============================================================================= 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 24 1.000 71.061 -29.291 15.240 -99.200 -91.000 PHE 25 1.000 71.181 -26.443 19.551 -99.200 -91.000 PHE 27 1.000 79.335 -33.343 14.952 -99.200 -91.000 TYR 34 0.840 83.948 -24.646 5.674 -99.200 -91.000 TYR 39 0.840 87.262 -19.376 14.986 -99.200 -91.000 PHE 44 1.000 86.104 -24.422 10.642 -99.200 -91.000 TYR 50 0.840 74.369 -35.715 13.271 -99.200 -91.000 TYR 65 0.840 82.862 -19.829 23.716 -99.200 -91.000 TRP 76 1.040 71.647 -24.322 31.893 -99.200 -91.000 TRP6 76 1.020 72.871 -22.676 30.714 -99.200 -91.000 TYR 78 0.840 67.968 -34.697 33.481 -99.200 -91.000 TRP 101 1.040 73.214 -18.549 10.846 -99.200 -91.000 TRP6 101 1.020 72.707 -20.098 9.138 -99.200 -91.000 PHE 103 1.000 70.315 -23.341 15.067 -99.200 -91.000 PHE 138 1.000 68.533 -21.471 -2.294 -99.200 -91.000 PHE 148 1.000 81.700 -17.766 17.861 -99.200 -91.000 TYR 153 0.840 67.665 -15.088 23.685 -99.200 -91.000 TRP 163 1.040 78.127 -20.414 31.164 -99.200 -91.000 TRP6 163 1.020 77.040 -20.674 29.081 -99.200 -91.000 PHE 170 1.000 66.793 -6.169 20.687 -99.200 -91.000 PHE 182 1.000 67.126 -32.003 15.961 -99.200 -91.000 HIS 187 0.900 64.981 -31.861 25.042 -99.200 -91.000 TYR 195 0.840 68.182 -13.227 4.195 -99.200 -91.000