============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 22 rings ring int. center anis. iso. TYR 7 0.840 -16.302 39.683 52.328 -99.200 -91.000 TYR 11 0.840 -23.199 40.163 51.251 -99.200 -91.000 PHE 18 1.000 -22.263 31.214 45.844 -99.200 -91.000 PHE 27 1.000 -19.295 21.332 40.031 -99.200 -91.000 HIS 44 0.900 -4.263 40.362 56.741 -99.200 -91.000 TYR 46 0.840 -9.178 36.688 48.169 -99.200 -91.000 PHE 53 1.000 -14.054 36.951 47.216 -99.200 -91.000 TRP 54 1.040 -14.768 42.868 41.904 -99.200 -91.000 TRP6 54 1.020 -15.167 45.068 42.679 -99.200 -91.000 HIS 60 0.900 -35.419 38.250 48.076 -99.200 -91.000 PHE 81 1.000 -16.358 28.114 43.481 -99.200 -91.000 TYR 86 0.840 -29.837 33.528 40.700 -99.200 -91.000 TYR 111 0.840 0.765 33.073 35.776 -99.200 -91.000 PHE 118 1.000 -15.016 23.160 40.559 -99.200 -91.000 TYR 123 0.840 -16.187 22.447 27.305 -99.200 -91.000 PHE 124 1.000 -16.495 32.080 32.378 -99.200 -91.000 TYR 125 0.840 -11.925 29.498 34.634 -99.200 -91.000 PHE 130 1.000 -8.334 33.342 32.505 -99.200 -91.000 PHE 142 1.000 -1.735 29.916 41.016 -99.200 -91.000 PHE 151 1.000 -2.441 23.915 38.012 -99.200 -91.000 TYR 152 0.840 -7.542 26.600 31.949 -99.200 -91.000 TYR 153 0.840 -0.483 34.906 31.746 -99.200 -91.000