicContact CB-CD 4.44Å; N167-K169 PolarHBondContact O-N 3.39Å
170	C	95.8	Very high	98	Very high	7 Å²	7	43.1 Å²	43.1	5%	0.047	23%	0.23	C	C	.	.			trans	-141.1	35.5	-175.1	60	0	0	0	0	112.9	P130 Y163 N167 S172 S173 A174	P130-C170 VanDerWaalsContact O-CB 3.25Å; P130-C170 WeakPolarHBondContact O-CB 3.36Å; P130-C170 PolarHBondContact O-SG 2.82Å; Y163-C170 HydrophobicContact CE1-CB 4.34Å; N167-C170 CarbonylContact O-C 3.58Å; N167-C170 PolarHBondContact O-N 2.89Å; C170-S172 PolarHBondContact O-N 3.46Å; C170-S172 VanDerWaalsContact O-N 3.13Å; C170-S173 PolarHBondContact O-N 2.92Å; C170-S173 VanDerWaalsContact O-N 3.1Å; C170-A174 PolarHBondContact O-N 3.28Å
171	L	97.3	Very high	98	Very high	96 Å²	96	43.2 Å²	43.2	50%	0.503	23%	0.23	S	C	.	.	H	α-helix	trans	-54.3	-36.7	-174.5	-175.4	61.4	0	0	0	113.8	N167 A174 N175	N167-L171 PolarHBondContact O-N 2.92Å; L171-A174 PolarHBondContact O-N 3.35Å; L171-N175 WeakPolarHBondContact O-CB 3.43Å; L171-N175 VanDerWaalsContact O-CG 3.3Å; L171-N175 PolarHBondContact O-N 3.3Å; L171-N175 PolarHBondContact O-ND2 3.17Å
172	S	97.7	Very high	98	Very high	80 Å²	80	46.3 Å²	46.3	56%	0.559	25%	0.246	S	C	*	.	H	α-helix	trans	-62	-54.1	176	-164.2	0	0	0	0	111.4	C170 A174 N175 E176	C170-S172 PolarHBondContact O-N 3.46Å; C170-S172 VanDerWaalsContact O-N 3.13Å; S172-A174 VanDerWaalsContact C-N 3.27Å; S172-A174 PolarHBondContact O-N 3.28Å; S172-N175 WeakPolarHBondContact O-CB 3.13Å; S172-N175 PolarHBondContact O-N 3.5Å; S172-N175 VanDerWaalsContact O-N 3.09Å; S172-E176 PolarHBondContact O-N 3.45Å
173	S	97.8	Very high	97.9	Very high	29 Å²	29	50.4 Å²	50.4	20%	0.203	27%	0.266	C	S	.	.	H	α-helix	trans	-60.3	-37.7	178	-49.4	0	0	0	0	112.1	C170 E176 F177	C170-S173 PolarHBondContact O-N 2.92Å; C170-S173 VanDerWaalsContact O-N 3.1Å; S173-E176 PolarHBondContact O-N 3.47Å; S173-F177 WeakPolarHBondContact O-CB 3.46Å; S173-F177 PolarHBondContact O-N 2.64Å
174	A	98.1	Very high	97.9	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-67.9	-35.7	175.9	0	0	0	0	0	112.8	Y163 N167 C170 L171 S172 R178	Y163-A174 HydrophobicContact CD1-CB 4.01Å; Y163-A174 HydrophobicContact CG-CB 4.12Å; N167-A174 HydrophobicContact CB-CB 3.47Å; N167-A174 VanDerWaalsContact CB-CB 3.47Å; C170-A174 PolarHBondContact O-N 3.28Å; L171-A174 PolarHBondContact O-N 3.35Å; S172-A174 VanDerWaalsContact C-N 3.27Å; S172-A174 PolarHBondContact O-N 3.28Å; A174-R178 WeakPolarHBondContact O-CG 3.45Å; A174-R178 PolarHBondContact O-N 2.87Å
175	N	98.4	Very high	97.8	Very high	79 Å²	79	51.7 Å²	51.7	42%	0.422	27%	0.272	S	S	.	.	H	α-helix	trans	-66.5	-45.6	172.5	-79	-34.5	0	0	0	111.5	L171 S172 F177 R178 Q179	L171-N175 WeakPolarHBondContact O-CB 3.43Å; L171-N175 VanDerWaalsContact O-CG 3.3Å; L171-N175 PolarHBondContact O-N 3.3Å; L171-N175 PolarHBondContact O-ND2 3.17Å; S172-N175 WeakPolarHBondContact O-CB 3.13Å; S172-N175 PolarHBondContact O-N 3.5Å; S172-N175 VanDerWaalsContact O-N 3.09Å; N175-F177 VanDerWaalsContact C-N 3.33Å; N175-F177 PolarHBondContact O-N 2.84Å; N175-R178 PolarHBondContact O-N 3.19Å; N175-R178 PolarHBondContact OD1-NH2 3.26Å; N175-Q179 WeakPolarHBondContact O-CB 3.3Å; N175-Q179 PolarHBondContact O-N 3.31Å
176	E	98.4	Very high	97.6	Very high	101 Å²	101	53.2 Å²	53.2	47%	0.472	29%	0.285	S	S	.	.	H	α-helix	trans	-59.3	-44.7	175.4	-71.5	170.1	-160.8	0	0	111.2	S172 S173 R178 Q179 W180	S172-E176 PolarHBondContact O-N 3.45Å; S173-E176 PolarHBondContact O-N 3.47Å; E176-R178 PolarHBondContact O-N 2.9Å; E176-Q179 PolarHBondContact O-N 2.83Å; E176-W180 VanDerWaalsContact O-CB 3.29Å; E176-W180 WeakPolarHBondContact O-CB 3.34Å; E176-W180 PolarHBondContact O-N 2.64Å
177	F	98.6	Very high	97.4	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-57.6	-47.4	174.1	165.1	-105.3	0	0	0	112.1	Y146 L159 Y163 L164 S173 N175 W180 F181 F225	Y146-F177 AromaticContact CD1-CD2 3.83Å; Y146-F177 HydrophobicContact CD1-CD2 3.83Å; Y146-F177 AromaticContact CD2-CD2 3.94Å; Y146-F177 HydrophobicContact CD2-CD2 3.94Å; Y146-F177 HydrophobicContact CE1-CB 4.02Å; Y146-F177 HydrophobicContact CE1-CD2 4.15Å; Y146-F177 HydrophobicContact CE2-CD2 4.27Å; Y146-F177 AromaticContact CG-CD2 3.69Å; Y146-F177 HydrophobicContact CG-CD2 3.69Å; Y146-F177 HydrophobicContact CG-CE2 4.25Å; L159-F177 HydrophobicContact CB-CE2 4.21Å; L159-F177 HydrophobicContact CB-CZ 4.09Å; L159-F177 HydrophobicContact CD2-CE2 3.87Å; L159-F177 HydrophobicContact CD2-CZ 3.97Å; L159-F177 HydrophobicContact CG-CZ 4.46Å; Y163-F177 HydrophobicContact CD2-CB 3.68Å; Y163-F177 HydrophobicContact CD2-CD1 4.02Å; Y163-F177 HydrophobicContact CD2-CD2 4.16Å; Y163-F177 AromaticContact CD2-CG 3.67Å; Y163-F177 HydrophobicContact CD2-CG 3.67Å; Y163-F177 HydrophobicContact CE2-CB 4.17Å; Y163-F177 HydrophobicContact CE2-CG 4.44Å; Y163-F177 HydrophobicContact CG-CB 4.39Å; Y163-F177 HydrophobicContact CG-CD1 4.41Å; Y163-F177 HydrophobicContact CG-CG 4.44Å; L164-F177 HydrophobicContact CD1-CE1 4.23Å; L164-F177 HydrophobicContact CD2-CD1 4.44Å; L164-F177 HydrophobicContact CD2-CE1 3.9Å; L164-F177 HydrophobicContact CG-CE1 3.94Å; S173-F177 WeakPolarHBondContact O-CB 3.46Å; S173-F177 PolarHBondContact O-N 2.64Å; N175-F177 VanDerWaalsContact C-N 3.33Å; N175-F177 PolarHBondContact O-N 2.84Å; F177-W180 HydrophobicContact CD2-CE3 4.13Å; F177-W180 HydrophobicContact CD2-CZ3 4.33Å; F177-W180 HydrophobicContact CE2-CE3 4.28Å; F177-W180 HydrophobicContact CE2-CZ3 4.08Å; F177-W180 PolarHBondContact O-N 3.23Å; F177-F181 WeakPolarHBondContact O-CB 3.09Å; F177-F181 PolarHBondContact O-N 3.48Å; F177-F225 HydrophobicContact CE1-CE1 4.04Å; F177-F225 AromaticContact CE1-CZ 3.92Å; F177-F225 HydrophobicContact CE1-CZ 3.92Å; F177-F225 HydrophobicContact CZ-CE1 4.16Å; F177-F225 HydrophobicContact CZ-CZ 4.48Å
178	R	98.5	Very high	96.7	Very high	35 Å²	35	62.6 Å²	62.6	13%	0.132	32%	0.324	C	S	.	.	H	α-helix	trans	-65.7	-38.6	178.2	-76	-169.2	-65.7	-91.9	5	112.5	L164 N167 A174 N175 E176 F181 N182 F225	L164-R178 HydrophobicContact CD2-CG 4.42Å; N167-R178 PolarHBondContact ND2-NH1 2.65Å; N167-R178 VanDerWaalsContact ND2-NH1 3.18Å; A174-R178 WeakPolarHBondContact O-CG 3.45Å; A174-R178 PolarHBondContact O-N 2.87Å; N175-R178 PolarHBondContact O-N 3.19Å; N175-R178 PolarHBondContact OD1-NH2 3.26Å; E176-R178 PolarHBondContact O-N 2.9Å; R178-F181 PolarHBondContact O-N 3.32Å; R178-N182 VanDerWaalsContact O-CG 3.31Å; R178-N182 PolarHBondContact O-N 2.71Å; R178-N182 VanDerWaalsContact O-N 3.14Å; R178-N182 PolarHBondContact O-ND2 3.23Å; R178-F225 HydrophobicContact CG-CE2 4.28Å; R178-F225 HydrophobicContact CG-CZ 4.07Å
179	Q	98.6	Very high	95.7	Very high	119 Å²	119	61.6 Å²	61.6	56%	0.556	31%	0.312	S	S	*	.	H	α-helix	trans	-63.3	-51.7	175	-177.2	-175.5	-33	0	0	110.3	N175 E176 F181 N182 E183	N175-Q179 WeakPolarHBondContact O-CB 3.3Å; N175-Q179 PolarHBondContact O-N 3.31Å; E176-Q179 PolarHBondContact O-N 2.83Å; Q179-F181 VanDerWaalsContact C-N 3.27Å; Q179-F181 PolarHBondContact O-N 3.47Å; Q179-N182 PolarHBondContact O-N 3.43Å; Q179-N182 VanDerWaalsContact O-N 3.11Å; Q179-E183 WeakPolarHBondContact CG-OE1 3.31Å; Q179-E183 PolarHBondContact NE2-OE1 3.01Å; Q179-E183 WeakPolarHBondContact O-CG 3.43Å; Q179-E183 PolarHBondContact O-N 3.18Å
180	W	98.7	Very high	94.9	Very high	20 Å²	20	63.1 Å²	63.1	8%	0.076	32%	0.322	C	S	.	.	H	α-helix	trans	-54.7	-43.4	176.1	168.2	85.1	0	0	0	111.8	Y146 T148 I157 L159 E176 F177 N182 E183 Q184	Y146-W180 AromaticContact CD2-CD2 3.63Å; Y146-W180 HydrophobicContact CD2-CD2 3.63Å; Y146-W180 AromaticContact CD2-CE2 3.95Å; Y146-W180 AromaticContact CD2-CE3 3.53Å; Y146-W180 HydrophobicContact CD2-CE3 3.53Å; Y146-W180 HydrophobicContact CD2-CG 4.24Å; Y146-W180 HydrophobicContact CD2-CH2 4.09Å; Y146-W180 HydrophobicContact CD2-CZ2 4.17Å; Y146-W180 AromaticContact CD2-CZ3 3.78Å; Y146-W180 HydrophobicContact CD2-CZ3 3.78Å; Y146-W180 HydrophobicContact CE2-CB 4.2Å; Y146-W180 AromaticContact CE2-CD2 3.78Å; Y146-W180 HydrophobicContact CE2-CD2 3.78Å; Y146-W180 AromaticContact CE2-CE3 3.96Å; Y146-W180 HydrophobicContact CE2-CE3 3.96Å; Y146-W180 AromaticContact CE2-CG 3.88Å; Y146-W180 HydrophobicContact CE2-CG 3.88Å; Y146-W180 HydrophobicContact CG-CE3 4.47Å; Y146-W180 HydrophobicContact CG-CZ3 4.42Å; T148-W180 HydrophobicContact CG2-CH2 4.25Å; T148-W180 HydrophobicContact CG2-CZ2 3.79Å; I157-W180 HydrophobicContact CG2-CH2 3.86Å; I157-W180 HydrophobicContact CG2-CZ3 4.31Å; L159-W180 HydrophobicContact CD2-CH2 4.47Å; L159-W180 HydrophobicContact CD2-CZ3 3.93Å; E176-W180 VanDerWaalsContact O-CB 3.29Å; E176-W180 WeakPolarHBondContact O-CB 3.34Å; E176-W180 PolarHBondContact O-N 2.64Å; F177-W180 HydrophobicContact CD2-CE3 4.13Å; F177-W180 HydrophobicContact CD2-CZ3 4.33Å; F177-W180 HydrophobicContact CE2-CE3 4.28Å; F177-W180 HydrophobicContact CE2-CZ3 4.08Å; F177-W180 PolarHBondContact O-N 3.23Å; W180-N182 PolarHBondContact O-N 3.09Å; W180-E183 WeakPolarHBondContact O-CB 3.38Å; W180-E183 PolarHBondContact O-N 2.85Å; W180-Q184 HydrophobicContact CD2-CG 3.92Å; W180-Q184 HydrophobicContact CE3-CG 4.33Å; W180-Q184 HydrophobicContact CG-CG 4.49Å; W180-Q184 HydrophobicContact CH2-CG 4.05Å; W180-Q184 HydrophobicContact CZ2-CG 3.6Å; W180-Q184 HydrophobicContact CZ3-CG 4.38Å; W180-Q184 VanDerWaalsContact NE1-NE2 3.14Å; W180-Q184 WeakPolarHBondContact O-CG 3.41Å; W180-Q184 PolarHBondContact O-N 3.03Å
181	F	98.7	Very high	94.3	Very high	1 Å²	1	67.2 Å²	67.2	0%	0.004	34%	0.343	C	S	.	.	H	α-helix	trans	-59.2	-47.2	177.4	175.2	-103.1	0	0	0	111.6	L159 F177 R178 Q179 E183 Q184 L185 F225 K228 L229	L159-F181 HydrophobicContact CD1-CE2 4.5Å; L159-F181 HydrophobicContact CD2-CD2 3.92Å; L159-F181 HydrophobicContact CD2-CE2 4.28Å; F177-F181 WeakPolarHBondContact O-CB 3.09Å; F177-F181 PolarHBondContact O-N 3.48Å; R178-F181 PolarHBondContact O-N 3.32Å; Q179-F181 VanDerWaalsContact C-N 3.27Å; Q179-F181 PolarHBondContact O-N 3.47Å; F181-E183 VanDerWaalsContact C-N 3.3Å; F181-E183 PolarHBondContact O-N 2.89Å; F181-Q184 WeakPolarHBondContact O-CB 3.4Å; F181-Q184 PolarHBondContact O-N 2.95Å; F181-Q184 VanDerWaalsContact O-N 3.16Å; F181-L185 HydrophobicContact CD1-CD1 4.13Å; F181-L185 HydrophobicContact CE1-CD1 3.5Å; F181-L185 HydrophobicContact CE1-CG 4.17Å; F181-L185 HydrophobicContact CE2-CD2 4.31Å; F181-L185 HydrophobicContact CE2-CG 4.47Å; F181-L185 HydrophobicContact CZ-CD1 3.75Å; F181-L185 HydrophobicContact CZ-CD2 4.15Å; F181-L185 HydrophobicContact CZ-CG 4.14Å; F181-L185 WeakPolarHBondContact O-CG 3.35Å; F181-L185 PolarHBondContact O-N 3.19Å; F181-F225 HydrophobicContact CB-CE1 4.37Å; F181-F225 AromaticContact CD1-CD1 3.95Å; F181-F225 HydrophobicContact CD1-CD1 3.95Å; F181-F225 AromaticContact CD1-CE1 3.51Å; F181-F225 HydrophobicContact CD1-CE1 3.51Å; F181-F225 AromaticContact CD1-CZ 3.87Å; F181-F225 HydrophobicContact CD1-CZ 3.87Å; F181-F225 HydrophobicContact CD2-CD1 4.33Å; F181-F225 AromaticContact CD2-CE1 3.9Å; F181-F225 HydrophobicContact CD2-CE1 3.9Å; F181-F225 AromaticContact CE1-CD1 3.51Å; F181-F225 HydrophobicContact CE1-CD1 3.51Å; F181-F225 AromaticContact CE1-CE1 3.61Å; F181-F225 HydrophobicContact CE1-CE1 3.61Å; F181-F225 HydrophobicContact CE1-CG 4.06Å; F181-F225 HydrophobicContact CE1-CZ 4.21Å; F181-F225 AromaticContact CE2-CD1 3.94Å; F181-F225 HydrophobicContact CE2-CD1 3.94Å; F181-F225 AromaticContact CE2-CE1 4Å; F181-F225 HydrophobicContact CE2-CE1 4Å; F181-F225 HydrophobicContact CG-CD1 4.33Å; F181-F225 AromaticContact CG-CE1 3.65Å; F181-F225 HydrophobicContact CG-CE1 3.65Å; F181-F225 HydrophobicContact CG-CZ 4.2Å; F181-F225 AromaticContact CZ-CD1 3.51Å; F181-F225 HydrophobicContact CZ-CD1 3.51Å; F181-F225 AromaticContact CZ-CE1 3.85Å; F181-F225 HydrophobicContact CZ-CE1 3.85Å; F181-F225 HydrophobicContact CZ-CG 4.28Å; F181-K228 HydrophobicContact CE1-CB 4.41Å; F181-K228 HydrophobicContact CE1-CD 4.32Å; F181-L229 HydrophobicContact CE2-CD2 3.98Å; F181-L229 HydrophobicContact CZ-CD2 3.79Å; F181-L229 HydrophobicContact CZ-CG 3.96Å
182	N	98.4	Very high	94	Very high	65 Å²	65	63.8 Å²	63.8	35%	0.348	32%	0.324	S	S	.	.	H	α-helix	trans	-62.3	-38.4	176.2	-64.2	-41.2	0	0	0	112	R178 Q179 W180 L185 S186 K228	R178-N182 VanDerWaalsContact O-CG 3.31Å; R178-N182 PolarHBondContact O-N 2.71Å; R178-N182 VanDerWaalsContact O-N 3.14Å; R178-N182 PolarHBondContact O-ND2 3.23Å; Q179-N182 PolarHBondContact O-N 3.43Å; Q179-N182 VanDerWaalsContact O-N 3.11Å; W180-N182 PolarHBondContact O-N 3.09Å; N182-L185 PolarHBondContact O-N 2.97Å; N182-S186 PolarHBondContact O-N 2.91Å; N182-S186 VanDerWaalsContact O-N 3.14Å; N182-K228 PolarHBondContact OD1-NZ 3.06Å
183	E	97.8	Very high	93.5	Very high	88 Å²	88	64.4 Å²	64.4	41%	0.411	32%	0.321	S	S	.	.	H	α-helix	trans	-60.6	-46.2	173.6	-68.6	167.2	-173.2	0	0	110.4	Q179 W180 F181 L185 S186 I187	Q179-E183 WeakPolarHBondContact CG-OE1 3.31Å; Q179-E183 PolarHBondContact NE2-OE1 3.01Å; Q179-E183 WeakPolarHBondContact O-CG 3.43Å; Q179-E183 PolarHBondContact O-N 3.18Å; W180-E183 WeakPolarHBondContact O-CB 3.38Å; W180-E183 PolarHBondContact O-N 2.85Å; F181-E183 VanDerWaalsContact C-N 3.3Å; F181-E183 PolarHBondContact O-N 2.89Å; E183-L185 VanDerWaalsContact C-N 3.33Å; E183-L185 PolarHBondContact O-N 3.29Å; E183-S186 PolarHBondContact O-N 3.27Å; E183-S186 VanDerWaalsContact O-N 3.08Å; E183-S186 PolarHBondContact O-OG 2.98Å; E183-I187 WeakPolarHBondContact O-CG1 3.25Å; E183-I187 PolarHBondContact O-N 3.28Å
184	Q	97.5	Very high	93.1	Very high	19 Å²	19	64.8 Å²	64.8	9%	0.089	32%	0.32	C	S	.	.	H	α-helix	trans	-57.6	-44.9	176.5	-62.8	-40.8	-61.7	0	0	111.6	T148 R155 W180 F181 S186 I187	T148-Q184 HydrophobicContact CG2-CG 3.89Å; R155-Q184 PolarHBondContact NH1-O 3.27Å; W180-Q184 HydrophobicContact CD2-CG 3.92Å; W180-Q184 HydrophobicContact CE3-CG 4.33Å; W180-Q184 HydrophobicContact CG-CG 4.49Å; W180-Q184 HydrophobicContact CH2-CG 4.05Å; W180-Q184 HydrophobicContact CZ2-CG 3.6Å; W180-Q184 HydrophobicContact CZ3-CG 4.38Å; W180-Q184 VanDerWaalsContact NE1-NE2 3.14Å; W180-Q184 WeakPolarHBondContact O-CG 3.41Å; W180-Q184 PolarHBondContact O-N 3.03Å; F181-Q184 WeakPolarHBondContact O-CB 3.4Å; F181-Q184 PolarHBondContact O-N 2.95Å; F181-Q184 VanDerWaalsContact O-N 3.16Å; Q184-S186 PolarHBondContact O-N 3.03Å; Q184-I187 WeakPolarHBondContact O-CB 3.28Å; Q184-I187 PolarHBondContact O-N 2.86Å
