============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 8 rings ring int. center anis. iso. TRP 6 1.040 9.167 -2.288 34.593 -99.200 -91.000 TRP6 6 1.020 11.523 -2.315 34.407 -99.200 -91.000 TRP 42 1.040 -15.505 -0.398 4.096 -99.200 -91.000 TRP6 42 1.020 -13.980 -1.125 2.415 -99.200 -91.000 PHE 53 1.000 3.978 0.162 2.057 -99.200 -91.000 TYR 59 0.840 -14.843 0.923 8.940 -99.200 -91.000 HIS 68 0.900 -8.518 9.345 30.129 -99.200 -91.000 PHE 97 1.000 13.476 10.220 28.177 -99.200 -91.000