============================================================================= 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 8 1.000 43.717 28.843 42.192 -99.200 -91.000 TYR 63 0.840 25.213 -4.757 77.685 -99.200 -91.000 TRP 76 1.040 18.628 -33.165 59.877 -99.200 -91.000 TRP6 76 1.020 18.085 -30.903 60.296 -99.200 -91.000 TYR 91 0.840 15.860 -16.147 62.758 -99.200 -91.000 PHE 95 1.000 18.477 -21.230 52.551 -99.200 -91.000 PHE 113 1.000 14.040 -29.624 58.452 -99.200 -91.000 PHE 114 1.000 14.127 -23.947 54.214 -99.200 -91.000 TYR 117 0.840 12.486 -34.334 57.504 -99.200 -91.000 PHE 121 1.000 8.879 -31.607 60.447 -99.200 -91.000 TRP 130 1.040 10.080 -14.508 57.639 -99.200 -91.000 TRP6 130 1.020 11.093 -13.914 55.584 -99.200 -91.000