185	L	96.4	Very high	93	Very high	9 Å²	9	65.1 Å²	65.1	5%	0.047	32%	0.322	C	S	.	.	H	α-helix	trans	-61.7	-33.3	178.3	-62.8	-174.7	0	0	0	112.9	F181 N182 E183 I187 K228 L229 H232 I234	F181-L185 HydrophobicContact CD1-CD1 4.13Å; F181-L185 HydrophobicContact CE1-CD1 3.5Å; F181-L185 HydrophobicContact CE1-CG 4.17Å; F181-L185 HydrophobicContact CE2-CD2 4.31Å; F181-L185 HydrophobicContact CE2-CG 4.47Å; F181-L185 HydrophobicContact CZ-CD1 3.75Å; F181-L185 HydrophobicContact CZ-CD2 4.15Å; F181-L185 HydrophobicContact CZ-CG 4.14Å; F181-L185 WeakPolarHBondContact O-CG 3.35Å; F181-L185 PolarHBondContact O-N 3.19Å; N182-L185 PolarHBondContact O-N 2.97Å; E183-L185 VanDerWaalsContact C-N 3.33Å; E183-L185 PolarHBondContact O-N 3.29Å; L185-I187 VanDerWaalsContact C-N 3.3Å; L185-I187 PolarHBondContact O-N 2.73Å; L185-K228 HydrophobicContact CD1-CB 3.65Å; L185-K228 HydrophobicContact CD1-CD 4.46Å; L185-K228 HydrophobicContact CD1-CG 4.5Å; L185-L229 HydrophobicContact CD2-CD2 3.95Å; L185-H232 HydrophobicContact CD2-CB 4.44Å; L185-H232 PolarHBondContact O-CD2 3.49Å; L185-I234 HydrophobicContact CD2-CD1 3.54Å
186	S	94.3	Very high	93	Very high	79 Å²	79	61.3 Å²	61.3	55%	0.552	30%	0.302	S	S	*	.	H	α-helix	trans	-74.6	-15.5	-179.7	76.2	0	0	0	0	114.7	N182 E183 Q184 K188	N182-S186 PolarHBondContact O-N 2.91Å; N182-S186 VanDerWaalsContact O-N 3.14Å; E183-S186 PolarHBondContact O-N 3.27Å; E183-S186 VanDerWaalsContact O-N 3.08Å; E183-S186 PolarHBondContact O-OG 2.98Å; Q184-S186 PolarHBondContact O-N 3.03Å; S186-K188 PolarHBondContact O-N 3.45Å; S186-K188 VanDerWaalsContact O-N 3.17Å
187	I	93	Very high	93	Very high	61 Å²	61	56.5 Å²	56.5	31%	0.313	28%	0.28	S	S	.	.			trans	-68.9	113.7	-178.4	-67.7	170.5	0	0	0	109.7	E183 Q184 L185 N189 F192	E183-I187 WeakPolarHBondContact O-CG1 3.25Å; E183-I187 PolarHBondContact O-N 3.28Å; Q184-I187 WeakPolarHBondContact O-CB 3.28Å; Q184-I187 PolarHBondContact O-N 2.86Å; L185-I187 VanDerWaalsContact C-N 3.3Å; L185-I187 PolarHBondContact O-N 2.73Å; I187-N189 HydrophobicContact CG2-CB 3.57Å; I187-F192 HydrophobicContact CG2-CE1 3.89Å; I187-F192 HydrophobicContact CG2-CZ 4.06Å; I187-F192 WeakPolarHBondContact O-CZ 3.45Å
188	K	81.5	Confident	93	Very high	207 Å²	207	56.5 Å²	56.5	90%	0.9	28%	0.28	S	S	*	.			trans	-101.8	79.6	166.4	-61.8	-177.8	-178.8	-177.3	0	108.2	S186	S186-K188 PolarHBondContact O-N 3.45Å; S186-K188 VanDerWaalsContact O-N 3.17Å
189	N	75.7	Confident	93	Very high	62 Å²	62	54.9 Å²	54.9	33%	0.332	27%	0.273	S	S	.	.			trans	-95.1	139.8	-174	-164.7	-27.6	0	0	0	110.9	I187 N191 F192	I187-N189 HydrophobicContact CG2-CB 3.57Å; N189-N191 PolarHBondContact O-N 3.21Å; N189-N191 VanDerWaalsContact O-N 3.17Å; N189-N191 WeakPolarHBondContact OD1-CB 3.07Å; N189-N191 VanDerWaalsContact OD1-CG 3.24Å; N189-N191 PolarHBondContact OD1-N 3.08Å; N189-N191 PolarHBondContact OD1-ND2 3.34Å; N189-F192 HydrophobicContact CB-CD1 3.81Å; N189-F192 HydrophobicContact CB-CE1 3.41Å; N189-F192 VanDerWaalsContact CB-CE1 3.41Å; N189-F192 HydrophobicContact CB-CZ 4.17Å
190	E	81	Confident	93	Very high	169 Å²	169	49.2 Å²	49.2	79%	0.79	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-15.4	173	-62.3	-178.5	173.2	0	0	113	R153	R153-E190 VanDerWaalsContact CZ-O 3.29Å; R153-E190 PolarHBondContact NH1-O 3.46Å; R153-E190 PolarHBondContact NH2-O 2.9Å
191	N	84.9	Confident	93	Very high	92 Å²	92	48.3 Å²	48.3	49%	0.492	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-11.9	-175.7	-65.7	-18.5	0	0	0	115.2	I150 R153 N189	I150-N191 HydrophobicContact CD1-CB 3.9Å; R153-N191 WeakPolarHBondContact CA-O 3.39Å; N189-N191 PolarHBondContact O-N 3.21Å; N189-N191 VanDerWaalsContact O-N 3.17Å; N189-N191 WeakPolarHBondContact OD1-CB 3.07Å; N189-N191 VanDerWaalsContact OD1-CG 3.24Å; N189-N191 PolarHBondContact OD1-N 3.08Å; N189-N191 PolarHBondContact OD1-ND2 3.34Å
192	F	89.3	Confident	93	Very high	24 Å²	24	48.2 Å²	48.2	11%	0.105	24%	0.243	C	C	.	.			trans	-144.9	149.3	179.6	66.5	-98.1	0	0	0	113.2	I150 R153 R155 I187 N189	I150-F192 HydrophobicContact CD1-CD1 3.85Å; I150-F192 HydrophobicContact CG1-CD1 4.45Å; I150-F192 HydrophobicContact CG2-CB 4.48Å; R153-F192 CarbonylContact O-C 3.43Å; R153-F192 WeakPolarHBondContact O-CA 3.45Å; R153-F192 VanDerWaalsContact O-CB 3.26Å; R153-F192 WeakPolarHBondContact O-CB 3.31Å; R155-F192 HydrophobicContact CB-CB 4.01Å; R155-F192 HydrophobicContact CB-CD1 3.83Å; R155-F192 HydrophobicContact CB-CD2 3.93Å; R155-F192 HydrophobicContact CB-CE1 4.27Å; R155-F192 HydrophobicContact CB-CE2 4.39Å; R155-F192 HydrophobicContact CB-CG 3.65Å; R155-F192 HydrophobicContact CG-CD1 4.44Å; R155-F192 HydrophobicContact CG-CE1 4.5Å; R155-F192 VanDerWaalsContact NH1-CZ 3.31Å; I187-F192 HydrophobicContact CG2-CE1 3.89Å; I187-F192 HydrophobicContact CG2-CZ 4.06Å; I187-F192 WeakPolarHBondContact O-CZ 3.45Å; N189-F192 HydrophobicContact CB-CD1 3.81Å; N189-F192 HydrophobicContact CB-CE1 3.41Å; N189-F192 VanDerWaalsContact CB-CE1 3.41Å; N189-F192 HydrophobicContact CB-CZ 4.17Å
193	D	87.5	Confident	93.1	Very high	93 Å²	93	45.1 Å²	45.1	50%	0.497	23%	0.227	S	C	.	.	S	Bend	trans	-108.1	-23.8	-179.5	-56.8	-49.9	0	0	0	112.5	R153	R153-D193 IonicContact CZ-OD1 3.88Å; R153-D193 IonicContact CZ-OD2 2.73Å; R153-D193 IonicContact NE-OD1 3.6Å; R153-D193 IonicContact NE-OD2 2.72Å; R153-D193 PolarHBondContact NE-OD2 3.19Å; R153-D193 IonicContact NH2-OD1 3.13Å; R153-D193 PolarHBondContact NH2-OD1 3.38Å; R153-D193 IonicContact NH2-OD2 3.56Å; R153-D193 PolarHBondContact NH2-OD2 3.16Å; R153-D193 PolarHBondContact O-N 3Å
194	M	90.7	Very high	93.1	Very high	37 Å²	37	41 Å²	41	18%	0.182	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	167.1	178.3	67	175.3	-74.6	0	0	111.9	T154 R155 V196 I295 I305 L306	T154-M194 HydrophobicContact CG2-CE 4.48Å; T154-M194 HydrophobicContact CG2-CG 3.92Å; T154-M194 HydrophobicContact CG2-SD 4.47Å; R155-M194 PolarHBondContact N-O 3.26Å; M194-V196 HydrophobicContact CE-CG2 3.77Å; M194-I295 HydrophobicContact CE-CD1 4.06Å; M194-I295 HydrophobicContact SD-CD1 4.39Å; M194-I295 HydrophobicContact SD-CG2 3.83Å; M194-I305 HydrophobicContact SD-CG2 3.75Å; M194-L306 HydrophobicContact CE-CD1 4.42Å
195	S	94.9	Very high	93.1	Very high	7 Å²	7	41.1 Å²	41.1	5%	0.049	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	148.6	172.9	-58.2	0	0	0	0	112.7	R155	R155-S195 PolarHBondContact NE-OG 3.43Å; R155-S195 PolarHBondContact NH2-OG 2.78Å; R155-S195 CarbonylContact O-C 3.52Å; R155-S195 WeakPolarHBondContact O-CA 3.42Å
196	V	97.8	Very high	93.2	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	140	174.3	178.4	0	0	0	0	108.8	T154 R155 F156 I157 M194 F198 F238 I295 L306	T154-V196 HydrophobicContact CG2-CG2 4.15Å; R155-V196 PolarHBondContact O-N 3.22Å; F156-V196 CarbonylContact C-O 3.59Å; F156-V196 WeakPolarHBondContact CA-O 3.47Å; F156-V196 HydrophobicContact CD1-CB 3.76Å; F156-V196 HydrophobicContact CD1-CG1 4.26Å; F156-V196 HydrophobicContact CD1-CG2 4.47Å; F156-V196 HydrophobicContact CE1-CB 3.9Å; F156-V196 HydrophobicContact CE1-CG1 4.36Å; F156-V196 HydrophobicContact CE1-CG2 4.15Å; I157-V196 PolarHBondContact N-O 3.21Å; M194-V196 HydrophobicContact CE-CG2 3.77Å; V196-F198 HydrophobicContact CG1-CZ 4.38Å; V196-F238 HydrophobicContact CG1-CD2 3.64Å; V196-F238 HydrophobicContact CG1-CE2 3.65Å; V196-I295 HydrophobicContact CG2-CD1 4.23Å; V196-L306 HydrophobicContact CG2-CD1 3.76Å
197	V	98.9	Very high	93.3	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	138	178.4	179.6	0	0	0	0	110.2	I157 L159 L229 I234 Y236 S237 F238	I157-V197 HydrophobicContact CB-CG2 4.45Å; I157-V197 CarbonylContact O-C 3.43Å; I157-V197 WeakPolarHBondContact O-CA 3.37Å; L159-V197 HydrophobicContact CD1-CG1 3.56Å; L159-V197 HydrophobicContact CG-CG1 3.9Å; V197-L229 HydrophobicContact CG2-CD1 4.14Å; V197-L229 HydrophobicContact CG2-CD2 3.7Å; V197-I234 HydrophobicContact CG2-CG2 3.86Å; V197-Y236 PolarHBondContact N-O 3.45Å; V197-S237 CarbonylContact O-C 3.58Å; V197-S237 WeakPolarHBondContact O-CA 3.31Å; V197-F238 PolarHBondContact O-N 3.21Å
198	F	99	Very high	93.5	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	136	167.1	-65.8	-70.1	0	0	0	109.8	F33 V35 F80 I82 L120 F149 F156 I157 V158 L159 V196 F238	F33-F198 HydrophobicContact CD2-CZ 4.1Å; F33-F198 AromaticContact CE2-CE1 3.89Å; F33-F198 HydrophobicContact CE2-CE1 3.89Å; F33-F198 AromaticContact CE2-CZ 3.46Å; F33-F198 HydrophobicContact CE2-CZ 3.46Å; F33-F198 VanDerWaalsContact CE2-CZ 3.46Å; F33-F198 AromaticContact CZ-CZ 3.92Å; F33-F198 HydrophobicContact CZ-CZ 3.92Å; V35-F198 HydrophobicContact CG2-CE1 3.87Å; F80-F198 HydrophobicContact CE2-CE2 4.17Å; F80-F198 HydrophobicContact CE2-CZ 4.17Å; F80-F198 HydrophobicContact CZ-CE2 4.39Å; F80-F198 HydrophobicContact CZ-CZ 4.46Å; I82-F198 HydrophobicContact CD1-CB 3.78Å; I82-F198 HydrophobicContact CD1-CD1 4.1Å; I82-F198 HydrophobicContact CD1-CD2 3.49Å; I82-F198 VanDerWaalsContact CD1-CD2 3.49Å; I82-F198 HydrophobicContact CD1-CE2 3.99Å; I82-F198 HydrophobicContact CD1-CG 3.55Å; I82-F198 HydrophobicContact CG2-CD1 3.94Å; I82-F198 HydrophobicContact CG2-CE1 3.65Å; I82-F198 HydrophobicContact CG2-CE2 4.25Å; I82-F198 HydrophobicContact CG2-CG 4.45Å; I82-F198 HydrophobicContact CG2-CZ 3.82Å; L120-F198 HydrophobicContact CD2-CB 3.67Å; F149-F198 HydrophobicContact CZ-CE2 4.36Å; F156-F198 HydrophobicContact CB-CD2 4.26Å; F156-F198 HydrophobicContact CB-CE2 4.09Å; F156-F198 HydrophobicContact CD1-CD2 4.12Å; F156-F198 AromaticContact CD1-CE2 3.27Å; F156-F198 HydrophobicContact CD1-CE2 3.27Å; F156-F198 AromaticContact CD1-CZ 3.92Å; F156-F198 HydrophobicContact CD1-CZ 3.92Å; F156-F198 AromaticContact CE1-CE2 3.96Å; F156-F198 HydrophobicContact CE1-CE2 3.96Å; F156-F198 HydrophobicContact CE1-CZ 4.17Å; F156-F198 AromaticContact CG-CE2 3.97Å; F156-F198 HydrophobicContact CG-CE2 3.97Å; I157-F198 PolarHBondContact O-N 2.85Å; V158-F198 WeakPolarHBondContact CA-O 3.23Å; V158-F198 HydrophobicContact CG2-CB 4.37Å; V158-F198 HydrophobicContact CG2-CD2 4.46Å; L159-F198 PolarHBondContact N-O 3.22Å; V196-F198 HydrophobicContact CG1-CZ 4.38Å; F198-F238 HydrophobicContact CD1-CB 3.62Å; F198-F238 HydrophobicContact CD1-CD2 4.27Å; F198-F238 HydrophobicContact CD1-CG 4.26Å; F198-F238 HydrophobicContact CE1-CB 3.81Å; F198-F238 AromaticContact CE1-CD2 3.8Å; F198-F238 HydrophobicContact CE1-CD2 3.8Å; F198-F238 AromaticContact CE1-CG 3.96Å; F198-F238 HydrophobicContact CE1-CG 3.96Å
199	Q	98.9	Very high	94.3	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.203	C	C	.	.			trans	-153.2	177.1	179.1	65	-170.2	40.7	0	0	110.1	L159 T161 T201 F203 S237 F238 A239	L159-Q199 HydrophobicContact CB-CB 4.16Å; T161-Q199 HydrophobicContact CG2-CB 3.64Å; T161-Q199 HydrophobicContact CG2-CG 4.14Å; Q199-T201 PolarHBondContact NE2-O 3.15Å; Q199-F203 VanDerWaalsContact OE1-CZ 3.27Å; Q199-S237 PolarHBondContact OE1-OG 2.83Å; Q199-F238 PolarHBondContact N-O 2.97Å; Q199-A239 HydrophobicContact CG-CB 4.14Å; Q199-A239 WeakPolarHBondContact O-CA 3.39Å
200	H	98.9	Very high	95.4	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.193	C	C	.	.	S	Bend	trans	-98.7	-56.3	175.5	173.4	72.6	0	0	0	111.8	D38 C84 G85 D86 L120 P121 G122 N123 P202 A239 G240 H241	D38-H200 IonicContact OD1-CE1 3.51Å; D38-H200 PolarHBondContact OD1-CE1 3.25Å; D38-H200 IonicContact OD1-ND1 3.42Å; C84-H200 PolarHBondContact O-ND1 3Å; G85-H200 WeakPolarHBondContact CA-ND1 3.25Å; D86-H200 IonicContact OD1-CE1 3.53Å; D86-H200 PolarHBondContact OD1-CE1 3.32Å; D86-H200 IonicContact OD1-NE2 2.67Å; D86-H200 PolarHBondContact OD1-NE2 3.43Å; D86-H200 IonicContact OD2-CE1 2.71Å; D86-H200 IonicContact OD2-NE2 3.77Å; L120-H200 HydrophobicContact CD1-CB 3.67Å; P121-H200 WeakPolarHBondContact O-CB 3.47Å; G122-H200 WeakPolarHBondContact CA-CD2 3.15Å; G122-H200 WeakPolarHBondContact CA-NE2 3.45Å; N123-H200 PolarHBondContact OD1-NE2 2.82Å; H200-P202 WeakPolarHBondContact O-CD 3.39Å; H200-A239 WeakPolarHBondContact O-CB 3.43Å; H200-G240 CarbonylContact O-C 3.51Å; H200-G240 PolarHBondContact O-N 3Å; H200-G240 VanDerWaalsContact O-N 3.11Å; H200-H241 AromaticContact CD2-ND1 3.86Å; H200-H241 AromaticContact CE1-ND1 3.88Å; H200-H241 AromaticContact NE2-CG 3.64Å; H200-H241 AromaticContact NE2-ND1 3.15Å; H200-H241 PolarHBondContact NE2-ND1 3.22Å; H200-H241 VanDerWaalsContact NE2-ND1 3.15Å; H200-H241 VanDerWaalsContact O-CB 3.31Å; H200-H241 WeakPolarHBondContact O-CB 3.3Å
201	T	98.8	Very high	96.2	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.006	19%	0.189	C	C	.	.	S	Bend	trans	-85.1	123.3	-178.1	-50.3	0	0	0	0	110.6	T161 V165 Q199 I217	T161-T201 PolarHBondContact OG1-N 3.06Å; T161-T201 VanDerWaalsContact OG1-N 3.12Å; T161-T201 PolarHBondContact OG1-OG1 2.89Å; V165-T201 HydrophobicContact CG2-CG2 4.07Å; Q199-T201 PolarHBondContact NE2-O 3.15Å; T201-I217 HydrophobicContact CG2-CD1 3.71Å; T201-I217 HydrophobicContact CG2-CG1 4.21Å
202	P	98.8	Very high	96.8	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.187	C	C	.	.			trans	-56.9	145.4	176.1	-25.2	32.4	0	0	0	112.9	H200 L205 F215 N216 I217 A239 M273 T275	H200-P202 WeakPolarHBondContact O-CD 3.39Å; P202-L205 HydrophobicContact CB-CD2 3.93Å; P202-L205 HydrophobicContact CG-CD2 4.03Å; P202-F215 WeakPolarHBondContact CD-O 3.27Å; P202-N216 WeakPolarHBondContact O-CA 3.25Å; P202-I217 PolarHBondContact O-N 2.75Å; P202-A239 HydrophobicContact CB-CB 4.39Å; P202-A239 HydrophobicContact CG-CB 3.89Å; P202-M273 HydrophobicContact CB-CE 4.18Å; P202-M273 HydrophobicContact CB-CG 4.19Å; P202-M273 HydrophobicContact CB-SD 4.29Å; P202-T275 HydrophobicContact CG-CG2 3.93Å; P202-T275 WeakPolarHBondContact CG-OG1 3.41Å
