============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 18 rings ring int. center anis. iso. HIS 3 0.900 21.563 14.888 19.259 -99.200 -91.000 PHE 6 1.000 10.146 10.954 9.537 -99.200 -91.000 PHE 28 1.000 16.498 10.984 8.605 -99.200 -91.000 TYR 42 0.840 15.967 9.167 -4.399 -99.200 -91.000 PHE 62 1.000 9.464 13.113 -4.791 -99.200 -91.000 PHE 63 1.000 6.566 17.292 -5.799 -99.200 -91.000 PHE 75 1.000 4.955 14.145 -1.011 -99.200 -91.000 TYR 76 0.840 3.368 19.828 -7.845 -99.200 -91.000 PHE 79 1.000 8.389 21.123 -3.044 -99.200 -91.000 PHE 92 1.000 2.770 14.525 3.510 -99.200 -91.000 TYR 94 0.840 1.005 10.802 -0.748 -99.200 -91.000 PHE 96 1.000 6.605 7.833 -0.910 -99.200 -91.000 TYR 98 0.840 5.622 5.855 -12.096 -99.200 -91.000 HIS 108 0.900 9.802 17.017 9.001 -99.200 -91.000 TYR 118 0.840 12.327 24.819 -1.047 -99.200 -91.000 TRP 119 1.040 16.841 19.192 3.908 -99.200 -91.000 TRP6 119 1.020 18.523 17.795 2.989 -99.200 -91.000 PHE 121 1.000 14.454 15.504 6.069 -99.200 -91.000