============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 16 rings ring int. center anis. iso. HIS 13 0.900 85.278 40.070 48.222 -99.200 -91.000 TRP 16 1.040 76.735 47.053 44.900 -99.200 -91.000 TRP6 16 1.020 74.518 47.876 44.811 -99.200 -91.000 HIS 36 0.900 88.884 19.864 48.747 -99.200 -91.000 TRP 52 1.040 79.797 46.271 34.458 -99.200 -91.000 TRP6 52 1.020 78.517 45.382 32.661 -99.200 -91.000 TYR 67 0.840 95.922 34.022 40.556 -99.200 -91.000 HIS 83 0.900 71.644 47.057 37.593 -99.200 -91.000 PHE 84 1.000 67.865 39.501 39.625 -99.200 -91.000 TYR 86 0.840 67.194 43.795 30.494 -99.200 -91.000 HIS 93 0.900 78.422 36.207 26.949 -99.200 -91.000 TYR 121 0.840 67.995 28.116 53.560 -99.200 -91.000 HIS 129 0.900 75.790 23.255 51.540 -99.200 -91.000 HIS 131 0.900 74.298 27.067 48.018 -99.200 -91.000 TRP 135 1.040 79.983 28.245 44.735 -99.200 -91.000 TRP6 135 1.020 79.240 30.315 45.591 -99.200 -91.000