203	F	98.8	Very high	97.2	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.2	C	C	.	.	S	Bend	trans	-62.2	-50	171.5	-76.5	-59.7	0	0	0	110.7	L159 L164 Q199 I217 R222 F225 V226 L229 F271 M273	L159-F203 HydrophobicContact CD1-CZ 4.35Å; L164-F203 HydrophobicContact CD1-CE1 4.39Å; Q199-F203 VanDerWaalsContact OE1-CZ 3.27Å; F203-I217 HydrophobicContact CD1-CB 4.19Å; F203-I217 HydrophobicContact CD1-CG1 4Å; F203-I217 HydrophobicContact CD1-CG2 4.38Å; F203-I217 HydrophobicContact CE1-CG1 4.47Å; F203-I217 PolarHBondContact O-N 3.26Å; F203-R222 HydrophobicContact CB-CB 4.02Å; F203-R222 HydrophobicContact CD1-CB 3.76Å; F203-R222 HydrophobicContact CG-CB 4.32Å; F203-R222 WeakPolarHBondContact O-CD 3.46Å; F203-F225 HydrophobicContact CD1-CB 4.39Å; F203-F225 HydrophobicContact CE1-CB 3.51Å; F203-F225 HydrophobicContact CE1-CD1 4.2Å; F203-F225 HydrophobicContact CE1-CG 4.07Å; F203-F225 HydrophobicContact CZ-CB 3.72Å; F203-F225 HydrophobicContact CZ-CD1 4.08Å; F203-F225 HydrophobicContact CZ-CG 4.29Å; F203-V226 HydrophobicContact CB-CG2 3.76Å; F203-V226 HydrophobicContact CD1-CG2 4.15Å; F203-V226 HydrophobicContact CD2-CG2 3.69Å; F203-V226 HydrophobicContact CE2-CG2 4.32Å; F203-V226 HydrophobicContact CG-CG2 3.6Å; F203-L229 HydrophobicContact CE2-CD1 3.81Å; F203-L229 HydrophobicContact CZ-CD1 4.19Å; F203-F271 HydrophobicContact CD2-CE1 4.23Å; F203-F271 AromaticContact CD2-CZ 3.93Å; F203-F271 HydrophobicContact CD2-CZ 3.93Å; F203-F271 HydrophobicContact CE2-CZ 4.22Å; F203-M273 HydrophobicContact CB-SD 4.13Å; F203-M273 HydrophobicContact CD2-SD 4.02Å; F203-M273 HydrophobicContact CG-SD 4.5Å; F203-M273 PolarHBondContact N-SD 2.8Å; F203-M273 VanDerWaalsContact N-SD 3.42Å
204	F	98.7	Very high	97.7	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.199	C	C	.	.			trans	-148.3	160	178.1	58.7	-81.6	0	0	0	109.3	I208 E210 V226 A248 F271 M273	F204-I208 HydrophobicContact CB-CD1 4.47Å; F204-I208 HydrophobicContact CD1-CD1 3.47Å; F204-I208 VanDerWaalsContact CD1-CD1 3.47Å; F204-I208 HydrophobicContact CE1-CD1 3.97Å; F204-I208 HydrophobicContact CG-CD1 4.14Å; F204-E210 WeakPolarHBondContact CA-OE1 3.31Å; F204-V226 HydrophobicContact CE1-CG2 4.31Å; F204-A248 HydrophobicContact CD2-CB 3.9Å; F204-A248 HydrophobicContact CE2-CB 3.54Å; F204-F271 AromaticContact CE1-CD1 3.87Å; F204-F271 HydrophobicContact CE1-CD1 3.87Å; F204-F271 AromaticContact CE1-CE1 3.94Å; F204-F271 HydrophobicContact CE1-CE1 3.94Å; F204-F271 HydrophobicContact CZ-CD1 4.09Å; F204-F271 HydrophobicContact CZ-CE1 4.48Å; F204-M273 HydrophobicContact CE1-CB 4.02Å; F204-M273 HydrophobicContact CE2-CB 4.33Å; F204-M273 HydrophobicContact CZ-CB 3.91Å; F204-M273 WeakPolarHBondContact O-CG 3.46Å
205	L	98.2	Very high	98	Very high	23 Å²	23	40 Å²	40	12%	0.12	20%	0.203	C	C	.	.	S	Bend	trans	-103.5	-42.3	-179	-55.7	-175.8	0	0	0	112.2	P202 E210 F215 N216 L242 N246 A248	P202-L205 HydrophobicContact CB-CD2 3.93Å; P202-L205 HydrophobicContact CG-CD2 4.03Å; L205-E210 PolarHBondContact N-OE1 3.18Å; L205-E210 PolarHBondContact N-OE2 2.95Å; L205-F215 HydrophobicContact CD1-CB 3.87Å; L205-N216 HydrophobicContact CG-CB 4.49Å; L205-L242 HydrophobicContact CD1-CD1 3.89Å; L205-L242 HydrophobicContact CD2-CD1 3.98Å; L205-L242 HydrophobicContact CD2-CD2 3.98Å; L205-L242 HydrophobicContact CD2-CG 4.47Å; L205-N246 PolarHBondContact O-ND2 3.47Å; L205-A248 WeakPolarHBondContact O-CB 3.43Å
206	E	97.6	Very high	98.2	Very high	168 Å²	168	39.9 Å²	39.9	79%	0.785	20%	0.202	S	C	*	.	S	Bend	trans	-130.2	-45.9	-177.8	-64.4	178.9	-164.7	0	0	110.4	E210	E206-E210 PolarHBondContact N-OE2 3.06Å
207	D	97.5	Very high	98.2	Very high	82 Å²	82	39.9 Å²	39.9	44%	0.439	20%	0.202	S	C	.	.			trans	-135.4	136.9	-177.9	-168.3	-49.8	0	0	0	110.4	N209 E210	D207-N209 PolarHBondContact O-N 2.83Å; D207-N209 WeakPolarHBondContact OD1-CA 3.26Å; D207-N209 VanDerWaalsContact OD1-CB 3.28Å; D207-N209 WeakPolarHBondContact OD1-CB 3.49Å; D207-N209 PolarHBondContact OD1-N 3.37Å; D207-N209 PolarHBondContact OD1-ND2 3.33Å; D207-E210 HydrophobicContact CB-CB 4.37Å; D207-E210 PolarHBondContact N-OE2 3.22Å; D207-E210 VanDerWaalsContact N-OE2 3.14Å; D207-E210 WeakPolarHBondContact O-CB 3.46Å; D207-E210 VanDerWaalsContact O-CD 3.3Å; D207-E210 WeakPolarHBondContact O-CG 3.39Å; D207-E210 PolarHBondContact O-N 3.17Å
208	I	97.4	Very high	98.2	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.005	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-19.3	174.9	-163.7	65.4	0	0	0	113.2	F204 R222 K223 V226 Y250	F204-I208 HydrophobicContact CB-CD1 4.47Å; F204-I208 HydrophobicContact CD1-CD1 3.47Å; F204-I208 VanDerWaalsContact CD1-CD1 3.47Å; F204-I208 HydrophobicContact CE1-CD1 3.97Å; F204-I208 HydrophobicContact CG-CD1 4.14Å; I208-R222 HydrophobicContact CD1-CB 4.44Å; I208-R222 HydrophobicContact CD1-CG 4.06Å; I208-R222 VanDerWaalsContact O-CZ 3.3Å; I208-R222 PolarHBondContact O-NE 3.14Å; I208-R222 PolarHBondContact O-NH2 2.82Å; I208-K223 HydrophobicContact CG1-CG 3.98Å; I208-V226 HydrophobicContact CD1-CB 4.19Å; I208-V226 HydrophobicContact CD1-CG1 4.41Å; I208-V226 HydrophobicContact CD1-CG2 4.02Å; I208-Y250 HydrophobicContact CB-CD1 4.21Å; I208-Y250 HydrophobicContact CB-CD2 4.02Å; I208-Y250 HydrophobicContact CB-CE1 4.31Å; I208-Y250 HydrophobicContact CB-CE2 4.19Å; I208-Y250 HydrophobicContact CB-CG 4.04Å; I208-Y250 HydrophobicContact CD1-CD1 4.4Å; I208-Y250 HydrophobicContact CG1-CD1 4.1Å; I208-Y250 HydrophobicContact CG1-CE1 3.98Å; I208-Y250 HydrophobicContact CG1-CG 4.44Å; I208-Y250 HydrophobicContact CG2-CD1 4.44Å; I208-Y250 HydrophobicContact CG2-CD2 3.65Å; I208-Y250 HydrophobicContact CG2-CE1 4.2Å; I208-Y250 HydrophobicContact CG2-CE2 3.42Å; I208-Y250 VanDerWaalsContact CG2-CE2 3.42Å; I208-Y250 HydrophobicContact CG2-CG 4.17Å
209	N	97.6	Very high	98.2	Very high	86 Å²	86	43.5 Å²	43.5	46%	0.46	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.1	4	179.7	-52.6	-74.7	0	0	0	113.7	D207 K223	D207-N209 PolarHBondContact O-N 2.83Å; D207-N209 WeakPolarHBondContact OD1-CA 3.26Å; D207-N209 VanDerWaalsContact OD1-CB 3.28Å; D207-N209 WeakPolarHBondContact OD1-CB 3.49Å; D207-N209 PolarHBondContact OD1-N 3.37Å; D207-N209 PolarHBondContact OD1-ND2 3.33Å; N209-K223 WeakPolarHBondContact OD1-CE 3.33Å; N209-K223 PolarHBondContact OD1-NZ 2.95Å
210	E	98.1	Very high	98	Very high	25 Å²	25	49.9 Å²	49.9	12%	0.117	26%	0.257	C	S	.	.	S	Bend	trans	-57.4	158.6	177.5	72	-164.8	-169.9	0	0	111.8	F204 L205 E206 D207 N216 R222	F204-E210 WeakPolarHBondContact CA-OE1 3.31Å; L205-E210 PolarHBondContact N-OE1 3.18Å; L205-E210 PolarHBondContact N-OE2 2.95Å; E206-E210 PolarHBondContact N-OE2 3.06Å; D207-E210 HydrophobicContact CB-CB 4.37Å; D207-E210 PolarHBondContact N-OE2 3.22Å; D207-E210 VanDerWaalsContact N-OE2 3.14Å; D207-E210 WeakPolarHBondContact O-CB 3.46Å; D207-E210 VanDerWaalsContact O-CD 3.3Å; D207-E210 WeakPolarHBondContact O-CG 3.39Å; D207-E210 PolarHBondContact O-N 3.17Å; E210-N216 WeakPolarHBondContact CG-ND2 3.29Å; E210-N216 PolarHBondContact OE1-ND2 3.43Å; E210-R222 PolarHBondContact O-NH2 3.08Å; E210-R222 IonicContact OE1-NH1 3.6Å
211	P	98.3	Very high	98	Very high	109 Å²	109	52.7 Å²	52.7	71%	0.708	27%	0.268	S	S	*	.	P	Polyproline II helix	trans	-60.7	143.8	176.8	-25.3	35.8	0	0	0	112.9	N213 N216	P211-N213 PolarHBondContact O-N 2.9Å; P211-N213 PolarHBondContact O-ND2 3.36Å; P211-N216 PolarHBondContact O-ND2 2.69Å; P211-N216 VanDerWaalsContact O-ND2 3.11Å
212	D	98.3	Very high	98	Very high	85 Å²	85	52.6 Å²	52.6	46%	0.455	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-58.3	130.2	170	-68.6	-2.4	0	0	0	109.3	I219	D212-I219 VanDerWaalsContact OD1-CB 3.31Å; D212-I219 WeakPolarHBondContact OD1-CB 3.37Å; D212-I219 PolarHBondContact OD1-N 3.06Å; D212-I219 PolarHBondContact OD2-N 2.8Å
213	N	96.6	Very high	97.9	Very high	72 Å²	72	55.9 Å²	55.9	39%	0.385	28%	0.282	S	S	.	.			trans	-148.7	-178.9	177.7	68.7	65.4	0	0	0	110.8	P211 F215 N216	P211-N213 PolarHBondContact O-N 2.9Å; P211-N213 PolarHBondContact O-ND2 3.36Å; N213-F215 PolarHBondContact O-N 2.7Å; N213-F215 WeakPolarHBondContact OD1-CA 3.11Å; N213-F215 WeakPolarHBondContact OD1-CB 3.43Å; N213-F215 PolarHBondContact OD1-N 2.89Å; N213-N216 PolarHBondContact N-OD1 3.04Å; N213-N216 PolarHBondContact ND2-ND2 3.43Å; N213-N216 PolarHBondContact O-N 3.15Å; N213-N216 PolarHBondContact O-OD1 3.45Å
214	Y	97.3	Very high	97.8	Very high	119 Å²	119	59.3 Å²	59.3	47%	0.467	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-31.5	-177.4	177.9	-101.4	0	0	0	113.5	N123 H241	N123-Y214 PolarHBondContact ND2-OH 3.42Å; Y214-H241 AromaticContact CD1-NE2 3.92Å; Y214-H241 AromaticContact CE1-CE1 3.43Å; Y214-H241 VanDerWaalsContact CE1-CE1 3.43Å; Y214-H241 WeakPolarHBondContact CE1-CE1 3.29Å; Y214-H241 AromaticContact CE1-NE2 3.74Å; Y214-H241 AromaticContact CZ-CE1 3.57Å; Y214-H241 PolarHBondContact O-NE2 3.2Å
215	F	98	Very high	97.8	Very high	63 Å²	63	59.3 Å²	59.3	28%	0.276	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-3.9	-170	-62.7	-73.8	0	0	0	114.5	P202 L205 N213 L242 L283	P202-F215 WeakPolarHBondContact CD-O 3.27Å; L205-F215 HydrophobicContact CD1-CB 3.87Å; N213-F215 PolarHBondContact O-N 2.7Å; N213-F215 WeakPolarHBondContact OD1-CA 3.11Å; N213-F215 WeakPolarHBondContact OD1-CB 3.43Å; N213-F215 PolarHBondContact OD1-N 2.89Å; F215-L242 HydrophobicContact CB-CD1 4.01Å; F215-L242 HydrophobicContact CD1-CD1 3.94Å; F215-L242 HydrophobicContact CG-CD1 3.96Å; F215-L283 HydrophobicContact CE1-CD1 4.3Å; F215-L283 HydrophobicContact CZ-CD1 4.22Å
216	N	98.5	Very high	97.8	Very high	3 Å²	3	58.2 Å²	58.2	2%	0.016	29%	0.292	C	S	.	.	S	Bend	trans	-131.4	155.3	-178	63.1	19.9	0	0	0	112.8	P202 L205 E210 P211 N213 R222	P202-N216 WeakPolarHBondContact O-CA 3.25Å; L205-N216 HydrophobicContact CG-CB 4.49Å; E210-N216 WeakPolarHBondContact CG-ND2 3.29Å; E210-N216 PolarHBondContact OE1-ND2 3.43Å; P211-N216 PolarHBondContact O-ND2 2.69Å; P211-N216 VanDerWaalsContact O-ND2 3.11Å; N213-N216 PolarHBondContact N-OD1 3.04Å; N213-N216 PolarHBondContact ND2-ND2 3.43Å; N213-N216 PolarHBondContact O-N 3.15Å; N213-N216 PolarHBondContact O-OD1 3.45Å; N216-R222 VanDerWaalsContact CG-NH1 3.28Å; N216-R222 PolarHBondContact ND2-NH1 3.05Å
217	I	98.7	Very high	97.7	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.268	C	S	.	.			trans	-66.7	139	172.8	-63.7	-56.8	0	0	0	109.5	T161 L164 V165 T201 P202 F203 R222	T161-I217 HydrophobicContact CG2-CD1 3.95Å; L164-I217 HydrophobicContact CB-CD1 4.17Å; L164-I217 HydrophobicContact CB-CG2 4.03Å; V165-I217 HydrophobicContact CG2-CD1 3.48Å; V165-I217 VanDerWaalsContact CG2-CD1 3.48Å; T201-I217 HydrophobicContact CG2-CD1 3.71Å; T201-I217 HydrophobicContact CG2-CG1 4.21Å; P202-I217 PolarHBondContact O-N 2.75Å; F203-I217 HydrophobicContact CD1-CB 4.19Å; F203-I217 HydrophobicContact CD1-CG1 4Å; F203-I217 HydrophobicContact CD1-CG2 4.38Å; F203-I217 HydrophobicContact CE1-CG1 4.47Å; F203-I217 PolarHBondContact O-N 3.26Å; I217-R222 HydrophobicContact CB-CB 4Å; I217-R222 HydrophobicContact CG2-CB 3.92Å; I217-R222 VanDerWaalsContact O-CD 3.27Å; I217-R222 WeakPolarHBondContact O-CD 3.48Å; I217-R222 PolarHBondContact O-NH1 3.12Å
218	P	98.5	Very high	97.7	Very high	31 Å²	31	51 Å²	51	20%	0.201	26%	0.256	C	S	.	.			trans	-53.3	141.6	176.5	-29	35.4	0	0	0	113.8	N220 Y221 R222	P218-N220 PolarHBondContact O-N 2.97Å; P218-Y221 PolarHBondContact O-N 3.38Å; P218-R222 PolarHBondContact O-N 3.26Å
219	I	98.2	Very high	97.7	Very high	46 Å²	46	51 Å²	51	24%	0.236	26%	0.256	C	S	.	.	H	α-helix	trans	-51.7	-39.1	-167	-169.6	166.9	0	0	0	113.7	D212 R222 K223	D212-I219 VanDerWaalsContact OD1-CB 3.31Å; D212-I219 WeakPolarHBondContact OD1-CB 3.37Å; D212-I219 PolarHBondContact OD1-N 3.06Å; D212-I219 PolarHBondContact OD2-N 2.8Å; I219-R222 WeakPolarHBondContact O-CG 3.24Å; I219-K223 HydrophobicContact CG1-CD 3.99Å; I219-K223 HydrophobicContact CG1-CG 4.29Å; I219-K223 WeakPolarHBondContact O-CB 3.49Å; I219-K223 WeakPolarHBondContact O-CG 3.42Å; I219-K223 PolarHBondContact O-N 2.84Å; I219-K223 VanDerWaalsContact O-N 3.09Å
220	N	96.1	Very high	97.5	Very high	133 Å²	133	47.5 Å²	47.5	71%	0.711	24%	0.237	S	C	*	.	H	α-helix	trans	-63.9	-46.6	-179.1	-70	-24.8	0	0	0	111.5	P218 E224	P218-N220 PolarHBondContact O-N 2.97Å; N220-E224 WeakPolarHBondContact O-CB 3.42Å; N220-E224 PolarHBondContact O-N 3.46Å
221	Y	98.2	Very high	97.3	Very high	59 Å²	59	53.1 Å²	53.1	23%	0.231	26%	0.263	C	S	.	.	H	α-helix	trans	-75.2	-42.8	-179.3	-69.5	-59.8	0	0	0	111.9	L164 N167 P218 K223 E224 F225	L164-Y221 HydrophobicContact CB-CD2 4.34Å; L164-Y221 HydrophobicContact CB-CG 4.29Å; L164-Y221 HydrophobicContact CD2-CD1 3.92Å; L164-Y221 HydrophobicContact CD2-CE1 4.41Å; L164-Y221 HydrophobicContact CD2-CG 4.04Å; L164-Y221 WeakPolarHBondContact O-CD2 3.32Å; L164-Y221 WeakPolarHBondContact O-CE2 3.36Å; N167-Y221 PolarHBondContact ND2-OH 2.91Å; P218-Y221 PolarHBondContact O-N 3.38Å; Y221-K223 PolarHBondContact O-N 2.95Å; Y221-E224 PolarHBondContact O-N 3.06Å; Y221-F225 WeakPolarHBondContact O-CB 3.46Å; Y221-F225 WeakPolarHBondContact O-CD2 3.34Å; Y221-F225 PolarHBondContact O-N 3.21Å
222	R	97.9	Very high	97	Very high	0 Å²	0	52 Å²	52	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-65.3	-38.6	-178.8	69	177.4	-179.6	-145.6	-1.2	112.7	F203 I208 E210 N216 I217 P218 I219 F225 V226	F203-R222 HydrophobicContact CB-CB 4.02Å; F203-R222 HydrophobicContact CD1-CB 3.76Å; F203-R222 HydrophobicContact CG-CB 4.32Å; F203-R222 WeakPolarHBondContact O-CD 3.46Å; I208-R222 HydrophobicContact CD1-CB 4.44Å; I208-R222 HydrophobicContact CD1-CG 4.06Å; I208-R222 VanDerWaalsContact O-CZ 3.3Å; I208-R222 PolarHBondContact O-NE 3.14Å; I208-R222 PolarHBondContact O-NH2 2.82Å; E210-R222 PolarHBondContact O-NH2 3.08Å; E210-R222 IonicContact OE1-NH1 3.6Å; N216-R222 VanDerWaalsContact CG-NH1 3.28Å; N216-R222 PolarHBondContact ND2-NH1 3.05Å; I217-R222 HydrophobicContact CB-CB 4Å; I217-R222 HydrophobicContact CG2-CB 3.92Å; I217-R222 VanDerWaalsContact O-CD 3.27Å; I217-R222 WeakPolarHBondContact O-CD 3.48Å; I217-R222 PolarHBondContact O-NH1 3.12Å; P218-R222 PolarHBondContact O-N 3.26Å; I219-R222 WeakPolarHBondContact O-CG 3.24Å; R222-F225 PolarHBondContact O-N 3.13Å; R222-V226 VanDerWaalsContact O-CB 3.23Å; R222-V226 WeakPolarHBondContact O-CB 3.22Å; R222-V226 WeakPolarHBondContact O-CG2 3.38Å; R222-V226 PolarHBondContact O-N 3.48Å
