============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 15 rings ring int. center anis. iso. TYR 4 0.840 18.274 31.986 40.584 -99.200 -91.000 TYR 9 0.840 23.085 24.500 28.246 -99.200 -91.000 TYR 40 0.840 39.268 31.213 10.354 -99.200 -91.000 PHE 51 1.000 28.284 29.680 9.776 -99.200 -91.000 TYR 57 0.840 19.562 17.907 18.138 -99.200 -91.000 HIS 91 0.900 11.216 34.414 8.112 -99.200 -91.000 TYR 93 0.840 15.249 40.208 7.219 -99.200 -91.000 TYR 103 0.840 12.346 44.033 16.798 -99.200 -91.000 HIS 104 0.900 10.304 48.103 14.472 -99.200 -91.000 TYR 119 0.840 19.337 40.557 18.262 -99.200 -91.000 TRP 127 1.040 20.934 48.302 24.616 -99.200 -91.000 TRP6 127 1.020 20.023 46.564 25.944 -99.200 -91.000 HIS 143 0.900 32.385 45.861 24.555 -99.200 -91.000 HIS 151 0.900 15.114 40.765 29.170 -99.200 -91.000 TYR 152 0.840 20.521 32.412 30.168 -99.200 -91.000