============================================================================= 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. HIS 9 0.900 35.810 17.777 60.191 -99.200 -91.000 TRP 15 1.040 23.888 18.754 64.004 -99.200 -91.000 TRP6 15 1.020 25.230 20.486 63.101 -99.200 -91.000 HIS 21 0.900 21.606 6.431 66.532 -99.200 -91.000 PHE 35 1.000 28.771 9.982 48.802 -99.200 -91.000 HIS 41 0.900 36.105 7.622 59.779 -99.200 -91.000 TRP 43 1.040 36.527 14.813 52.225 -99.200 -91.000 TRP6 43 1.020 35.066 16.579 51.659 -99.200 -91.000 TYR 48 0.840 41.873 18.979 62.069 -99.200 -91.000 TYR 58 0.840 39.839 8.893 61.765 -99.200 -91.000 TYR 62 0.840 32.514 13.224 60.412 -99.200 -91.000 PHE 63 1.000 31.963 5.694 61.462 -99.200 -91.000 HIS 70 0.900 14.404 11.939 69.333 -99.200 -91.000 TYR 100 0.840 35.031 20.917 53.908 -99.200 -91.000 TYR 129 0.840 -2.520 7.889 50.590 -99.200 -91.000