223	K	97.5	Very high	96.7	Very high	69 Å²	69	54.5 Å²	54.5	30%	0.3	26%	0.255	S	S	.	.	H	α-helix	trans	-64.2	-45	176.1	-79.6	-175	172.3	-177.6	0	110.8	I208 N209 I219 Y221 N227	I208-K223 HydrophobicContact CG1-CG 3.98Å; N209-K223 WeakPolarHBondContact OD1-CE 3.33Å; N209-K223 PolarHBondContact OD1-NZ 2.95Å; I219-K223 HydrophobicContact CG1-CD 3.99Å; I219-K223 HydrophobicContact CG1-CG 4.29Å; I219-K223 WeakPolarHBondContact O-CB 3.49Å; I219-K223 WeakPolarHBondContact O-CG 3.42Å; I219-K223 PolarHBondContact O-N 2.84Å; I219-K223 VanDerWaalsContact O-N 3.09Å; Y221-K223 PolarHBondContact O-N 2.95Å; K223-N227 WeakPolarHBondContact O-CB 3.35Å; K223-N227 PolarHBondContact O-N 3.1Å; K223-N227 PolarHBondContact O-ND2 3.21Å; K223-N227 VanDerWaalsContact O-ND2 3.12Å
224	E	97.3	Very high	96.6	Very high	71 Å²	71	51.1 Å²	51.1	33%	0.332	24%	0.237	S	C	.	.	H	α-helix	trans	-58.6	-53.4	176.7	-174.1	-165.7	151.4	0	0	111.3	N220 Y221 K228	N220-E224 WeakPolarHBondContact O-CB 3.42Å; N220-E224 PolarHBondContact O-N 3.46Å; Y221-E224 PolarHBondContact O-N 3.06Å; E224-K228 HydrophobicContact CG-CD 4.18Å; E224-K228 WeakPolarHBondContact O-CB 3.29Å; E224-K228 VanDerWaalsContact O-CG 3.3Å; E224-K228 WeakPolarHBondContact O-CG 3.44Å; E224-K228 PolarHBondContact O-N 3.18Å; E224-K228 WeakPolarHBondContact OE1-CE 3.43Å; E224-K228 IonicContact OE1-NZ 2.66Å; E224-K228 PolarHBondContact OE1-NZ 2.95Å
225	F	98.5	Very high	96.5	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-66.4	-48.6	-175.7	-87.8	-115.5	0	0	0	112.2	L164 F177 R178 F181 F203 Y221 R222 N227 K228 L229	L164-F225 HydrophobicContact CD1-CD1 3.96Å; L164-F225 HydrophobicContact CD1-CD2 4.18Å; L164-F225 HydrophobicContact CD1-CE1 3.79Å; L164-F225 HydrophobicContact CD1-CE2 4.02Å; L164-F225 HydrophobicContact CD1-CG 4.16Å; L164-F225 HydrophobicContact CD1-CZ 3.83Å; L164-F225 HydrophobicContact CD2-CD2 4.45Å; L164-F225 HydrophobicContact CD2-CE1 4.45Å; L164-F225 HydrophobicContact CD2-CE2 3.66Å; L164-F225 HydrophobicContact CD2-CZ 3.67Å; L164-F225 HydrophobicContact CG-CZ 4.33Å; F177-F225 HydrophobicContact CE1-CE1 4.04Å; F177-F225 AromaticContact CE1-CZ 3.92Å; F177-F225 HydrophobicContact CE1-CZ 3.92Å; F177-F225 HydrophobicContact CZ-CE1 4.16Å; F177-F225 HydrophobicContact CZ-CZ 4.48Å; R178-F225 HydrophobicContact CG-CE2 4.28Å; R178-F225 HydrophobicContact CG-CZ 4.07Å; F181-F225 HydrophobicContact CB-CE1 4.37Å; F181-F225 AromaticContact CD1-CD1 3.95Å; F181-F225 HydrophobicContact CD1-CD1 3.95Å; F181-F225 AromaticContact CD1-CE1 3.51Å; F181-F225 HydrophobicContact CD1-CE1 3.51Å; F181-F225 AromaticContact CD1-CZ 3.87Å; F181-F225 HydrophobicContact CD1-CZ 3.87Å; F181-F225 HydrophobicContact CD2-CD1 4.33Å; F181-F225 AromaticContact CD2-CE1 3.9Å; F181-F225 HydrophobicContact CD2-CE1 3.9Å; F181-F225 AromaticContact CE1-CD1 3.51Å; F181-F225 HydrophobicContact CE1-CD1 3.51Å; F181-F225 AromaticContact CE1-CE1 3.61Å; F181-F225 HydrophobicContact CE1-CE1 3.61Å; F181-F225 HydrophobicContact CE1-CG 4.06Å; F181-F225 HydrophobicContact CE1-CZ 4.21Å; F181-F225 AromaticContact CE2-CD1 3.94Å; F181-F225 HydrophobicContact CE2-CD1 3.94Å; F181-F225 AromaticContact CE2-CE1 4Å; F181-F225 HydrophobicContact CE2-CE1 4Å; F181-F225 HydrophobicContact CG-CD1 4.33Å; F181-F225 AromaticContact CG-CE1 3.65Å; F181-F225 HydrophobicContact CG-CE1 3.65Å; F181-F225 HydrophobicContact CG-CZ 4.2Å; F181-F225 AromaticContact CZ-CD1 3.51Å; F181-F225 HydrophobicContact CZ-CD1 3.51Å; F181-F225 AromaticContact CZ-CE1 3.85Å; F181-F225 HydrophobicContact CZ-CE1 3.85Å; F181-F225 HydrophobicContact CZ-CG 4.28Å; F203-F225 HydrophobicContact CD1-CB 4.39Å; F203-F225 HydrophobicContact CE1-CB 3.51Å; F203-F225 HydrophobicContact CE1-CD1 4.2Å; F203-F225 HydrophobicContact CE1-CG 4.07Å; F203-F225 HydrophobicContact CZ-CB 3.72Å; F203-F225 HydrophobicContact CZ-CD1 4.08Å; F203-F225 HydrophobicContact CZ-CG 4.29Å; Y221-F225 WeakPolarHBondContact O-CB 3.46Å; Y221-F225 WeakPolarHBondContact O-CD2 3.34Å; Y221-F225 PolarHBondContact O-N 3.21Å; R222-F225 PolarHBondContact O-N 3.13Å; F225-N227 PolarHBondContact O-N 3.33Å; F225-K228 PolarHBondContact O-N 3.12Å; F225-L229 WeakPolarHBondContact O-CB 3.29Å; F225-L229 VanDerWaalsContact O-CG 3.29Å; F225-L229 WeakPolarHBondContact O-CG 3.39Å; F225-L229 PolarHBondContact O-N 3.03Å
226	V	98.2	Very high	96.5	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-63.3	-41.6	-179.7	174.9	0	0	0	0	110.9	F203 F204 I208 R222 K228 L229 Y230 Y250 F271	F203-V226 HydrophobicContact CB-CG2 3.76Å; F203-V226 HydrophobicContact CD1-CG2 4.15Å; F203-V226 HydrophobicContact CD2-CG2 3.69Å; F203-V226 HydrophobicContact CE2-CG2 4.32Å; F203-V226 HydrophobicContact CG-CG2 3.6Å; F204-V226 HydrophobicContact CE1-CG2 4.31Å; I208-V226 HydrophobicContact CD1-CB 4.19Å; I208-V226 HydrophobicContact CD1-CG1 4.41Å; I208-V226 HydrophobicContact CD1-CG2 4.02Å; R222-V226 VanDerWaalsContact O-CB 3.23Å; R222-V226 WeakPolarHBondContact O-CB 3.22Å; R222-V226 WeakPolarHBondContact O-CG2 3.38Å; R222-V226 PolarHBondContact O-N 3.48Å; V226-K228 PolarHBondContact O-N 2.93Å; V226-L229 PolarHBondContact O-N 2.66Å; V226-Y230 VanDerWaalsContact O-CB 3.29Å; V226-Y230 WeakPolarHBondContact O-CB 3.49Å; V226-Y230 PolarHBondContact O-N 2.85Å; V226-Y250 HydrophobicContact CG1-CD1 3.68Å; V226-Y250 HydrophobicContact CG1-CE1 4.18Å; V226-F271 HydrophobicContact CG1-CB 4.26Å; V226-F271 HydrophobicContact CG1-CD1 3.8Å; V226-F271 HydrophobicContact CG1-CD2 4.31Å; V226-F271 HydrophobicContact CG1-CE1 4.17Å; V226-F271 HydrophobicContact CG1-CG 3.86Å; V226-F271 HydrophobicContact CG2-CD1 4.43Å; V226-F271 HydrophobicContact CG2-CE1 3.99Å; V226-F271 HydrophobicContact CG2-CZ 4.21Å
227	N	95.8	Very high	96.5	Very high	53 Å²	53	44.6 Å²	44.6	28%	0.283	21%	0.21	S	C	.	.	H	α-helix	trans	-63.2	-41.9	175.3	-71.9	-18.6	0	0	0	111.8	K223 F225 Y230 Q231 P252	K223-N227 WeakPolarHBondContact O-CB 3.35Å; K223-N227 PolarHBondContact O-N 3.1Å; K223-N227 PolarHBondContact O-ND2 3.21Å; K223-N227 VanDerWaalsContact O-ND2 3.12Å; F225-N227 PolarHBondContact O-N 3.33Å; N227-Y230 PolarHBondContact O-N 3.34Å; N227-Q231 WeakPolarHBondContact O-CB 3.42Å; N227-Q231 WeakPolarHBondContact O-CG 3.36Å; N227-Q231 PolarHBondContact O-N 3.14Å; N227-P252 WeakPolarHBondContact OD1-CB 3.3Å
228	K	96.5	Very high	96.5	Very high	46 Å²	46	44.6 Å²	44.6	20%	0.2	21%	0.21	C	C	.	.	H	α-helix	trans	-64.7	-44.8	176.8	-78	176.9	175.7	179	0	112.1	F181 N182 L185 E224 F225 V226 Y230 Q231 H232	F181-K228 HydrophobicContact CE1-CB 4.41Å; F181-K228 HydrophobicContact CE1-CD 4.32Å; N182-K228 PolarHBondContact OD1-NZ 3.06Å; L185-K228 HydrophobicContact CD1-CB 3.65Å; L185-K228 HydrophobicContact CD1-CD 4.46Å; L185-K228 HydrophobicContact CD1-CG 4.5Å; E224-K228 HydrophobicContact CG-CD 4.18Å; E224-K228 WeakPolarHBondContact O-CB 3.29Å; E224-K228 VanDerWaalsContact O-CG 3.3Å; E224-K228 WeakPolarHBondContact O-CG 3.44Å; E224-K228 PolarHBondContact O-N 3.18Å; E224-K228 WeakPolarHBondContact OE1-CE 3.43Å; E224-K228 IonicContact OE1-NZ 2.66Å; E224-K228 PolarHBondContact OE1-NZ 2.95Å; F225-K228 PolarHBondContact O-N 3.12Å; V226-K228 PolarHBondContact O-N 2.93Å; K228-Y230 VanDerWaalsContact C-N 3.33Å; K228-Y230 PolarHBondContact O-N 2.83Å; K228-Q231 PolarHBondContact O-N 2.92Å; K228-H232 PolarHBondContact O-N 2.68Å; K228-H232 PolarHBondContact O-ND1 3.02Å
229	L	97	Very high	96.5	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-58	-47.9	175.4	-71.8	169.9	0	0	0	110.7	F181 L185 V197 F203 F225 V226 Q231 H232 K233 I234 F271	F181-L229 HydrophobicContact CE2-CD2 3.98Å; F181-L229 HydrophobicContact CZ-CD2 3.79Å; F181-L229 HydrophobicContact CZ-CG 3.96Å; L185-L229 HydrophobicContact CD2-CD2 3.95Å; V197-L229 HydrophobicContact CG2-CD1 4.14Å; V197-L229 HydrophobicContact CG2-CD2 3.7Å; F203-L229 HydrophobicContact CE2-CD1 3.81Å; F203-L229 HydrophobicContact CZ-CD1 4.19Å; F225-L229 WeakPolarHBondContact O-CB 3.29Å; F225-L229 VanDerWaalsContact O-CG 3.29Å; F225-L229 WeakPolarHBondContact O-CG 3.39Å; F225-L229 PolarHBondContact O-N 3.03Å; V226-L229 PolarHBondContact O-N 2.66Å; L229-Q231 PolarHBondContact O-N 3.17Å; L229-H232 CarbonylContact O-C 3.56Å; L229-H232 PolarHBondContact O-N 2.93Å; L229-H232 VanDerWaalsContact O-N 3.08Å; L229-K233 PolarHBondContact O-N 3.28Å; L229-I234 CarbonylContact C-O 3.59Å; L229-I234 HydrophobicContact CB-CB 4.16Å; L229-I234 HydrophobicContact CD2-CB 3.96Å; L229-I234 HydrophobicContact CD2-CD1 3.96Å; L229-I234 HydrophobicContact CD2-CG1 4.48Å; L229-I234 HydrophobicContact CD2-CG2 3.88Å; L229-I234 PolarHBondContact O-N 3.16Å; L229-F271 HydrophobicContact CB-CD2 4.49Å; L229-F271 HydrophobicContact CB-CE2 4.15Å; L229-F271 HydrophobicContact CD1-CE2 3.77Å; L229-F271 HydrophobicContact CD1-CZ 4.12Å
230	Y	94.5	Very high	96.5	Very high	13 Å²	13	41 Å²	41	5%	0.051	19%	0.189	C	C	.	.	H	α-helix	trans	-60.3	-46.4	179.3	-165.1	-93.4	0	0	0	112.9	V226 N227 K228 H232 K233 Y235 T251 P252 N266 D268 K269 F271	V226-Y230 VanDerWaalsContact O-CB 3.29Å; V226-Y230 WeakPolarHBondContact O-CB 3.49Å; V226-Y230 PolarHBondContact O-N 2.85Å; N227-Y230 PolarHBondContact O-N 3.34Å; K228-Y230 VanDerWaalsContact C-N 3.33Å; K228-Y230 PolarHBondContact O-N 2.83Å; Y230-H232 PolarHBondContact O-N 2.83Å; Y230-H232 VanDerWaalsContact O-N 3.15Å; Y230-K233 PolarHBondContact O-N 3.38Å; Y230-Y235 HydrophobicContact CD2-CD1 4.02Å; Y230-Y235 HydrophobicContact CD2-CE1 4Å; Y230-Y235 HydrophobicContact CE2-CD1 4.04Å; Y230-Y235 AromaticContact CE2-CE1 3.88Å; Y230-Y235 HydrophobicContact CE2-CE1 3.88Å; Y230-T251 WeakPolarHBondContact OH-CG2 3.39Å; Y230-P252 HydrophobicContact CD1-CB 4.15Å; Y230-P252 HydrophobicContact CD1-CG 3.73Å; Y230-P252 VanDerWaalsContact CD2-CD 3.41Å; Y230-P252 HydrophobicContact CD2-CG 3.89Å; Y230-P252 HydrophobicContact CE1-CG 4.36Å; Y230-P252 HydrophobicContact CE2-CG 4.47Å; Y230-P252 HydrophobicContact CG-CB 4.39Å; Y230-P252 VanDerWaalsContact CG-CD 3.49Å; Y230-P252 HydrophobicContact CG-CG 3.47Å; Y230-P252 VanDerWaalsContact CG-CG 3.47Å; Y230-N266 PolarHBondContact OH-ND2 3.06Å; Y230-D268 WeakPolarHBondContact OH-CB 3.35Å; Y230-D268 PolarHBondContact OH-O 3.49Å; Y230-K269 WeakPolarHBondContact CE2-O 3.28Å; Y230-K269 PolarHBondContact OH-O 2.95Å; Y230-K269 VanDerWaalsContact OH-O 3.07Å; Y230-F271 HydrophobicContact CD2-CB 4.12Å
231	Q	92.4	Very high	96.7	Very high	143 Å²	143	34.9 Å²	34.9	67%	0.668	16%	0.156	S	C	*	.	H	α-helix	trans	-58.7	-26.6	175.9	-75.3	169.8	-5.7	0	0	113.1	N227 K228 L229	N227-Q231 WeakPolarHBondContact O-CB 3.42Å; N227-Q231 WeakPolarHBondContact O-CG 3.36Å; N227-Q231 PolarHBondContact O-N 3.14Å; K228-Q231 PolarHBondContact O-N 2.92Å; L229-Q231 PolarHBondContact O-N 3.17Å
232	H	92.6	Very high	96.7	Very high	85 Å²	85	32.8 Å²	32.8	39%	0.394	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	16.7	177	-64.2	82.4	0	0	0	112.8	L185 K228 L229 Y230 I234	L185-H232 HydrophobicContact CD2-CB 4.44Å; L185-H232 PolarHBondContact O-CD2 3.49Å; K228-H232 PolarHBondContact O-N 2.68Å; K228-H232 PolarHBondContact O-ND1 3.02Å; L229-H232 CarbonylContact O-C 3.56Å; L229-H232 PolarHBondContact O-N 2.93Å; L229-H232 VanDerWaalsContact O-N 3.08Å; Y230-H232 PolarHBondContact O-N 2.83Å; Y230-H232 VanDerWaalsContact O-N 3.15Å; H232-I234 HydrophobicContact CB-CD1 4.44Å; H232-I234 HydrophobicContact CB-CG1 4.27Å; H232-I234 PolarHBondContact O-N 3.17Å
233	K	91.9	Very high	96.7	Very high	138 Å²	138	33.5 Å²	33.5	60%	0.6	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	58	32.2	178.7	-52.7	-169.1	173.6	-166.7	0	114.2	L229 Y230 Y235	L229-K233 PolarHBondContact O-N 3.28Å; Y230-K233 PolarHBondContact O-N 3.38Å; K233-Y235 HydrophobicContact CB-CE2 3.88Å; K233-Y235 WeakPolarHBondContact CB-OH 3.38Å; K233-Y235 WeakPolarHBondContact CG-OH 3.48Å; K233-Y235 WeakPolarHBondContact O-CD2 3.33Å; K233-Y235 WeakPolarHBondContact O-CE2 3.29Å
234	I	94.4	Very high	96.7	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.01	16%	0.155	C	C	.	.			trans	-99.8	103.4	175.1	-50.4	-174.2	0	0	0	107.8	I157 L185 V197 L229 H232 F271	I157-I234 HydrophobicContact CD1-CD1 3.95Å; L185-I234 HydrophobicContact CD2-CD1 3.54Å; V197-I234 HydrophobicContact CG2-CG2 3.86Å; L229-I234 CarbonylContact C-O 3.59Å; L229-I234 HydrophobicContact CB-CB 4.16Å; L229-I234 HydrophobicContact CD2-CB 3.96Å; L229-I234 HydrophobicContact CD2-CD1 3.96Å; L229-I234 HydrophobicContact CD2-CG1 4.48Å; L229-I234 HydrophobicContact CD2-CG2 3.88Å; L229-I234 PolarHBondContact O-N 3.16Å; H232-I234 HydrophobicContact CB-CD1 4.44Å; H232-I234 HydrophobicContact CB-CG1 4.27Å; H232-I234 PolarHBondContact O-N 3.17Å; I234-F271 WeakPolarHBondContact O-CD2 3.38Å
235	Y	95.5	Very high	96.7	Very high	30 Å²	30	32.9 Å²	32.9	12%	0.118	15%	0.151	C	C	.	.			trans	-105.4	-5.6	-166.9	-54.7	-60.7	0	0	0	115	Y230 K233 D268 K269 F271 S272	Y230-Y235 HydrophobicContact CD2-CD1 4.02Å; Y230-Y235 HydrophobicContact CD2-CE1 4Å; Y230-Y235 HydrophobicContact CE2-CD1 4.04Å; Y230-Y235 AromaticContact CE2-CE1 3.88Å; Y230-Y235 HydrophobicContact CE2-CE1 3.88Å; K233-Y235 HydrophobicContact CB-CE2 3.88Å; K233-Y235 WeakPolarHBondContact CB-OH 3.38Å; K233-Y235 WeakPolarHBondContact CG-OH 3.48Å; K233-Y235 WeakPolarHBondContact O-CD2 3.33Å; K233-Y235 WeakPolarHBondContact O-CE2 3.29Å; Y235-D268 HydrophobicContact CE1-CB 4.4Å; Y235-K269 HydrophobicContact CD1-CB 4.43Å; Y235-K269 HydrophobicContact CD2-CB 4.18Å; Y235-K269 HydrophobicContact CD2-CD 4.45Å; Y235-K269 HydrophobicContact CE2-CB 4.39Å; Y235-K269 HydrophobicContact CG-CB 4.19Å; Y235-K269 HydrophobicContact CG-CD 4.42Å; Y235-F271 CarbonylContact O-C 3.52Å; Y235-F271 WeakPolarHBondContact O-CA 3.44Å; Y235-S272 PolarHBondContact O-N 3.2Å
