============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 28 rings ring int. center anis. iso. TRP 6 1.040 -19.248 2.243 15.180 -99.200 -91.000 TRP6 6 1.020 -18.793 3.857 13.510 -99.200 -91.000 PHE 9 1.000 -23.820 14.989 21.158 -99.200 -91.000 TYR 14 0.840 -19.417 11.883 17.102 -99.200 -91.000 TYR 16 0.840 -8.524 7.195 18.755 -99.200 -91.000 TRP 23 1.040 -8.347 14.863 6.085 -99.200 -91.000 TRP6 23 1.020 -9.605 14.899 4.102 -99.200 -91.000 HIS 51 0.900 -15.049 11.602 27.946 -99.200 -91.000 PHE 62 1.000 2.710 16.214 15.581 -99.200 -91.000 TRP 65 1.040 -5.460 12.503 9.684 -99.200 -91.000 TRP6 65 1.020 -4.484 14.605 9.189 -99.200 -91.000 TRP 75 1.040 -8.860 26.214 6.833 -99.200 -91.000 TRP6 75 1.020 -7.881 24.111 7.196 -99.200 -91.000 TRP 77 1.040 -17.608 21.507 8.645 -99.200 -91.000 TRP6 77 1.020 -16.028 20.612 10.135 -99.200 -91.000 PHE 84 1.000 -13.824 24.444 9.085 -99.200 -91.000 TYR 86 0.840 -17.682 24.804 17.400 -99.200 -91.000 TRP 89 1.040 -9.356 27.691 13.046 -99.200 -91.000 TRP6 89 1.020 -8.463 25.865 11.889 -99.200 -91.000 HIS 104 0.900 -3.679 17.442 14.028 -99.200 -91.000 TYR 105 0.840 -10.471 17.240 18.151 -99.200 -91.000 TRP 107 1.040 -0.278 20.012 22.130 -99.200 -91.000 TRP6 107 1.020 0.668 18.614 23.765 -99.200 -91.000 TRP 110 1.040 -11.647 22.080 15.629 -99.200 -91.000 TRP6 110 1.020 -13.115 23.247 14.216 -99.200 -91.000 HIS 116 0.900 -0.961 12.819 1.442 -99.200 -91.000 TYR 117 0.840 2.028 13.668 11.742 -99.200 -91.000 TYR 121 0.840 -8.960 6.277 10.754 -99.200 -91.000