============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 12 rings ring int. center anis. iso. TRP 22 1.040 39.256 88.391 36.889 -99.200 -91.000 TRP6 22 1.020 39.200 86.101 37.455 -99.200 -91.000 PHE 24 1.000 42.090 85.942 31.555 -99.200 -91.000 TRP 32 1.040 32.192 76.870 31.266 -99.200 -91.000 TRP6 32 1.020 30.503 78.090 30.216 -99.200 -91.000 HIS 33 0.900 33.751 83.518 35.408 -99.200 -91.000 HIS 35 0.900 31.025 88.094 35.825 -99.200 -91.000 TYR 38 0.840 31.111 91.783 34.485 -99.200 -91.000 TYR 66 0.840 34.212 94.959 28.406 -99.200 -91.000 HIS 74 0.900 32.106 85.495 31.110 -99.200 -91.000 PHE 84 1.000 43.526 90.778 27.226 -99.200 -91.000 PHE 86 1.000 39.269 90.648 32.352 -99.200 -91.000