236	Y	97.8	Very high	96.7	Very high	18 Å²	18	35 Å²	35	7%	0.071	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	126.5	-173.3	-57.8	-88.5	0	0	0	111.1	V197 K269 I274 L306	V197-Y236 PolarHBondContact N-O 3.45Å; Y236-K269 HydrophobicContact CE2-CD 4.28Å; Y236-K269 VanDerWaalsContact CZ-CE 3.43Å; Y236-K269 VanDerWaalsContact OH-CE 3.24Å; Y236-K269 WeakPolarHBondContact OH-CE 3.49Å; Y236-K269 PolarHBondContact OH-NZ 3.3Å; Y236-I274 HydrophobicContact CD1-CD1 4.11Å; Y236-L306 HydrophobicContact CD1-CD1 4.38Å; Y236-L306 HydrophobicContact CD1-CD2 3.94Å; Y236-L306 HydrophobicContact CD2-CB 4.44Å; Y236-L306 HydrophobicContact CD2-CD1 4.28Å; Y236-L306 HydrophobicContact CE1-CB 4.08Å; Y236-L306 HydrophobicContact CE1-CD2 3.9Å; Y236-L306 HydrophobicContact CE1-CG 4.44Å; Y236-L306 HydrophobicContact CE2-CB 3.99Å; Y236-L306 HydrophobicContact CG-CD1 4.11Å; Y236-L306 HydrophobicContact CG-CD2 4.48Å
237	S	98.8	Very high	96.6	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	126.9	172.4	-172.1	0	0	0	0	110.3	V197 Q199 S272 M273 I274	V197-S237 CarbonylContact O-C 3.58Å; V197-S237 WeakPolarHBondContact O-CA 3.31Å; Q199-S237 PolarHBondContact OE1-OG 2.83Å; S237-S272 PolarHBondContact N-O 3.19Å; S237-M273 VanDerWaalsContact O-CE 3.29Å; S237-M273 WeakPolarHBondContact O-CE 3.48Å; S237-I274 PolarHBondContact O-N 3.08Å
238	F	98.9	Very high	96.8	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	140.7	176.7	-68.1	-91.2	0	0	0	111.1	V35 V196 V197 F198 Q199 I274 V293 L306 H308	V35-F238 HydrophobicContact CG2-CD1 4.31Å; V196-F238 HydrophobicContact CG1-CD2 3.64Å; V196-F238 HydrophobicContact CG1-CE2 3.65Å; V197-F238 PolarHBondContact O-N 3.21Å; F198-F238 HydrophobicContact CD1-CB 3.62Å; F198-F238 HydrophobicContact CD1-CD2 4.27Å; F198-F238 HydrophobicContact CD1-CG 4.26Å; F198-F238 HydrophobicContact CE1-CB 3.81Å; F198-F238 AromaticContact CE1-CD2 3.8Å; F198-F238 HydrophobicContact CE1-CD2 3.8Å; F198-F238 AromaticContact CE1-CG 3.96Å; F198-F238 HydrophobicContact CE1-CG 3.96Å; Q199-F238 PolarHBondContact N-O 2.97Å; F238-I274 CarbonylContact C-O 3.59Å; F238-I274 WeakPolarHBondContact CA-O 3.39Å; F238-I274 HydrophobicContact CD1-CB 3.79Å; F238-I274 HydrophobicContact CD1-CG2 3.72Å; F238-I274 HydrophobicContact CE1-CB 3.92Å; F238-I274 HydrophobicContact CE1-CD1 4.27Å; F238-I274 HydrophobicContact CE1-CG1 4.29Å; F238-I274 HydrophobicContact CE1-CG2 3.7Å; F238-I274 HydrophobicContact CE2-CD1 4.42Å; F238-I274 HydrophobicContact CG-CB 4.44Å; F238-I274 HydrophobicContact CZ-CD1 4.19Å; F238-V293 HydrophobicContact CE1-CG2 3.78Å; F238-V293 HydrophobicContact CZ-CG1 3.93Å; F238-V293 HydrophobicContact CZ-CG2 3.89Å; F238-L306 HydrophobicContact CE2-CD1 4.11Å; F238-L306 HydrophobicContact CE2-CD2 4.45Å; F238-L306 HydrophobicContact CZ-CD1 4.34Å; F238-L306 HydrophobicContact CZ-CD2 3.92Å; F238-H308 HydrophobicContact CE1-CB 4.45Å
239	A	98.9	Very high	96.8	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	165.3	-179	0	0	0	0	0	113.9	Q199 H200 P202 M273 I274 T275 S276	Q199-A239 HydrophobicContact CG-CB 4.14Å; Q199-A239 WeakPolarHBondContact O-CA 3.39Å; H200-A239 WeakPolarHBondContact O-CB 3.43Å; P202-A239 HydrophobicContact CB-CB 4.39Å; P202-A239 HydrophobicContact CG-CB 3.89Å; A239-M273 HydrophobicContact CB-CE 3.34Å; A239-I274 PolarHBondContact N-O 2.67Å; A239-T275 WeakPolarHBondContact O-CA 3.17Å; A239-S276 PolarHBondContact O-N 2.81Å
240	G	98.8	Very high	96.7	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.201	C	C	.	.			trans	-111.4	-130.1	165.3	0	0	0	0	0	110.4	D38 H200 L242 T275	D38-G240 VanDerWaalsContact OD2-CA 3.25Å; D38-G240 WeakPolarHBondContact OD2-CA 3.48Å; H200-G240 CarbonylContact O-C 3.51Å; H200-G240 PolarHBondContact O-N 3Å; H200-G240 VanDerWaalsContact O-N 3.11Å; G240-L242 PolarHBondContact O-N 3.27Å; G240-T275 WeakPolarHBondContact O-CG2 3.48Å
241	H	98.7	Very high	96.8	Very high	5 Å²	5	43.1 Å²	43.1	2%	0.023	21%	0.209	C	C	.	.	S	Bend	trans	66.6	-34	170.6	-171.7	62.3	0	0	0	116.7	D38 N123 H200 Y214 H243	D38-H241 VanDerWaalsContact CG-N 3.29Å; D38-H241 WeakPolarHBondContact OD1-CA 3.15Å; D38-H241 PolarHBondContact OD1-N 3.03Å; D38-H241 PolarHBondContact OD2-N 3.26Å; N123-H241 PolarHBondContact OD1-CE1 2.72Å; N123-H241 VanDerWaalsContact OD1-CE1 3.22Å; N123-H241 PolarHBondContact OD1-ND1 3.18Å; H200-H241 AromaticContact CD2-ND1 3.86Å; H200-H241 AromaticContact CE1-ND1 3.88Å; H200-H241 AromaticContact NE2-CG 3.64Å; H200-H241 AromaticContact NE2-ND1 3.15Å; H200-H241 PolarHBondContact NE2-ND1 3.22Å; H200-H241 VanDerWaalsContact NE2-ND1 3.15Å; H200-H241 VanDerWaalsContact O-CB 3.31Å; H200-H241 WeakPolarHBondContact O-CB 3.3Å; Y214-H241 AromaticContact CD1-NE2 3.92Å; Y214-H241 AromaticContact CE1-CE1 3.43Å; Y214-H241 VanDerWaalsContact CE1-CE1 3.43Å; Y214-H241 WeakPolarHBondContact CE1-CE1 3.29Å; Y214-H241 AromaticContact CE1-NE2 3.74Å; Y214-H241 AromaticContact CZ-CE1 3.57Å; Y214-H241 PolarHBondContact O-NE2 3.2Å; H241-H243 VanDerWaalsContact C-N 3.32Å; H241-H243 PolarHBondContact O-CD2 3.42Å
242	L	98	Very high	96.7	Very high	16 Å²	16	36.8 Å²	36.8	8%	0.084	18%	0.181	C	C	.	.	S	Bend	trans	-77.6	-21.4	179.9	-173.2	63	0	0	0	112.3	L205 F215 G240 K244 N246 T275 L283	L205-L242 HydrophobicContact CD1-CD1 3.89Å; L205-L242 HydrophobicContact CD2-CD1 3.98Å; L205-L242 HydrophobicContact CD2-CD2 3.98Å; L205-L242 HydrophobicContact CD2-CG 4.47Å; F215-L242 HydrophobicContact CB-CD1 4.01Å; F215-L242 HydrophobicContact CD1-CD1 3.94Å; F215-L242 HydrophobicContact CG-CD1 3.96Å; G240-L242 PolarHBondContact O-N 3.27Å; L242-K244 HydrophobicContact CD2-CB 4Å; L242-K244 HydrophobicContact CG-CB 3.96Å; L242-K244 HydrophobicContact CG-CG 4.29Å; L242-K244 PolarHBondContact O-N 3.37Å; L242-K244 VanDerWaalsContact O-N 3.13Å; L242-N246 HydrophobicContact CD2-CB 3.67Å; L242-T275 HydrophobicContact CB-CG2 3.54Å; L242-T275 HydrophobicContact CD2-CG2 4.08Å; L242-T275 HydrophobicContact CG-CG2 4.47Å; L242-L283 WeakPolarHBondContact O-CD1 3.16Å
243	H	98.3	Very high	96.3	Very high	15 Å²	15	37.4 Å²	37.4	7%	0.069	19%	0.186	C	C	.	.	S	Bend	trans	54.9	27.2	-171.5	-67.6	-122.8	0	0	0	112.6	D38 Q40 H241 S277 S278 V281 L283	D38-H243 IonicContact OD1-NE2 2.65Å; Q40-H243 PolarHBondContact OE1-CE1 3.17Å; Q40-H243 PolarHBondContact OE1-NE2 3.2Å; Q40-H243 VanDerWaalsContact OE1-NE2 3.08Å; H241-H243 VanDerWaalsContact C-N 3.32Å; H241-H243 PolarHBondContact O-CD2 3.42Å; H243-S277 PolarHBondContact O-OG 3.46Å; H243-S278 WeakPolarHBondContact ND1-CB 3.3Å; H243-V281 PolarHBondContact ND1-O 3.4Å; H243-L283 HydrophobicContact CB-CB 4.3Å; H243-L283 HydrophobicContact CB-CD1 4.22Å; H243-L283 HydrophobicContact CB-CG 3.84Å; H243-L283 PolarHBondContact O-N 2.96Å
244	K	97.7	Very high	95.5	Very high	82 Å²	82	34.5 Å²	34.5	36%	0.357	18%	0.177	S	C	.	.	S	Bend	trans	-143.8	148.6	174.4	-56	-165.7	175.8	-177.7	0	110.4	L242 N246 S276 S277 L283	L242-K244 HydrophobicContact CD2-CB 4Å; L242-K244 HydrophobicContact CG-CB 3.96Å; L242-K244 HydrophobicContact CG-CG 4.29Å; L242-K244 PolarHBondContact O-N 3.37Å; L242-K244 VanDerWaalsContact O-N 3.13Å; K244-N246 PolarHBondContact O-N 2.86Å; K244-S276 CarbonylContact O-C 3.33Å; K244-S277 WeakPolarHBondContact CA-OG 3.47Å; K244-L283 HydrophobicContact CD-CB 4.15Å; K244-L283 WeakPolarHBondContact CE-O 3.49Å; K244-L283 HydrophobicContact CG-CB 3.75Å; K244-L283 VanDerWaalsContact CG-O 3.31Å; K244-L283 WeakPolarHBondContact CG-O 3.31Å
245	N	97.4	Very high	94.4	Very high	44 Å²	44	38.9 Å²	38.9	24%	0.235	20%	0.199	C	C	.	.			trans	-66.9	126.3	162.1	-76.4	-64.5	0	0	0	109.5	T275 D286 R291 Y310	N245-T275 WeakPolarHBondContact CA-O 3.3Å; N245-D286 VanDerWaalsContact CB-OD2 3.31Å; N245-D286 WeakPolarHBondContact CB-OD2 3.29Å; N245-D286 PolarHBondContact N-OD2 3.21Å; N245-D286 PolarHBondContact ND2-OD2 2.97Å; N245-R291 PolarHBondContact OD1-NH2 2.92Å; N245-Y310 VanDerWaalsContact CG-CG 3.47Å; N245-Y310 WeakPolarHBondContact ND2-CD1 3.43Å; N245-Y310 WeakPolarHBondContact ND2-CE1 3.29Å; N245-Y310 VanDerWaalsContact OD1-CB 3.31Å; N245-Y310 WeakPolarHBondContact OD1-CB 3.46Å; N245-Y310 WeakPolarHBondContact OD1-CD2 3.43Å
246	N	97.9	Very high	93.4	Very high	45 Å²	45	39.6 Å²	39.6	24%	0.241	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	139.4	174.4	-172.7	40.5	0	0	0	109.8	L205 L242 K244 T275	L205-N246 PolarHBondContact O-ND2 3.47Å; L242-N246 HydrophobicContact CD2-CB 3.67Å; K244-N246 PolarHBondContact O-N 2.86Å; N246-T275 PolarHBondContact N-O 3.34Å; N246-T275 PolarHBondContact O-N 2.78Å
247	I	98	Very high	92.4	Very high	97 Å²	97	47.8 Å²	47.8	50%	0.497	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	115.5	175.7	-57.7	166	0	0	0	106.7	M273 I274	I247-M273 WeakPolarHBondContact CA-O 3.36Å; I247-I274 HydrophobicContact CG1-CG2 4.42Å
248	A	98.2	Very high	91.7	Very high	8 Å²	8	52.9 Å²	52.9	7%	0.066	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	147	176.8	0	0	0	0	0	110.1	F204 L205 S272 M273	F204-A248 HydrophobicContact CD2-CB 3.9Å; F204-A248 HydrophobicContact CE2-CB 3.54Å; L205-A248 WeakPolarHBondContact O-CB 3.43Å; A248-S272 WeakPolarHBondContact O-CA 3.25Å; A248-M273 PolarHBondContact N-O 3.35Å; A248-M273 PolarHBondContact O-N 2.67Å
249	T	97.2	Very high	90.7	Very high	85 Å²	85	59.3 Å²	59.3	52%	0.521	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	147.9	-179.8	65.8	0	0	0	0	111.5	F271	T249-F271 CarbonylContact C-O 3.48Å; T249-F271 WeakPolarHBondContact CA-O 3.4Å
250	Y	96	Very high	89.8	Confident	55 Å²	55	63.6 Å²	63.6	22%	0.216	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	135.1	176.5	173	-115.8	0	0	0	110.9	I208 V226 P252 F271	I208-Y250 HydrophobicContact CB-CD1 4.21Å; I208-Y250 HydrophobicContact CB-CD2 4.02Å; I208-Y250 HydrophobicContact CB-CE1 4.31Å; I208-Y250 HydrophobicContact CB-CE2 4.19Å; I208-Y250 HydrophobicContact CB-CG 4.04Å; I208-Y250 HydrophobicContact CD1-CD1 4.4Å; I208-Y250 HydrophobicContact CG1-CD1 4.1Å; I208-Y250 HydrophobicContact CG1-CE1 3.98Å; I208-Y250 HydrophobicContact CG1-CG 4.44Å; I208-Y250 HydrophobicContact CG2-CD1 4.44Å; I208-Y250 HydrophobicContact CG2-CD2 3.65Å; I208-Y250 HydrophobicContact CG2-CE1 4.2Å; I208-Y250 HydrophobicContact CG2-CE2 3.42Å; I208-Y250 VanDerWaalsContact CG2-CE2 3.42Å; I208-Y250 HydrophobicContact CG2-CG 4.17Å; V226-Y250 HydrophobicContact CG1-CD1 3.68Å; V226-Y250 HydrophobicContact CG1-CE1 4.18Å; Y250-P252 HydrophobicContact CD1-CG 3.99Å; Y250-P252 HydrophobicContact CE1-CB 4.08Å; Y250-P252 HydrophobicContact CE1-CG 3.56Å; Y250-F271 PolarHBondContact N-O 3.43Å; Y250-F271 WeakPolarHBondContact O-CB 3.17Å; Y250-F271 PolarHBondContact O-N 2.92Å
251	T	94.6	Very high	88.6	Confident	37 Å²	37	69.3 Å²	69.3	23%	0.227	36%	0.355	C	S	.	.			trans	-116.6	103.8	175.5	-47.8	0	0	0	0	108.3	Y230 L253 N263 N266 S270	Y230-T251 WeakPolarHBondContact OH-CG2 3.39Å; T251-L253 PolarHBondContact O-N 3.12Å; T251-N263 WeakPolarHBondContact CG2-ND2 3.46Å; T251-N263 PolarHBondContact O-ND2 3.41Å; T251-N266 WeakPolarHBondContact CG2-ND2 3.41Å; T251-S270 WeakPolarHBondContact OG1-CB 3.46Å; T251-S270 PolarHBondContact OG1-OG 2.87Å
252	P	90.7	Very high	87.4	Confident	10 Å²	10	70.9 Å²	70.9	7%	0.065	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-54.7	138.6	174.5	-24.4	33.4	0	0	0	112.3	N227 Y230 Y250 N263	N227-P252 WeakPolarHBondContact OD1-CB 3.3Å; Y230-P252 HydrophobicContact CD1-CB 4.15Å; Y230-P252 HydrophobicContact CD1-CG 3.73Å; Y230-P252 VanDerWaalsContact CD2-CD 3.41Å; Y230-P252 HydrophobicContact CD2-CG 3.89Å; Y230-P252 HydrophobicContact CE1-CG 4.36Å; Y230-P252 HydrophobicContact CE2-CG 4.47Å; Y230-P252 HydrophobicContact CG-CB 4.39Å; Y230-P252 VanDerWaalsContact CG-CD 3.49Å; Y230-P252 HydrophobicContact CG-CG 3.47Å; Y230-P252 VanDerWaalsContact CG-CG 3.47Å; Y250-P252 HydrophobicContact CD1-CG 3.99Å; Y250-P252 HydrophobicContact CE1-CB 4.08Å; Y250-P252 HydrophobicContact CE1-CG 3.56Å; P252-N263 PolarHBondContact O-OD1 3.25Å
253	L	85	Confident	86.1	Confident	98 Å²	98	72.7 Å²	72.7	51%	0.513	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-68	129.4	174	-64	169.4	0	0	0	110.9	T251 H261 N263	T251-L253 PolarHBondContact O-N 3.12Å; L253-H261 HydrophobicContact CB-CB 3.93Å; L253-H261 HydrophobicContact CD1-CB 3.93Å; L253-H261 HydrophobicContact CG-CB 4.45Å; L253-N263 VanDerWaalsContact CA-OD1 3.28Å; L253-N263 WeakPolarHBondContact CA-OD1 3.45Å; L253-N263 HydrophobicContact CD2-CB 4.29Å
254	I	75.1	Confident	84.3	Confident	77 Å²	77	81.2 Å²	81.2	40%	0.395	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	141.3	172	-56.1	176.5	0	0	0	108.8	H261 T262 N266	I254-H261 CarbonylContact O-C 3.53Å; I254-H261 WeakPolarHBondContact O-CA 3.36Å; I254-T262 PolarHBondContact N-O 3.09Å; I254-T262 PolarHBondContact O-N 3.37Å; I254-T262 VanDerWaalsContact O-O 3.13Å; I254-N266 HydrophobicContact CD1-CB 3.78Å
255	I	71.7	Confident	82.4	Confident	94 Å²	94	84.1 Å²	84.1	48%	0.482	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	118.7	169.3	-58.9	173.8	0	0	0	107.7	N260 H261	I255-N260 WeakPolarHBondContact CA-O 3.33Å; I255-H261 WeakPolarHBondContact CG1-CE1 3.42Å
256	D	74	Confident	80.9	Confident	46 Å²	46	83.3 Å²	83.3	25%	0.246	43%	0.427	C	S	.	.			trans	-77.7	175.2	176.3	76	9.1	0	0	0	112.6	N258 N259 N260 T262	D256-N258 PolarHBondContact O-N 3.44Å; D256-N258 VanDerWaalsContact OD1-C 3.29Å; D256-N258 VanDerWaalsContact OD1-CA 3.28Å; D256-N258 WeakPolarHBondContact OD1-CA 3.31Å; D256-N258 WeakPolarHBondContact OD1-CB 3.29Å; D256-N258 PolarHBondContact OD1-N 3.2Å; D256-N259 PolarHBondContact O-N 3.36Å; D256-N259 PolarHBondContact OD1-N 2.85Å; D256-N260 PolarHBondContact N-O 3.23Å; D256-N260 WeakPolarHBondContact OD1-CB 3.18Å; D256-N260 PolarHBondContact OD1-N 3.14Å; D256-T262 HydrophobicContact CB-CG2 4.48Å
