============================================================================= 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. TRP 9 1.040 10.022 15.933 5.343 -99.200 -91.000 TRP6 9 1.020 9.178 15.252 3.264 -99.200 -91.000 TYR 10 0.840 5.537 12.436 10.851 -99.200 -91.000 PHE 17 1.000 14.632 14.706 7.659 -99.200 -91.000 TYR 31 0.840 16.233 10.656 12.069 -99.200 -91.000 TYR 42 0.840 20.061 11.162 19.236 -99.200 -91.000 TYR 48 0.840 18.091 22.570 -0.620 -99.200 -91.000 TRP 63 1.040 19.335 13.457 7.184 -99.200 -91.000 TRP6 63 1.020 17.765 13.002 5.480 -99.200 -91.000 TRP 67 1.040 22.888 7.602 15.063 -99.200 -91.000 TRP6 67 1.020 20.659 8.370 14.953 -99.200 -91.000 TYR 71 0.840 19.048 14.618 28.115 -99.200 -91.000 HIS 75 0.900 30.690 6.107 22.166 -99.200 -91.000 TRP 80 1.040 18.695 8.569 6.637 -99.200 -91.000 TRP6 80 1.020 19.522 9.238 8.769 -99.200 -91.000 TYR 84 0.840 10.876 17.549 -2.236 -99.200 -91.000 TRP 96 1.040 19.260 3.795 6.369 -99.200 -91.000 TRP6 96 1.020 20.350 2.132 7.615 -99.200 -91.000 TRP 108 1.040 35.242 -7.817 10.266 -99.200 -91.000 TRP6 108 1.020 33.343 -8.994 9.508 -99.200 -91.000 HIS 115 0.900 15.265 -0.216 1.875 -99.200 -91.000 PHE 118 1.000 13.236 9.586 6.416 -99.200 -91.000