============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 0 rings ============================================================================= Atom RingCur El P_anis Const RC pred Obs ============================================================================= 1y7lP1 ASN 264 HA 0.00 0.00 0.09 -0.75 4.76 4.10 1y7lP1 ASN 264 HB2 0.00 0.00 0.02 -0.04 2.88 2.86 1y7lP1 ASN 264 HB3 0.00 0.02 0.09 -0.04 2.79 2.85 1y7lP1 ASN 264 HD21 0.00 0.01 0.01 -0.04 7.03 7.01 1y7lP1 ASN 264 HD22 0.00 0.00 0.00 -0.04 7.74 7.70 1y7lP1 LEU 265 H 0.00 0.21 0.12 -0.55 8.37 8.16 1y7lP1 LEU 265 HA 0.00 0.11 0.68 -0.75 4.35 4.39 1y7lP1 LEU 265 HB2 0.00 0.01 0.05 -0.04 1.64 1.66 1y7lP1 LEU 265 HB3 0.00 -0.02 0.11 -0.04 1.64 1.68 1y7lP1 LEU 265 HG 0.00 0.02 -0.16 -0.04 1.64 1.46 1y7lP1 LEU 265 HD13 0.00 -0.00 -0.01 -0.04 0.93 0.88 1y7lP1 LEU 265 HD23 0.00 0.01 -0.02 -0.04 0.89 0.84 1y7lP1 ASN 266 H 0.00 0.09 -0.09 -0.55 8.53 7.99 1y7lP1 ASN 266 HA 0.00 0.12 0.56 -0.75 4.76 4.68 1y7lP1 ASN 266 HB2 0.00 -0.02 0.12 -0.04 2.88 2.94 1y7lP1 ASN 266 HB3 0.00 0.04 0.19 -0.04 2.79 2.98 1y7lP1 ASN 266 HD21 0.00 -0.00 0.02 -0.04 7.03 7.00 1y7lP1 ASN 266 HD22 0.00 0.00 0.05 -0.04 7.74 7.76 1y7lP1 ILE 267 H 0.00 0.55 -0.73 -0.55 8.25 7.52 1y7lP1 ILE 267 HA 0.00 0.22 0.57 -0.75 4.18 4.22 1y7lP1 ILE 267 HB 0.00 0.06 -0.02 -0.04 1.89 1.89 1y7lP1 ILE 267 HG12 0.00 -0.01 -0.14 -0.04 1.49 1.30 1y7lP1 ILE 267 HG13 0.00 -0.08 -0.53 -0.04 1.21 0.56 1y7lP1 ILE 267 HG23 0.00 -0.00 0.00 -0.04 0.93 0.89 1y7lP1 ILE 267 HD13 0.00 0.01 -0.02 -0.04 0.88 0.83