257	E	77.1	Confident	79.6	Confident	189 Å²	189	87.8 Å²	87.8	88%	0.883	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-18.9	177.8	63.2	-175.7	177.7	0	0	114.3
258	N	83.6	Confident	78.7	Confident	108 Å²	108	86 Å²	86	58%	0.578	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	13.3	178.8	-61.4	-60.2	0	0	0	112.5	D256 N260	D256-N258 PolarHBondContact O-N 3.44Å; D256-N258 VanDerWaalsContact OD1-C 3.29Å; D256-N258 VanDerWaalsContact OD1-CA 3.28Å; D256-N258 WeakPolarHBondContact OD1-CA 3.31Å; D256-N258 WeakPolarHBondContact OD1-CB 3.29Å; D256-N258 PolarHBondContact OD1-N 3.2Å; N258-N260 PolarHBondContact O-N 3.05Å
259	N	77.2	Confident	78.2	Confident	134 Å²	134	88.2 Å²	88.2	72%	0.717	46%	0.455	S	S	*	.	S	Bend	trans	61.8	19.1	-174.5	-95.3	-10.1	0	0	0	114.5	D256	D256-N259 PolarHBondContact O-N 3.36Å; D256-N259 PolarHBondContact OD1-N 2.85Å
260	N	79.7	Confident	78	Confident	91 Å²	91	86 Å²	86	49%	0.487	44%	0.443	S	S	.	.			trans	-88.8	137.7	173.4	-59.9	-53.5	0	0	0	110.3	I255 D256 N258 T262	I255-N260 WeakPolarHBondContact CA-O 3.33Å; D256-N260 PolarHBondContact N-O 3.23Å; D256-N260 WeakPolarHBondContact OD1-CB 3.18Å; D256-N260 PolarHBondContact OD1-N 3.14Å; N258-N260 PolarHBondContact O-N 3.05Å; N260-T262 HydrophobicContact CB-CG2 3.96Å; N260-T262 PolarHBondContact O-N 3.19Å
261	H	75	Confident	78	Confident	119 Å²	119	83.4 Å²	83.4	55%	0.551	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.4	115.1	168.3	-74.3	-72.3	0	0	0	109.8	L253 I254 I255	L253-H261 HydrophobicContact CB-CB 3.93Å; L253-H261 HydrophobicContact CD1-CB 3.93Å; L253-H261 HydrophobicContact CG-CB 4.45Å; I254-H261 CarbonylContact O-C 3.53Å; I254-H261 WeakPolarHBondContact O-CA 3.36Å; I255-H261 WeakPolarHBondContact CG1-CE1 3.42Å
262	T	73.7	Confident	78.2	Confident	38 Å²	38	82.2 Å²	82.2	23%	0.233	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	147.9	178.9	91.1	0	0	0	0	111.6	I254 D256 N260	I254-T262 PolarHBondContact N-O 3.09Å; I254-T262 PolarHBondContact O-N 3.37Å; I254-T262 VanDerWaalsContact O-O 3.13Å; D256-T262 HydrophobicContact CB-CG2 4.48Å; N260-T262 HydrophobicContact CB-CG2 3.96Å; N260-T262 PolarHBondContact O-N 3.19Å
263	N	69.8	Low	78.5	Confident	55 Å²	55	81.8 Å²	81.8	29%	0.294	42%	0.424	S	S	.	.			trans	-107	4.8	164.2	-84.2	-11.3	0	0	0	112.3	T251 P252 L253 N265 N266	T251-N263 WeakPolarHBondContact CG2-ND2 3.46Å; T251-N263 PolarHBondContact O-ND2 3.41Å; P252-N263 PolarHBondContact O-OD1 3.25Å; L253-N263 VanDerWaalsContact CA-OD1 3.28Å; L253-N263 WeakPolarHBondContact CA-OD1 3.45Å; L253-N263 HydrophobicContact CD2-CB 4.29Å; N263-N265 PolarHBondContact O-N 2.99Å; N263-N266 HydrophobicContact CB-CB 4.49Å; N263-N266 WeakPolarHBondContact O-CB 3.5Å; N263-N266 PolarHBondContact O-N 2.94Å
264	K	59.8	Low	79.2	Confident	194 Å²	194	77.1 Å²	77.1	84%	0.843	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-23.5	-165.8	-157.2	173.4	-176.7	178.6	0	113.4
265	N	58	Low	80.3	Confident	142 Å²	142	73.4 Å²	73.4	76%	0.759	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.1	8.3	176.6	-62.9	-13.8	0	0	0	112.5	N263 T267	N263-N265 PolarHBondContact O-N 2.99Å; N265-T267 PolarHBondContact O-N 2.89Å
266	N	67.1	Low	81.6	Confident	27 Å²	27	69 Å²	69	14%	0.144	36%	0.358	C	S	.	.			trans	-80.6	105.5	-178.4	-168	-1.6	0	0	0	109.4	Y230 T251 I254 N263 D268	Y230-N266 PolarHBondContact OH-ND2 3.06Å; T251-N266 WeakPolarHBondContact CG2-ND2 3.41Å; I254-N266 HydrophobicContact CD1-CB 3.78Å; N263-N266 HydrophobicContact CB-CB 4.49Å; N263-N266 WeakPolarHBondContact O-CB 3.5Å; N263-N266 PolarHBondContact O-N 2.94Å; N266-D268 VanDerWaalsContact C-N 3.3Å; N266-D268 WeakPolarHBondContact OD1-CB 3.26Å; N266-D268 PolarHBondContact OD1-N 3.36Å
267	T	69.6	Low	82.8	Confident	139 Å²	139	66.9 Å²	66.9	85%	0.853	35%	0.346	S	S	*	.			trans	-85.8	-5.7	173.2	56.1	0	0	0	0	112.3	N265	N265-T267 PolarHBondContact O-N 2.89Å
268	D	79.5	Confident	83.8	Confident	59 Å²	59	57.9 Å²	57.9	32%	0.316	30%	0.304	S	S	.	.	S	Bend	trans	-73	147.1	-179.2	-65.6	-38.5	0	0	0	110.7	Y230 Y235 N266	Y230-D268 WeakPolarHBondContact OH-CB 3.35Å; Y230-D268 PolarHBondContact OH-O 3.49Å; Y235-D268 HydrophobicContact CE1-CB 4.4Å; N266-D268 VanDerWaalsContact C-N 3.3Å; N266-D268 WeakPolarHBondContact OD1-CB 3.26Å; N266-D268 PolarHBondContact OD1-N 3.36Å
269	K	87	Confident	84.5	Confident	55 Å²	55	52.8 Å²	52.8	24%	0.239	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-56.1	148.6	172.9	-166.7	-171.8	179.3	110.1	0	110.5	Y230 Y235 Y236 D304	Y230-K269 WeakPolarHBondContact CE2-O 3.28Å; Y230-K269 PolarHBondContact OH-O 2.95Å; Y230-K269 VanDerWaalsContact OH-O 3.07Å; Y235-K269 HydrophobicContact CD1-CB 4.43Å; Y235-K269 HydrophobicContact CD2-CB 4.18Å; Y235-K269 HydrophobicContact CD2-CD 4.45Å; Y235-K269 HydrophobicContact CE2-CB 4.39Å; Y235-K269 HydrophobicContact CG-CB 4.19Å; Y235-K269 HydrophobicContact CG-CD 4.42Å; Y236-K269 HydrophobicContact CE2-CD 4.28Å; Y236-K269 VanDerWaalsContact CZ-CE 3.43Å; Y236-K269 VanDerWaalsContact OH-CE 3.24Å; Y236-K269 WeakPolarHBondContact OH-CE 3.49Å; Y236-K269 PolarHBondContact OH-NZ 3.3Å; K269-D304 IonicContact NZ-OD1 3.62Å; K269-D304 PolarHBondContact NZ-OD1 2.98Å; K269-D304 IonicContact NZ-OD2 2.61Å; K269-D304 PolarHBondContact NZ-OD2 3.29Å
270	S	93.7	Very high	85.5	Confident	39 Å²	39	46.6 Å²	46.6	27%	0.273	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-64.3	148.9	166.9	-52.2	0	0	0	0	111.5	T251	T251-S270 WeakPolarHBondContact OG1-CB 3.46Å; T251-S270 PolarHBondContact OG1-OG 2.87Å
271	F	96.1	Very high	86.4	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	130.4	164.6	-179.3	-92.6	0	0	0	109.3	F203 F204 V226 L229 Y230 I234 Y235 T249 Y250 M273	F203-F271 HydrophobicContact CD2-CE1 4.23Å; F203-F271 AromaticContact CD2-CZ 3.93Å; F203-F271 HydrophobicContact CD2-CZ 3.93Å; F203-F271 HydrophobicContact CE2-CZ 4.22Å; F204-F271 AromaticContact CE1-CD1 3.87Å; F204-F271 HydrophobicContact CE1-CD1 3.87Å; F204-F271 AromaticContact CE1-CE1 3.94Å; F204-F271 HydrophobicContact CE1-CE1 3.94Å; F204-F271 HydrophobicContact CZ-CD1 4.09Å; F204-F271 HydrophobicContact CZ-CE1 4.48Å; V226-F271 HydrophobicContact CG1-CB 4.26Å; V226-F271 HydrophobicContact CG1-CD1 3.8Å; V226-F271 HydrophobicContact CG1-CD2 4.31Å; V226-F271 HydrophobicContact CG1-CE1 4.17Å; V226-F271 HydrophobicContact CG1-CG 3.86Å; V226-F271 HydrophobicContact CG2-CD1 4.43Å; V226-F271 HydrophobicContact CG2-CE1 3.99Å; V226-F271 HydrophobicContact CG2-CZ 4.21Å; L229-F271 HydrophobicContact CB-CD2 4.49Å; L229-F271 HydrophobicContact CB-CE2 4.15Å; L229-F271 HydrophobicContact CD1-CE2 3.77Å; L229-F271 HydrophobicContact CD1-CZ 4.12Å; Y230-F271 HydrophobicContact CD2-CB 4.12Å; I234-F271 WeakPolarHBondContact O-CD2 3.38Å; Y235-F271 CarbonylContact O-C 3.52Å; Y235-F271 WeakPolarHBondContact O-CA 3.44Å; T249-F271 CarbonylContact C-O 3.48Å; T249-F271 WeakPolarHBondContact CA-O 3.4Å; Y250-F271 PolarHBondContact N-O 3.43Å; Y250-F271 WeakPolarHBondContact O-CB 3.17Å; Y250-F271 PolarHBondContact O-N 2.92Å; F271-M273 HydrophobicContact CE1-CB 4.19Å
272	S	97.7	Very high	87.4	Confident	13 Å²	13	39.3 Å²	39.3	9%	0.091	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	120.1	177	-65.1	0	0	0	0	110.3	Y235 S237 A248 I274	Y235-S272 PolarHBondContact O-N 3.2Å; S237-S272 PolarHBondContact N-O 3.19Å; A248-S272 WeakPolarHBondContact O-CA 3.25Å; S272-I274 WeakPolarHBondContact O-CD1 3.36Å
273	M	98.6	Very high	88.4	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	109.3	167.2	-172.2	63.5	-113.9	0	0	108	P202 F203 F204 S237 A239 I247 A248 F271	P202-M273 HydrophobicContact CB-CE 4.18Å; P202-M273 HydrophobicContact CB-CG 4.19Å; P202-M273 HydrophobicContact CB-SD 4.29Å; F203-M273 HydrophobicContact CB-SD 4.13Å; F203-M273 HydrophobicContact CD2-SD 4.02Å; F203-M273 HydrophobicContact CG-SD 4.5Å; F203-M273 PolarHBondContact N-SD 2.8Å; F203-M273 VanDerWaalsContact N-SD 3.42Å; F204-M273 HydrophobicContact CE1-CB 4.02Å; F204-M273 HydrophobicContact CE2-CB 4.33Å; F204-M273 HydrophobicContact CZ-CB 3.91Å; F204-M273 WeakPolarHBondContact O-CG 3.46Å; S237-M273 VanDerWaalsContact O-CE 3.29Å; S237-M273 WeakPolarHBondContact O-CE 3.48Å; A239-M273 HydrophobicContact CB-CE 3.34Å; I247-M273 WeakPolarHBondContact CA-O 3.36Å; A248-M273 PolarHBondContact N-O 3.35Å; A248-M273 PolarHBondContact O-N 2.67Å; F271-M273 HydrophobicContact CE1-CB 4.19Å
274	I	98.8	Very high	89.4	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	109	-177.6	-54.5	102.3	0	0	0	109.3	Y236 S237 F238 A239 I247 S272	Y236-I274 HydrophobicContact CD1-CD1 4.11Å; S237-I274 PolarHBondContact O-N 3.08Å; F238-I274 CarbonylContact C-O 3.59Å; F238-I274 WeakPolarHBondContact CA-O 3.39Å; F238-I274 HydrophobicContact CD1-CB 3.79Å; F238-I274 HydrophobicContact CD1-CG2 3.72Å; F238-I274 HydrophobicContact CE1-CB 3.92Å; F238-I274 HydrophobicContact CE1-CD1 4.27Å; F238-I274 HydrophobicContact CE1-CG1 4.29Å; F238-I274 HydrophobicContact CE1-CG2 3.7Å; F238-I274 HydrophobicContact CE2-CD1 4.42Å; F238-I274 HydrophobicContact CG-CB 4.44Å; F238-I274 HydrophobicContact CZ-CD1 4.19Å; A239-I274 PolarHBondContact N-O 2.67Å; I247-I274 HydrophobicContact CG1-CG2 4.42Å; S272-I274 WeakPolarHBondContact O-CD1 3.36Å
275	T	98.6	Very high	91.1	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	131.6	175	-49.9	0	0	0	0	109.7	P202 A239 G240 L242 N245 N246 R291	P202-T275 HydrophobicContact CG-CG2 3.93Å; P202-T275 WeakPolarHBondContact CG-OG1 3.41Å; A239-T275 WeakPolarHBondContact O-CA 3.17Å; G240-T275 WeakPolarHBondContact O-CG2 3.48Å; L242-T275 HydrophobicContact CB-CG2 3.54Å; L242-T275 HydrophobicContact CD2-CG2 4.08Å; L242-T275 HydrophobicContact CG-CG2 4.47Å; N245-T275 WeakPolarHBondContact CA-O 3.3Å; N246-T275 PolarHBondContact N-O 3.34Å; N246-T275 PolarHBondContact O-N 2.78Å; T275-R291 PolarHBondContact O-NH2 3.12Å
276	S	98.7	Very high	92.9	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.007	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-99.7	142.2	176.2	-48.8	0	0	0	0	109.4	A239 K244 R291	A239-S276 PolarHBondContact O-N 2.81Å; K244-S276 CarbonylContact O-C 3.33Å; S276-R291 PolarHBondContact OG-NE 3.4Å
277	S	98.4	Very high	94.3	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.007	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-67.2	159.2	172.9	-157.7	0	0	0	0	111.5	H243 K244 Q282 D286 Y310	H243-S277 PolarHBondContact O-OG 3.46Å; K244-S277 WeakPolarHBondContact CA-OG 3.47Å; S277-Q282 VanDerWaalsContact OG-CG 3.27Å; S277-Q282 WeakPolarHBondContact OG-CG 3.35Å; S277-D286 VanDerWaalsContact CB-OD2 3.23Å; S277-D286 WeakPolarHBondContact CB-OD2 3.47Å; S277-D286 PolarHBondContact OG-OD2 3.5Å; S277-Y310 WeakPolarHBondContact CB-OH 3.21Å
278	S	98.5	Very high	95.7	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.186	C	C	.	.	P	Polyproline II helix	trans	-64	139.7	178.5	168.9	0	0	0	0	110.4	A37 D38 H243 C280 V281 Q282	A37-S278 CarbonylContact O-C 3.5Å; A37-S278 WeakPolarHBondContact O-CA 3.46Å; D38-S278 PolarHBondContact O-OG 3.28Å; H243-S278 WeakPolarHBondContact ND1-CB 3.3Å; S278-C280 PolarHBondContact O-N 2.89Å; S278-C280 PolarHBondContact OG-N 3.43Å; S278-V281 WeakPolarHBondContact CB-O 3.35Å; S278-V281 PolarHBondContact OG-N 3.43Å; S278-V281 PolarHBondContact OG-O 3.17Å; S278-Q282 PolarHBondContact O-NE2 3.43Å
279	V	98.8	Very high	96.6	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.006	17%	0.171	C	C	.	.	S	Bend	trans	-68.7	-14.6	172.8	70	0	0	0	0	112.8	I36 A37 P39 V64 A67 P288 I290 L313	I36-V279 HydrophobicContact CG2-CB 3.8Å; I36-V279 HydrophobicContact CG2-CG1 3.64Å; I36-V279 HydrophobicContact CG2-CG2 4.2Å; A37-V279 PolarHBondContact O-N 2.74Å; P39-V279 HydrophobicContact CB-CG1 4.06Å; P39-V279 HydrophobicContact CG-CG1 4.03Å; V64-V279 HydrophobicContact CG2-CG1 4.43Å; A67-V279 HydrophobicContact CB-CG2 3.67Å; V279-P288 WeakPolarHBondContact O-CB 3.32Å; V279-I290 HydrophobicContact CG2-CG2 4.12Å; V279-L313 HydrophobicContact CG2-CD2 4.45Å
280	C	98.5	Very high	97.2	Very high	5 Å²	5	27.3 Å²	27.3	3%	0.034	16%	0.161	C	C	.	.	S	Bend	trans	-115.2	-69.4	-177.3	-70.7	0	0	0	0	112.5	P39 E60 L63 S278 Q282	P39-C280 WeakPolarHBondContact O-CB 3.37Å; P39-C280 PolarHBondContact O-SG 3.05Å; E60-C280 HydrophobicContact CB-CB 4.13Å; E60-C280 HydrophobicContact CG-CB 3.86Å; L63-C280 HydrophobicContact CD1-CB 4.33Å; L63-C280 WeakPolarHBondContact CD1-O 3.46Å; S278-C280 PolarHBondContact O-N 2.89Å; S278-C280 PolarHBondContact OG-N 3.43Å; C280-Q282 PolarHBondContact O-NE2 3.47Å
281	V	97.7	Very high	97.4	Very high	17 Å²	17	25.8 Å²	25.8	10%	0.103	15%	0.149	C	C	.	.			trans	-119	114.5	-171	173.1	0	0	0	0	110.1	L43 Q44 V48 H243 S278	L43-V281 HydrophobicContact CD2-CB 3.73Å; L43-V281 HydrophobicContact CD2-CG1 3.75Å; L43-V281 HydrophobicContact CD2-CG2 4.15Å; Q44-V281 HydrophobicContact CB-CG2 3.74Å; Q44-V281 HydrophobicContact CG-CG2 4.29Å; V48-V281 HydrophobicContact CG2-CG1 3.45Å; V48-V281 VanDerWaalsContact CG2-CG1 3.45Å; H243-V281 PolarHBondContact ND1-O 3.4Å; S278-V281 WeakPolarHBondContact CB-O 3.35Å; S278-V281 PolarHBondContact OG-N 3.43Å; S278-V281 PolarHBondContact OG-O 3.17Å
282	Q	96.8	Very high	97.5	Very high	39 Å²	39	26.2 Å²	26.2	18%	0.182	15%	0.151	C	C	.	.			trans	-97.5	160.1	-175.9	-55.1	70.3	42.8	0	0	111.4	S277 S278 C280 D286	S277-Q282 VanDerWaalsContact OG-CG 3.27Å; S277-Q282 WeakPolarHBondContact OG-CG 3.35Å; S278-Q282 PolarHBondContact O-NE2 3.43Å; C280-Q282 PolarHBondContact O-NE2 3.47Å; Q282-D286 HydrophobicContact CB-CB 3.97Å; Q282-D286 WeakPolarHBondContact CB-O 3.23Å; Q282-D286 HydrophobicContact CG-CB 4.03Å; Q282-D286 WeakPolarHBondContact CG-O 3.22Å
