============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 12 rings ring int. center anis. iso. PHE 14 1.000 10.492 -22.006 12.456 -99.200 -91.000 PHE 15 1.000 7.247 -18.351 12.654 -99.200 -91.000 TYR 31 0.840 3.465 -22.111 33.820 -99.200 -91.000 HIS 99 0.900 16.231 -13.757 20.532 -99.200 -91.000 PHE 114 1.000 24.370 -29.063 -0.330 -99.200 -91.000 PHE 144 1.000 23.872 -17.964 0.068 -99.200 -91.000 TYR 151 0.840 33.689 -21.550 -1.776 -99.200 -91.000 PHE 164 1.000 11.683 -15.503 6.617 -99.200 -91.000 PHE 187 1.000 20.025 -19.560 2.059 -99.200 -91.000 PHE 214 1.000 18.146 -21.414 8.019 -99.200 -91.000 TYR 251 0.840 11.779 -13.043 34.983 -99.200 -91.000 PHE 260 1.000 21.490 -16.475 21.822 -99.200 -91.000