============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 13 rings ring int. center anis. iso. TRP 13 1.040 0.019 13.303 28.792 -99.200 -91.000 TRP6 13 1.020 0.538 15.224 30.071 -99.200 -91.000 HIS 27 0.900 2.327 7.615 27.457 -99.200 -91.000 PHE 31 1.000 2.201 22.638 27.445 -99.200 -91.000 TYR 38 0.840 7.251 46.668 26.790 -99.200 -91.000 TYR 52 0.840 12.407 13.118 42.046 -99.200 -91.000 TYR 70 0.840 11.121 14.807 34.208 -99.200 -91.000 TYR 72 0.840 11.531 17.885 28.080 -99.200 -91.000 PHE 89 1.000 10.453 28.869 29.207 -99.200 -91.000 HIS 106 0.900 7.485 20.270 22.112 -99.200 -91.000 TYR 111 0.840 8.058 5.019 36.499 -99.200 -91.000 PHE 122 1.000 -2.350 12.237 35.175 -99.200 -91.000 TYR 132 0.840 7.059 40.068 24.365 -99.200 -91.000