============================================================================= 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. PHE 38 1.000 2.767 11.987 -2.721 -99.200 -91.000 TYR 48 0.840 -0.721 5.509 -1.690 -99.200 -91.000 TYR 65 0.840 10.491 21.510 2.195 -99.200 -91.000 HIS 70 0.900 -0.419 8.621 8.372 -99.200 -91.000 HIS 71 0.900 6.164 4.977 14.766 -99.200 -91.000 PHE 73 1.000 3.270 2.022 15.943 -99.200 -91.000 PHE 83 1.000 8.646 11.185 7.597 -99.200 -91.000 TYR 96 0.840 21.813 12.587 1.585 -99.200 -91.000 TYR 104 0.840 17.907 21.961 -2.221 -99.200 -91.000 TYR 106 0.840 17.696 20.612 4.726 -99.200 -91.000 PHE 112 1.000 12.283 18.419 19.438 -99.200 -91.000 TYR 155 0.840 24.824 16.764 -3.551 -99.200 -91.000 PHE 157 1.000 18.331 12.961 -8.910 -99.200 -91.000 PHE 168 1.000 17.058 11.292 -3.030 -99.200 -91.000 HIS 170 0.900 15.483 0.220 -1.831 -99.200 -91.000 TYR 172 0.840 8.992 6.836 -4.001 -99.200 -91.000