283	L	93.8	Very high	97.6	Very high	75 Å²	75	25.6 Å²	25.6	39%	0.393	15%	0.147	S	C	.	.	S	Bend	trans	-101.4	151.3	162.2	-65.4	179.2	0	0	0	109.2	F215 L242 H243 K244	F215-L283 HydrophobicContact CE1-CD1 4.3Å; F215-L283 HydrophobicContact CZ-CD1 4.22Å; L242-L283 WeakPolarHBondContact O-CD1 3.16Å; H243-L283 HydrophobicContact CB-CB 4.3Å; H243-L283 HydrophobicContact CB-CD1 4.22Å; H243-L283 HydrophobicContact CB-CG 3.84Å; H243-L283 PolarHBondContact O-N 2.96Å; K244-L283 HydrophobicContact CD-CB 4.15Å; K244-L283 WeakPolarHBondContact CE-O 3.49Å; K244-L283 HydrophobicContact CG-CB 3.75Å; K244-L283 VanDerWaalsContact CG-O 3.31Å; K244-L283 WeakPolarHBondContact CG-O 3.31Å
284	G	92.3	Very high	97.5	Very high	55 Å²	55	27.8 Å²	27.8	57%	0.567	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.7	-146.1	-179.4	0	0	0	0	0	112
285	D	94	Very high	97.2	Very high	158 Å²	158	28 Å²	28	85%	0.845	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-2.4	-171.6	-58.1	-39.9	0	0	0	113.6	Q287	D285-Q287 PolarHBondContact O-NE2 3.32Å
286	D	96	Very high	96.8	Very high	44 Å²	44	29 Å²	29	24%	0.235	16%	0.163	C	C	.	.			trans	-60.6	147.4	177.8	-81.4	12.7	0	0	0	111.6	N245 S277 Q282	N245-D286 VanDerWaalsContact CB-OD2 3.31Å; N245-D286 WeakPolarHBondContact CB-OD2 3.29Å; N245-D286 PolarHBondContact N-OD2 3.21Å; N245-D286 PolarHBondContact ND2-OD2 2.97Å; S277-D286 VanDerWaalsContact CB-OD2 3.23Å; S277-D286 WeakPolarHBondContact CB-OD2 3.47Å; S277-D286 PolarHBondContact OG-OD2 3.5Å; Q282-D286 HydrophobicContact CB-CB 3.97Å; Q282-D286 WeakPolarHBondContact CB-O 3.23Å; Q282-D286 HydrophobicContact CG-CB 4.03Å; Q282-D286 WeakPolarHBondContact CG-O 3.22Å
287	Q	97.3	Very high	95.8	Very high	103 Å²	103	29.5 Å²	29.5	48%	0.481	17%	0.169	S	C	.	.			trans	-105.8	159.5	174	-59.9	-56.6	-62.1	0	0	110.9	D285 G289 Y310 T312	D285-Q287 PolarHBondContact O-NE2 3.32Å; Q287-G289 PolarHBondContact O-N 2.72Å; Q287-Y310 PolarHBondContact O-OH 3.3Å; Q287-T312 HydrophobicContact CB-CG2 3.71Å; Q287-T312 HydrophobicContact CG-CG2 4.43Å
288	P	98.5	Very high	94.2	Very high	21 Å²	21	34.7 Å²	34.7	14%	0.136	20%	0.197	C	C	.	.	S	Bend	trans	-50.2	134.7	173.3	-26.1	34.6	0	0	0	111.1	L63 V279 T312 L313	L63-P288 HydrophobicContact CD1-CB 4.44Å; L63-P288 HydrophobicContact CD1-CG 4.18Å; L63-P288 HydrophobicContact CD2-CB 4.02Å; L63-P288 HydrophobicContact CD2-CG 4.12Å; V279-P288 WeakPolarHBondContact O-CB 3.32Å; P288-T312 CarbonylContact O-C 3.58Å; P288-T312 VanDerWaalsContact O-CA 3.29Å; P288-T312 WeakPolarHBondContact O-CA 3.25Å; P288-L313 HydrophobicContact CB-CD1 4.01Å; P288-L313 HydrophobicContact CB-CG 4.26Å; P288-L313 PolarHBondContact O-N 3.42Å
289	G	98.6	Very high	92.1	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.8	-177.2	-172.7	0	0	0	0	0	114.1	Q287 Y310 W311	Q287-G289 PolarHBondContact O-N 2.72Å; G289-Y310 WeakPolarHBondContact CA-OH 3.47Å; G289-Y310 PolarHBondContact N-OH 3.33Å; G289-W311 CarbonylContact C-O 3.48Å; G289-W311 WeakPolarHBondContact CA-O 3.43Å
290	I	98.8	Very high	89.8	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.01	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	157	179.5	64.5	178.9	0	0	0	109.2	V34 I36 A67 I70 V71 V279 L292 W311 L313 L316	V34-I290 HydrophobicContact CG1-CB 4.14Å; V34-I290 HydrophobicContact CG1-CD1 3.89Å; V34-I290 HydrophobicContact CG1-CG1 4.39Å; I36-I290 HydrophobicContact CD1-CG2 4.37Å; I36-I290 HydrophobicContact CG1-CB 4.48Å; I36-I290 HydrophobicContact CG1-CG2 3.84Å; A67-I290 HydrophobicContact CB-CG2 4.09Å; I70-I290 HydrophobicContact CG2-CD1 4.01Å; V71-I290 HydrophobicContact CG2-CD1 3.98Å; V279-I290 HydrophobicContact CG2-CG2 4.12Å; I290-L292 HydrophobicContact CD1-CD2 4.2Å; I290-L292 HydrophobicContact CG1-CD2 4.45Å; I290-W311 PolarHBondContact N-O 3.21Å; I290-W311 PolarHBondContact O-N 3.12Å; I290-L313 HydrophobicContact CG2-CD2 4.06Å; I290-L316 HydrophobicContact CD1-CD1 3.58Å; I290-L316 HydrophobicContact CG1-CD1 3.48Å; I290-L316 VanDerWaalsContact CG1-CD1 3.48Å
291	R	98.8	Very high	87.8	Confident	6 Å²	6	56 Å²	56	2%	0.023	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	126.6	174.4	179.2	179.9	-54.5	-70.2	4.4	110.4	V34 V35 N245 T275 S276 V293 H308 V309 Y310	V34-R291 WeakPolarHBondContact CA-O 3.25Å; V35-R291 HydrophobicContact CB-CB 4.18Å; V35-R291 PolarHBondContact N-O 3.22Å; V35-R291 PolarHBondContact O-N 2.68Å; N245-R291 PolarHBondContact OD1-NH2 2.92Å; T275-R291 PolarHBondContact O-NH2 3.12Å; S276-R291 PolarHBondContact OG-NE 3.4Å; R291-V293 HydrophobicContact CG-CG2 4.03Å; R291-H308 HydrophobicContact CG-CB 4.29Å; R291-H308 PolarHBondContact NH1-ND1 3.27Å; R291-V309 CarbonylContact C-O 3.56Å; R291-V309 WeakPolarHBondContact CA-O 3.25Å; R291-V309 WeakPolarHBondContact CG-O 3.4Å; R291-Y310 HydrophobicContact CB-CD2 4.31Å
292	L	98.8	Very high	85.5	Confident	9 Å²	9	62.8 Å²	62.8	5%	0.047	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	135.2	169.7	-54.6	-174.4	0	0	0	108.7	V34 L74 I290 H308 V309 L316 P326 I328	V34-L292 HydrophobicContact CG2-CD2 3.8Å; L74-L292 HydrophobicContact CD1-CD2 3.91Å; I290-L292 HydrophobicContact CD1-CD2 4.2Å; I290-L292 HydrophobicContact CG1-CD2 4.45Å; L292-H308 CarbonylContact O-C 3.58Å; L292-H308 WeakPolarHBondContact O-CA 3.09Å; L292-H308 WeakPolarHBondContact O-CB 3.38Å; L292-V309 HydrophobicContact CB-CG1 4.18Å; L292-V309 PolarHBondContact N-O 3.21Å; L292-V309 PolarHBondContact O-N 3.46Å; L292-L316 HydrophobicContact CD1-CD2 4.39Å; L292-P326 HydrophobicContact CD1-CB 3.89Å; L292-P326 HydrophobicContact CD1-CG 3.57Å; L292-I328 HydrophobicContact CB-CD1 3.78Å; L292-I328 HydrophobicContact CB-CG1 3.79Å; L292-I328 HydrophobicContact CD1-CG1 4.4Å
293	V	98.5	Very high	83.7	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	132.2	179.7	-172.1	0	0	0	0	108.8	C32 F33 V35 F238 R291 L306 K307 H308	C32-V293 CarbonylContact C-O 3.57Å; C32-V293 WeakPolarHBondContact CA-O 3.48Å; C32-V293 WeakPolarHBondContact CB-O 3.25Å; F33-V293 HydrophobicContact CD1-CB 4.23Å; F33-V293 HydrophobicContact CD1-CG1 4.42Å; F33-V293 HydrophobicContact CD2-CB 3.9Å; F33-V293 HydrophobicContact CD2-CG2 4.15Å; F33-V293 HydrophobicContact CE1-CB 3.84Å; F33-V293 HydrophobicContact CE1-CG1 3.59Å; F33-V293 HydrophobicContact CE2-CB 3.45Å; F33-V293 VanDerWaalsContact CE2-CB 3.45Å; F33-V293 HydrophobicContact CE2-CG1 3.77Å; F33-V293 HydrophobicContact CE2-CG2 3.57Å; F33-V293 HydrophobicContact CG-CB 4.28Å; F33-V293 HydrophobicContact CZ-CB 3.45Å; F33-V293 VanDerWaalsContact CZ-CB 3.45Å; F33-V293 HydrophobicContact CZ-CG1 3.23Å; F33-V293 HydrophobicContact CZ-CG2 3.97Å; F33-V293 PolarHBondContact N-O 3.01Å; F33-V293 PolarHBondContact O-N 3.05Å; V35-V293 HydrophobicContact CG2-CG2 4.03Å; F238-V293 HydrophobicContact CE1-CG2 3.78Å; F238-V293 HydrophobicContact CZ-CG1 3.93Å; F238-V293 HydrophobicContact CZ-CG2 3.89Å; R291-V293 HydrophobicContact CG-CG2 4.03Å; V293-L306 HydrophobicContact CG1-CD1 4.12Å; V293-L306 HydrophobicContact CG1-CD2 3.85Å; V293-L306 HydrophobicContact CG1-CG 3.88Å; V293-K307 CarbonylContact C-O 3.39Å; V293-K307 WeakPolarHBondContact CA-O 3.25Å; V293-K307 WeakPolarHBondContact CG1-O 3.45Å; V293-H308 HydrophobicContact CB-CB 4.27Å; V293-H308 HydrophobicContact CG1-CB 4.18Å; V293-H308 HydrophobicContact CG2-CB 3.88Å
294	Q	96.5	Very high	82.6	Confident	47 Å²	47	68.1 Å²	68.1	22%	0.22	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	135.7	174	-174.9	171	-69.1	0	0	109.6	F31 C32 D296 L306 K307 I328	F31-Q294 WeakPolarHBondContact O-CA 3.34Å; C32-Q294 PolarHBondContact SG-OE1 3.21Å; Q294-D296 PolarHBondContact NE2-OD1 2.71Å; Q294-L306 WeakPolarHBondContact O-CA 3.43Å; Q294-K307 PolarHBondContact N-O 3.17Å; Q294-K307 PolarHBondContact O-N 3.46Å; Q294-I328 HydrophobicContact CB-CB 4.32Å; Q294-I328 HydrophobicContact CB-CD1 3.81Å; Q294-I328 HydrophobicContact CB-CG2 3.93Å
295	I	94.3	Very high	82.3	Confident	4 Å²	4	68.7 Å²	68.7	2%	0.021	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	116.2	166.8	-66.6	-178.8	0	0	0	106.7	P30 F31 F33 T154 F156 M194 V196 I305 L306	P30-I295 VanDerWaalsContact CA-O 3.27Å; P30-I295 WeakPolarHBondContact CA-O 3.48Å; F31-I295 HydrophobicContact CD1-CB 4.28Å; F31-I295 HydrophobicContact CE1-CB 3.74Å; F31-I295 HydrophobicContact CE1-CD1 4.45Å; F31-I295 HydrophobicContact CE1-CG2 3.8Å; F31-I295 HydrophobicContact CE2-CB 4.45Å; F31-I295 HydrophobicContact CE2-CD1 4.32Å; F31-I295 HydrophobicContact CZ-CB 3.85Å; F31-I295 HydrophobicContact CZ-CD1 3.77Å; F31-I295 HydrophobicContact CZ-CG1 4.25Å; F31-I295 HydrophobicContact CZ-CG2 4.18Å; F31-I295 PolarHBondContact N-O 3.02Å; F31-I295 PolarHBondContact O-N 3.28Å; F33-I295 HydrophobicContact CE1-CD1 3.84Å; F33-I295 HydrophobicContact CE1-CG1 4.1Å; T154-I295 HydrophobicContact CG2-CD1 3.82Å; F156-I295 HydrophobicContact CE1-CD1 4.27Å; F156-I295 HydrophobicContact CZ-CD1 4.04Å; M194-I295 HydrophobicContact CE-CD1 4.06Å; M194-I295 HydrophobicContact SD-CD1 4.39Å; M194-I295 HydrophobicContact SD-CG2 3.83Å; V196-I295 HydrophobicContact CG2-CD1 4.23Å; I295-I305 CarbonylContact C-O 3.48Å; I295-I305 WeakPolarHBondContact CA-O 3.14Å; I295-I305 HydrophobicContact CG2-CG2 3.93Å; I295-L306 HydrophobicContact CD1-CD1 4.09Å; I295-L306 HydrophobicContact CG1-CB 4.34Å; I295-L306 HydrophobicContact CG1-CD1 4.01Å; I295-L306 HydrophobicContact CG1-CG 4.08Å
296	D	89.5	Confident	82.3	Confident	20 Å²	20	61.4 Å²	61.4	11%	0.107	31%	0.31	C	S	.	.			trans	-69.4	141.8	176.6	-69.9	-18.6	0	0	0	109.5	Q294 I305 K307	Q294-D296 PolarHBondContact NE2-OD1 2.71Å; D296-I305 PolarHBondContact N-O 3.49Å; D296-I305 WeakPolarHBondContact O-CG2 3.39Å; D296-K307 IonicContact OD2-NZ 2.85Å; D296-K307 PolarHBondContact OD2-NZ 3.27Å
297	G	78.4	Confident	82.3	Confident	13 Å²	13	63.1 Å²	63.1	13%	0.134	32%	0.315	C	S	.	.	S	Bend	trans	-65.2	174	171.3	0	0	0	0	0	111.6	V27 N299	V27-G297 WeakPolarHBondContact O-CA 2.97Å; G297-N299 PolarHBondContact O-N 3.41Å
298	N	65	Low	82.4	Confident	109 Å²	109	60.3 Å²	60.3	58%	0.583	30%	0.302	S	S	*	.	S	Bend	trans	-37.8	91.2	-176.7	-84.3	-12.7	0	0	0	114.1	V27	V27-N298 WeakPolarHBondContact CB-ND2 3.28Å; V27-N298 WeakPolarHBondContact CG1-OD1 3.41Å; V27-N298 PolarHBondContact O-N 2.89Å
299	N	53.3	Low	82.3	Confident	85 Å²	85	61 Å²	61	46%	0.455	31%	0.306	S	S	.	.			trans	-112.5	141.9	166	-95.2	-9.3	0	0	0	108.5	G297	G297-N299 PolarHBondContact O-N 3.41Å
300	H	51.6	Low	82.3	Confident	170 Å²	170	62.7 Å²	62.7	79%	0.787	31%	0.313	S	S	*	.			trans	-49.2	154.2	-172.7	-63.6	-81	0	0	0	113.6	N302	H300-N302 PolarHBondContact O-N 3.39Å
301	E	54.6	Low	82.3	Confident	198 Å²	198	65.2 Å²	65.2	93%	0.925	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.9	3.8	-166.1	-61.8	179.1	152.5	0	0	119.5
302	N	49.9	Very low	82.3	Confident	161 Å²	161	66 Å²	66	86%	0.861	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.8	10.4	-170.2	-70.2	-41.7	0	0	0	116.8	H300	H300-N302 PolarHBondContact O-N 3.39Å
303	E	59	Low	82.3	Confident	130 Å²	130	65.6 Å²	65.6	61%	0.607	33%	0.325	S	S	*	.	S	Bend	trans	-112.4	155	173.6	-75	-172.7	-179.9	0	0	113.5	I305	E303-I305 PolarHBondContact O-N 3.33Å
304	D	71.2	Confident	82.3	Confident	95 Å²	95	70.1 Å²	70.1	51%	0.508	35%	0.35	S	S	.	.			trans	-67.5	94.6	174	-86.8	4.8	0	0	0	110.3	K269 L306	K269-D304 IonicContact NZ-OD1 3.62Å; K269-D304 PolarHBondContact NZ-OD1 2.98Å; K269-D304 IonicContact NZ-OD2 2.61Å; K269-D304 PolarHBondContact NZ-OD2 3.29Å; D304-L306 PolarHBondContact O-N 2.94Å
305	I	86.3	Confident	82.4	Confident	67 Å²	67	71.8 Å²	71.8	34%	0.344	36%	0.357	S	S	.	.	S	Bend	trans	-60.1	-29.2	-179.6	-64.1	168.6	0	0	0	112.2	M194 I295 D296 E303	M194-I305 HydrophobicContact SD-CG2 3.75Å; I295-I305 CarbonylContact C-O 3.48Å; I295-I305 WeakPolarHBondContact CA-O 3.14Å; I295-I305 HydrophobicContact CG2-CG2 3.93Å; D296-I305 PolarHBondContact N-O 3.49Å; D296-I305 WeakPolarHBondContact O-CG2 3.39Å; E303-I305 PolarHBondContact O-N 3.33Å
306	L	94.3	Very high	82.6	Confident	5 Å²	5	71.6 Å²	71.6	3%	0.026	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	124.8	179.4	-173.2	156.4	0	0	0	110.7	M194 V196 Y236 F238 V293 Q294 I295 D304	M194-L306 HydrophobicContact CE-CD1 4.42Å; V196-L306 HydrophobicContact CG2-CD1 3.76Å; Y236-L306 HydrophobicContact CD1-CD1 4.38Å; Y236-L306 HydrophobicContact CD1-CD2 3.94Å; Y236-L306 HydrophobicContact CD2-CB 4.44Å; Y236-L306 HydrophobicContact CD2-CD1 4.28Å; Y236-L306 HydrophobicContact CE1-CB 4.08Å; Y236-L306 HydrophobicContact CE1-CD2 3.9Å; Y236-L306 HydrophobicContact CE1-CG 4.44Å; Y236-L306 HydrophobicContact CE2-CB 3.99Å; Y236-L306 HydrophobicContact CG-CD1 4.11Å; Y236-L306 HydrophobicContact CG-CD2 4.48Å; F238-L306 HydrophobicContact CE2-CD1 4.11Å; F238-L306 HydrophobicContact CE2-CD2 4.45Å; F238-L306 HydrophobicContact CZ-CD1 4.34Å; F238-L306 HydrophobicContact CZ-CD2 3.92Å; V293-L306 HydrophobicContact CG1-CD1 4.12Å; V293-L306 HydrophobicContact CG1-CD2 3.85Å; V293-L306 HydrophobicContact CG1-CG 3.88Å; Q294-L306 WeakPolarHBondContact O-CA 3.43Å; I295-L306 HydrophobicContact CD1-CD1 4.09Å; I295-L306 HydrophobicContact CG1-CB 4.34Å; I295-L306 HydrophobicContact CG1-CD1 4.01Å; I295-L306 HydrophobicContact CG1-CG 4.08Å; D304-L306 PolarHBondContact O-N 2.94Å
307	K	95.8	Very high	83.1	Confident	80 Å²	80	72.9 Å²	72.9	35%	0.348	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	149.9	173.4	-64.8	166	-176.6	150.4	0	110.1	V293 Q294 D296 I328	V293-K307 CarbonylContact C-O 3.39Å; V293-K307 WeakPolarHBondContact CA-O 3.25Å; V293-K307 WeakPolarHBondContact CG1-O 3.45Å; Q294-K307 PolarHBondContact N-O 3.17Å; Q294-K307 PolarHBondContact O-N 3.46Å; D296-K307 IonicContact OD2-NZ 2.85Å; D296-K307 PolarHBondContact OD2-NZ 3.27Å; K307-I328 HydrophobicContact CB-CG2 3.91Å
308	H	97.9	Very high	84.1	Confident	44 Å²	44	79.2 Å²	79.2	20%	0.204	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	152.1	176.4	63.2	85.7	0	0	0	112.4	F238 R291 L292 V293	F238-H308 HydrophobicContact CE1-CB 4.45Å; R291-H308 HydrophobicContact CG-CB 4.29Å; R291-H308 PolarHBondContact NH1-ND1 3.27Å; L292-H308 CarbonylContact O-C 3.58Å; L292-H308 WeakPolarHBondContact O-CA 3.09Å; L292-H308 WeakPolarHBondContact O-CB 3.38Å; V293-H308 HydrophobicContact CB-CB 4.27Å; V293-H308 HydrophobicContact CG1-CB 4.18Å; V293-H308 HydrophobicContact CG2-CB 3.88Å
