============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 18 rings ring int. center anis. iso. TYR 10 0.840 46.434 28.655 7.962 -99.200 -91.000 HIS 13 0.900 51.623 28.883 18.943 -99.200 -91.000 TYR 26 0.840 45.472 33.664 3.264 -99.200 -91.000 PHE 30 1.000 37.803 35.353 -2.445 -99.200 -91.000 HIS 31 0.900 37.716 39.051 -9.587 -99.200 -91.000 HIS 34 0.900 28.302 38.353 -2.052 -99.200 -91.000 PHE 56 1.000 43.740 44.086 -5.214 -99.200 -91.000 TRP 60 1.040 44.220 42.464 -11.757 -99.200 -91.000 TRP6 60 1.020 44.751 44.478 -10.614 -99.200 -91.000 PHE 62 1.000 38.969 40.722 -4.676 -99.200 -91.000 TYR 63 0.840 45.720 35.439 -2.415 -99.200 -91.000 HIS 67 0.900 42.619 36.480 13.028 -99.200 -91.000 PHE 70 1.000 41.938 26.036 17.758 -99.200 -91.000 TYR 78 0.840 37.470 24.051 16.812 -99.200 -91.000 HIS 84 0.900 33.503 32.923 -5.376 -99.200 -91.000 TYR 94 0.840 34.281 18.924 8.980 -99.200 -91.000 TRP 95 1.040 42.789 22.330 12.489 -99.200 -91.000 TRP6 95 1.020 42.730 21.782 14.789 -99.200 -91.000