============================================================================= 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. TRP 6 1.040 -21.769 26.983 39.427 -99.200 -91.000 TRP6 6 1.020 -20.487 27.218 41.387 -99.200 -91.000 TRP 42 1.040 -13.164 5.555 7.750 -99.200 -91.000 TRP6 42 1.020 -11.135 4.628 8.533 -99.200 -91.000 PHE 53 1.000 -0.862 5.936 21.137 -99.200 -91.000 TYR 59 0.840 -16.077 9.042 9.494 -99.200 -91.000 HIS 69 0.900 -26.667 27.823 17.782 -99.200 -91.000 PHE 99 1.000 -11.158 34.641 32.889 -99.200 -91.000 TRP 105 1.040 -12.428 32.335 16.035 -99.200 -91.000 TRP6 105 1.020 -13.264 31.347 14.061 -99.200 -91.000 TRP 141 1.040 1.645 14.200 47.672 -99.200 -91.000 TRP6 141 1.020 1.446 12.013 46.798 -99.200 -91.000 PHE 152 1.000 -9.169 5.720 34.247 -99.200 -91.000 TYR 158 0.840 0.248 18.454 46.002 -99.200 -91.000 HIS 168 0.900 -10.674 37.227 37.915 -99.200 -91.000 PHE 198 1.000 -24.459 26.956 22.585 -99.200 -91.000