309	V	98.2	Very high	85.7	Confident	36 Å²	36	75.6 Å²	75.6	22%	0.218	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	139.3	177.9	58.6	0	0	0	0	109.3	R291 L292 E327 I328	R291-V309 CarbonylContact C-O 3.56Å; R291-V309 WeakPolarHBondContact CA-O 3.25Å; R291-V309 WeakPolarHBondContact CG-O 3.4Å; L292-V309 HydrophobicContact CB-CG1 4.18Å; L292-V309 PolarHBondContact N-O 3.21Å; L292-V309 PolarHBondContact O-N 3.46Å; V309-E327 WeakPolarHBondContact CG1-O 3.49Å; V309-I328 HydrophobicContact CG1-CB 4.28Å; V309-I328 HydrophobicContact CG1-CG1 4.11Å; V309-I328 HydrophobicContact CG1-CG2 4.28Å
310	Y	98.5	Very high	87.8	Confident	36 Å²	36	72.2 Å²	72.2	14%	0.141	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	130.7	169.3	-177.5	-90.1	0	0	0	108.3	N245 S277 Q287 G289 R291 T312	N245-Y310 VanDerWaalsContact CG-CG 3.47Å; N245-Y310 WeakPolarHBondContact ND2-CD1 3.43Å; N245-Y310 WeakPolarHBondContact ND2-CE1 3.29Å; N245-Y310 VanDerWaalsContact OD1-CB 3.31Å; N245-Y310 WeakPolarHBondContact OD1-CB 3.46Å; N245-Y310 WeakPolarHBondContact OD1-CD2 3.43Å; S277-Y310 WeakPolarHBondContact CB-OH 3.21Å; Q287-Y310 PolarHBondContact O-OH 3.3Å; G289-Y310 WeakPolarHBondContact CA-OH 3.47Å; G289-Y310 PolarHBondContact N-OH 3.33Å; R291-Y310 HydrophobicContact CB-CD2 4.31Å; Y310-T312 HydrophobicContact CE1-CG2 4.48Å
311	W	98.5	Very high	90	Very high	54 Å²	54	69.5 Å²	69.5	21%	0.205	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	140.2	174.7	-72.6	102	0	0	0	109.6	G289 I290 E315 L316 I319 P326 E327	G289-W311 CarbonylContact C-O 3.48Å; G289-W311 WeakPolarHBondContact CA-O 3.43Å; I290-W311 PolarHBondContact N-O 3.21Å; I290-W311 PolarHBondContact O-N 3.12Å; W311-E315 HydrophobicContact CE3-CB 3.72Å; W311-E315 HydrophobicContact CE3-CG 4.36Å; W311-E315 HydrophobicContact CZ3-CB 4.12Å; W311-L316 HydrophobicContact CB-CD1 3.75Å; W311-L316 HydrophobicContact CB-CD2 3.61Å; W311-L316 HydrophobicContact CB-CG 3.49Å; W311-L316 VanDerWaalsContact CB-CG 3.49Å; W311-L316 HydrophobicContact CD2-CD2 4.08Å; W311-L316 HydrophobicContact CG-CD2 3.6Å; W311-L316 HydrophobicContact CG-CG 4.07Å; W311-I319 HydrophobicContact CE3-CD1 4.08Å; W311-I319 HydrophobicContact CH2-CD1 3.69Å; W311-I319 HydrophobicContact CZ2-CD1 4.22Å; W311-I319 HydrophobicContact CZ3-CD1 3.61Å; W311-P326 HydrophobicContact CZ2-CB 4.43Å; W311-E327 PolarHBondContact NE1-O 3.46Å
312	T	98.6	Very high	92.1	Very high	23 Å²	23	63.6 Å²	63.6	14%	0.141	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	155	168.5	68.4	0	0	0	0	110.2	Q287 P288 Y310 D314 E315 L316	Q287-T312 HydrophobicContact CB-CG2 3.71Å; Q287-T312 HydrophobicContact CG-CG2 4.43Å; P288-T312 CarbonylContact O-C 3.58Å; P288-T312 VanDerWaalsContact O-CA 3.29Å; P288-T312 WeakPolarHBondContact O-CA 3.25Å; Y310-T312 HydrophobicContact CE1-CG2 4.48Å; T312-D314 PolarHBondContact O-N 2.76Å; T312-E315 WeakPolarHBondContact CB-OE2 3.41Å; T312-E315 WeakPolarHBondContact CG2-OE2 3.23Å; T312-E315 PolarHBondContact N-OE2 2.77Å; T312-E315 PolarHBondContact O-N 3.49Å; T312-E315 WeakPolarHBondContact OG1-CB 3.44Å; T312-E315 WeakPolarHBondContact OG1-CG 3.31Å; T312-E315 PolarHBondContact OG1-N 3.04Å; T312-E315 VanDerWaalsContact OG1-N 3.16Å; T312-E315 PolarHBondContact OG1-OE2 3.25Å; T312-L316 WeakPolarHBondContact O-CG 3.26Å; T312-L316 PolarHBondContact O-N 2.7Å; T312-L316 VanDerWaalsContact O-N 3.13Å
313	L	98.8	Very high	94.4	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-61.6	-37.7	176.7	-57.9	-176.7	0	0	0	111.1	L63 R66 A67 I70 V279 P288 I290 L316 E317	L63-L313 HydrophobicContact CB-CD1 4.49Å; L63-L313 HydrophobicContact CD2-CD1 4.1Å; R66-L313 HydrophobicContact CB-CD1 4.12Å; A67-L313 HydrophobicContact CB-CD2 3.96Å; I70-L313 HydrophobicContact CD1-CB 3.85Å; I70-L313 HydrophobicContact CD1-CD2 3.71Å; I70-L313 HydrophobicContact CD1-CG 4.31Å; V279-L313 HydrophobicContact CG2-CD2 4.45Å; P288-L313 HydrophobicContact CB-CD1 4.01Å; P288-L313 HydrophobicContact CB-CG 4.26Å; P288-L313 PolarHBondContact O-N 3.42Å; I290-L313 HydrophobicContact CG2-CD2 4.06Å; L313-L316 PolarHBondContact O-N 3.1Å; L313-E317 WeakPolarHBondContact O-CB 3.32Å; L313-E317 WeakPolarHBondContact O-CG 3.39Å; L313-E317 PolarHBondContact O-N 2.92Å
314	D	98.7	Very high	96.3	Very high	95 Å²	95	59.8 Å²	59.8	51%	0.508	32%	0.316	S	S	.	.	H	α-helix	trans	-63.4	-47.1	179.1	-68.9	5.5	0	0	0	111.3	R66 T312 L316 E317 E318	R66-D314 IonicContact CZ-OD1 2.83Å; R66-D314 IonicContact NH1-OD1 3.67Å; R66-D314 PolarHBondContact NH1-OD1 3.2Å; R66-D314 IonicContact NH2-OD1 2.97Å; R66-D314 PolarHBondContact NH2-OD1 3.47Å; T312-D314 PolarHBondContact O-N 2.76Å; D314-L316 PolarHBondContact O-N 2.77Å; D314-E317 PolarHBondContact O-N 2.92Å; D314-E318 PolarHBondContact O-N 2.6Å
315	E	98.6	Very high	97.5	Very high	82 Å²	82	58.8 Å²	58.8	38%	0.383	31%	0.308	S	S	.	.	H	α-helix	trans	-62	-44	176.9	-72.9	162.8	146.4	0	0	111.9	W311 T312 E318 I319	W311-E315 HydrophobicContact CE3-CB 3.72Å; W311-E315 HydrophobicContact CE3-CG 4.36Å; W311-E315 HydrophobicContact CZ3-CB 4.12Å; T312-E315 WeakPolarHBondContact CB-OE2 3.41Å; T312-E315 WeakPolarHBondContact CG2-OE2 3.23Å; T312-E315 PolarHBondContact N-OE2 2.77Å; T312-E315 PolarHBondContact O-N 3.49Å; T312-E315 WeakPolarHBondContact OG1-CB 3.44Å; T312-E315 WeakPolarHBondContact OG1-CG 3.31Å; T312-E315 PolarHBondContact OG1-N 3.04Å; T312-E315 VanDerWaalsContact OG1-N 3.16Å; T312-E315 PolarHBondContact OG1-OE2 3.25Å; E315-E318 PolarHBondContact O-N 3.35Å; E315-I319 VanDerWaalsContact O-CG1 3.27Å; E315-I319 WeakPolarHBondContact O-CG1 3.4Å; E315-I319 PolarHBondContact O-N 2.85Å
316	L	98.8	Very high	98.1	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-64.4	-42.3	178.7	-70.8	176.6	0	0	0	111.8	I70 I290 L292 W311 T312 L313 D314 I319 L320 P326	I70-L316 HydrophobicContact CD1-CB 4.16Å; I70-L316 HydrophobicContact CG1-CB 4.35Å; I70-L316 HydrophobicContact CG2-CB 3.78Å; I70-L316 HydrophobicContact CG2-CD1 3.58Å; I70-L316 HydrophobicContact CG2-CG 4.24Å; I290-L316 HydrophobicContact CD1-CD1 3.58Å; I290-L316 HydrophobicContact CG1-CD1 3.48Å; I290-L316 VanDerWaalsContact CG1-CD1 3.48Å; L292-L316 HydrophobicContact CD1-CD2 4.39Å; W311-L316 HydrophobicContact CB-CD1 3.75Å; W311-L316 HydrophobicContact CB-CD2 3.61Å; W311-L316 HydrophobicContact CB-CG 3.49Å; W311-L316 VanDerWaalsContact CB-CG 3.49Å; W311-L316 HydrophobicContact CD2-CD2 4.08Å; W311-L316 HydrophobicContact CG-CD2 3.6Å; W311-L316 HydrophobicContact CG-CG 4.07Å; T312-L316 WeakPolarHBondContact O-CG 3.26Å; T312-L316 PolarHBondContact O-N 2.7Å; T312-L316 VanDerWaalsContact O-N 3.13Å; L313-L316 PolarHBondContact O-N 3.1Å; D314-L316 PolarHBondContact O-N 2.77Å; L316-I319 PolarHBondContact O-N 2.82Å; L316-L320 VanDerWaalsContact O-CB 3.3Å; L316-L320 WeakPolarHBondContact O-CB 3.46Å; L316-L320 WeakPolarHBondContact O-CD1 3.42Å; L316-L320 WeakPolarHBondContact O-CG 3.41Å; L316-L320 PolarHBondContact O-N 3.34Å; L316-P326 HydrophobicContact CD2-CB 3.6Å; L316-P326 HydrophobicContact CD2-CG 3.76Å
317	E	98.8	Very high	98.1	Very high	47 Å²	47	64.1 Å²	64.1	22%	0.22	33%	0.333	C	S	.	.	H	α-helix	trans	-62	-43.8	175.6	-78.2	172.7	-179	0	0	111.3	R66 I70 L313 D314 L320 N321	R66-E317 IonicContact CZ-OE1 3.44Å; R66-E317 IonicContact CZ-OE2 4Å; R66-E317 IonicContact NE-OE1 2.69Å; R66-E317 PolarHBondContact NE-OE1 3.44Å; R66-E317 IonicContact NE-OE2 2.83Å; R66-E317 IonicContact NH2-OE1 3.4Å; R66-E317 PolarHBondContact NH2-OE1 2.94Å; R66-E317 IonicContact NH2-OE2 3.84Å; R66-E317 PolarHBondContact NH2-OE2 3.41Å; I70-E317 HydrophobicContact CD1-CG 3.86Å; I70-E317 HydrophobicContact CG1-CG 3.82Å; L313-E317 WeakPolarHBondContact O-CB 3.32Å; L313-E317 WeakPolarHBondContact O-CG 3.39Å; L313-E317 PolarHBondContact O-N 2.92Å; D314-E317 PolarHBondContact O-N 2.92Å; E317-L320 PolarHBondContact O-N 3.4Å; E317-N321 WeakPolarHBondContact O-CB 3.42Å; E317-N321 PolarHBondContact O-N 2.81Å; E317-N321 PolarHBondContact O-ND2 3.47Å; E317-N321 VanDerWaalsContact O-ND2 3.08Å; E317-N321 PolarHBondContact O-OD1 2.96Å
318	E	98.7	Very high	97.9	Very high	146 Å²	146	63.7 Å²	63.7	68%	0.682	33%	0.334	S	S	*	.	H	α-helix	trans	-59	-50.2	175.8	-174.1	178	176	0	0	111.6	D314 E315 L320 N321 S322	D314-E318 PolarHBondContact O-N 2.6Å; E315-E318 PolarHBondContact O-N 3.35Å; E318-L320 PolarHBondContact O-N 2.71Å; E318-N321 PolarHBondContact O-N 2.82Å; E318-S322 PolarHBondContact O-N 3.48Å
319	I	98.7	Very high	97.9	Very high	34 Å²	34	64.7 Å²	64.7	17%	0.174	34%	0.34	C	S	.	.	H	α-helix	trans	-57.9	-51	178.5	-69.4	166.1	0	0	0	110.6	W311 E315 L316 N321 S322 K324 P326	W311-I319 HydrophobicContact CE3-CD1 4.08Å; W311-I319 HydrophobicContact CH2-CD1 3.69Å; W311-I319 HydrophobicContact CZ2-CD1 4.22Å; W311-I319 HydrophobicContact CZ3-CD1 3.61Å; E315-I319 VanDerWaalsContact O-CG1 3.27Å; E315-I319 WeakPolarHBondContact O-CG1 3.4Å; E315-I319 PolarHBondContact O-N 2.85Å; L316-I319 PolarHBondContact O-N 2.82Å; I319-N321 VanDerWaalsContact C-N 3.33Å; I319-N321 PolarHBondContact O-N 3.25Å; I319-S322 WeakPolarHBondContact O-CB 3.47Å; I319-S322 PolarHBondContact O-N 3.05Å; I319-S322 VanDerWaalsContact O-N 3.17Å; I319-S322 PolarHBondContact O-OG 3.23Å; I319-K324 HydrophobicContact CG2-CB 4.01Å; I319-K324 PolarHBondContact O-N 3.28Å; I319-P326 HydrophobicContact CD1-CB 4.35Å
320	L	98.6	Very high	97.9	Very high	13 Å²	13	66.2 Å²	66.2	7%	0.068	35%	0.347	C	S	.	.	H	α-helix	trans	-68.8	-31.7	-177.4	-67.5	167.9	0	0	0	112.2	I70 R73 L74 L316 E317 E318 S322 G323	I70-L320 HydrophobicContact CB-CD1 4.41Å; I70-L320 HydrophobicContact CG1-CD1 4.48Å; I70-L320 HydrophobicContact CG2-CD1 3.98Å; R73-L320 HydrophobicContact CB-CD1 3.94Å; R73-L320 HydrophobicContact CB-CD2 4.26Å; R73-L320 VanDerWaalsContact NH2-CB 3.29Å; R73-L320 PolarHBondContact NH2-O 3.34Å; R73-L320 VanDerWaalsContact NH2-O 3.1Å; L74-L320 HydrophobicContact CD2-CD2 4.49Å; L316-L320 VanDerWaalsContact O-CB 3.3Å; L316-L320 WeakPolarHBondContact O-CB 3.46Å; L316-L320 WeakPolarHBondContact O-CD1 3.42Å; L316-L320 WeakPolarHBondContact O-CG 3.41Å; L316-L320 PolarHBondContact O-N 3.34Å; E317-L320 PolarHBondContact O-N 3.4Å; E318-L320 PolarHBondContact O-N 2.71Å; L320-S322 VanDerWaalsContact C-N 3.28Å; L320-G323 PolarHBondContact O-N 2.91Å
321	N	98.4	Very high	97.9	Very high	113 Å²	113	67.9 Å²	67.9	60%	0.604	36%	0.358	S	S	*	.	H	α-helix	trans	-70.5	-26.3	175.3	-69.7	-16.4	0	0	0	111.7	R73 E317 E318 I319 G323	R73-N321 PolarHBondContact NH1-OD1 2.84Å; R73-N321 PolarHBondContact NH2-OD1 3.47Å; E317-N321 WeakPolarHBondContact O-CB 3.42Å; E317-N321 PolarHBondContact O-N 2.81Å; E317-N321 PolarHBondContact O-ND2 3.47Å; E317-N321 VanDerWaalsContact O-ND2 3.08Å; E317-N321 PolarHBondContact O-OD1 2.96Å; E318-N321 PolarHBondContact O-N 2.82Å; I319-N321 VanDerWaalsContact C-N 3.33Å; I319-N321 PolarHBondContact O-N 3.25Å; N321-G323 PolarHBondContact O-N 2.93Å
322	S	98.2	Very high	97.8	Very high	74 Å²	74	68.7 Å²	68.7	52%	0.517	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-2.7	172.5	81.6	0	0	0	0	114.1	E318 I319 L320 K324	E318-S322 PolarHBondContact O-N 3.48Å; I319-S322 WeakPolarHBondContact O-CB 3.47Å; I319-S322 PolarHBondContact O-N 3.05Å; I319-S322 VanDerWaalsContact O-N 3.17Å; I319-S322 PolarHBondContact O-OG 3.23Å; L320-S322 VanDerWaalsContact C-N 3.28Å; S322-K324 VanDerWaalsContact C-N 3.3Å; S322-K324 WeakPolarHBondContact OG-CG 3.42Å
323	G	97.6	Very high	97.8	Very high	70 Å²	70	71.6 Å²	71.6	72%	0.722	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.9	11.1	-176.4	0	0	0	0	0	114.2	L320 N321	L320-G323 PolarHBondContact O-N 2.91Å; N321-G323 PolarHBondContact O-N 2.93Å
324	K	98.2	Very high	97.7	Very high	142 Å²	142	76.3 Å²	76.3	62%	0.617	41%	0.407	S	S	*	.			trans	-95.9	174.8	175.5	-64.5	180	-177.5	178.3	0	111	I319 S322	I319-K324 HydrophobicContact CG2-CB 4.01Å; I319-K324 PolarHBondContact O-N 3.28Å; S322-K324 VanDerWaalsContact C-N 3.3Å; S322-K324 WeakPolarHBondContact OG-CG 3.42Å
325	Q	98.1	Very high	97.7	Very high	73 Å²	73	75 Å²	75	34%	0.341	40%	0.4	S	S	.	.			trans	-117.3	146.4	170.5	-66.9	-63.7	-47.9	0	0	109	R73 C75	R73-Q325 PolarHBondContact O-NE2 2.61Å; C75-Q325 HydrophobicContact CB-CG 4.26Å; C75-Q325 WeakPolarHBondContact O-CG 3.18Å; C75-Q325 PolarHBondContact O-OE1 2.99Å
326	P	97.5	Very high	97.6	Very high	20 Å²	20	74.5 Å²	74.5	13%	0.13	40%	0.401	C	S	.	.			trans	-66.2	144.3	174.8	30	-36.1	0	0	0	110.4	L74 L292 W311 L316 I319	L74-P326 HydrophobicContact CD2-CG 3.65Å; L292-P326 HydrophobicContact CD1-CB 3.89Å; L292-P326 HydrophobicContact CD1-CG 3.57Å; W311-P326 HydrophobicContact CZ2-CB 4.43Å; L316-P326 HydrophobicContact CD2-CB 3.6Å; L316-P326 HydrophobicContact CD2-CG 3.76Å; I319-P326 HydrophobicContact CD1-CB 4.35Å
327	E	94.9	Very high	97.5	Very high	164 Å²	164	80.7 Å²	80.7	77%	0.766	43%	0.434	S	S	*	.			trans	-89.5	157	172.2	-64.8	-179.5	177.6	0	0	110.2	V309 W311	V309-E327 WeakPolarHBondContact CG1-O 3.49Å; W311-E327 PolarHBondContact NE1-O 3.46Å
328	I	92.4	Very high	97.4	Very high	72 Å²	72	83.7 Å²	83.7	37%	0.369	45%	0.454	S	S	.	.			trans	-117.4	0	172.7	-59.9	171.7	0	0	0	108.5	C32 L292 Q294 K307 V309	C32-I328 HydrophobicContact CB-CD1 4.17Å; L292-I328 HydrophobicContact CB-CD1 3.78Å; L292-I328 HydrophobicContact CB-CG1 3.79Å; L292-I328 HydrophobicContact CD1-CG1 4.4Å; Q294-I328 HydrophobicContact CB-CB 4.32Å; Q294-I328 HydrophobicContact CB-CD1 3.81Å; Q294-I328 HydrophobicContact CB-CG2 3.93Å; K307-I328 HydrophobicContact CB-CG2 3.91Å; V309-I328 HydrophobicContact CG1-CB 4.28Å; V309-I328 HydrophobicContact CG1-CG1 4.11Å; V309-I328 HydrophobicContact CG1-CG2 4.28Å

Retrieved 328 of 328 residues in 114.2 ms (Link to these results)

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