============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 23 rings ring int. center anis. iso. PHE 9 1.000 -29.968 -5.666 -16.232 -99.200 -91.000 HIS 28 0.900 -36.158 -7.502 -18.411 -99.200 -91.000 TYR 36 0.840 -27.312 -9.281 -19.106 -99.200 -91.000 TYR 48 0.840 -3.038 -5.734 -18.223 -99.200 -91.000 TRP 53 1.040 -13.128 -8.589 -20.428 -99.200 -91.000 TRP6 53 1.020 -11.532 -7.971 -22.058 -99.200 -91.000 PHE 62 1.000 -23.895 -15.760 -25.414 -99.200 -91.000 TYR 81 0.840 -13.296 -9.941 -31.487 -99.200 -91.000 PHE 90 1.000 -19.325 -13.198 -23.669 -99.200 -91.000 TYR 115 0.840 -23.656 -10.643 -22.656 -99.200 -91.000 PHE 135 1.000 -9.257 -7.864 -17.932 -99.200 -91.000 TYR 137 0.840 -5.276 -8.075 -14.330 -99.200 -91.000 HIS 143 0.900 -2.462 -20.976 -18.994 -99.200 -91.000 TRP 164 1.040 -3.651 -28.181 -6.831 -99.200 -91.000 TRP6 164 1.020 -3.525 -26.006 -5.915 -99.200 -91.000 PHE 180 1.000 -12.069 -24.023 -4.414 -99.200 -91.000 TYR 214 0.840 -26.672 -24.195 -4.434 -99.200 -91.000 PHE 216 1.000 -18.084 -26.040 -4.717 -99.200 -91.000 TYR 224 0.840 -0.522 -22.245 -7.544 -99.200 -91.000 TYR 228 0.840 -13.702 -21.236 -11.368 -99.200 -91.000 TRP 242 1.040 -4.322 -23.599 -15.978 -99.200 -91.000 TRP6 242 1.020 -3.102 -24.334 -17.872 -99.200 -91.000 TYR 260 0.840 -41.698 -9.951 -9.196 -99.200 -91.000