============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 29 rings ring int. center anis. iso. TYR 3 0.840 34.652-221.140 30.348 -99.200 -91.000 HIS 6 0.900 34.256-221.440 35.526 -99.200 -91.000 PHE 10 1.000 18.754-216.189 33.884 -99.200 -91.000 TYR 17 0.840 24.516-224.497 38.584 -99.200 -91.000 TYR 21 0.840 28.547-223.373 42.811 -99.200 -91.000 PHE 23 1.000 21.700-217.541 49.043 -99.200 -91.000 TYR 62 0.840 32.440-212.677 61.721 -99.200 -91.000 PHE 64 1.000 30.744-205.294 60.576 -99.200 -91.000 PHE 95 1.000 17.358-192.047 53.102 -99.200 -91.000 TYR 97 0.840 24.882-183.439 51.710 -99.200 -91.000 TYR 99 0.840 17.020-188.833 49.390 -99.200 -91.000 TYR 101 0.840 13.770-189.546 55.651 -99.200 -91.000 TYR 119 0.840 27.436-206.317 43.942 -99.200 -91.000 TYR 124 0.840 31.965-204.752 36.662 -99.200 -91.000 PHE 134 1.000 21.416-204.131 56.480 -99.200 -91.000 TYR 146 0.840 12.439-204.586 57.091 -99.200 -91.000 TYR 153 0.840 13.716-213.011 49.821 -99.200 -91.000 TYR 154 0.840 14.037-205.619 50.865 -99.200 -91.000 TYR 157 0.840 13.401-212.606 57.658 -99.200 -91.000 HIS 176 0.900 8.015-217.075 72.023 -99.200 -91.000 PHE 177 1.000 7.996-214.981 67.809 -99.200 -91.000 HIS 183 0.900 5.328-207.648 70.767 -99.200 -91.000 TRP 188 1.040 18.080-202.544 76.892 -99.200 -91.000 TRP6 188 1.020 20.117-203.656 77.345 -99.200 -91.000 PHE 194 1.000 12.183-215.268 73.452 -99.200 -91.000 HIS 198 0.900 12.919-219.276 73.195 -99.200 -91.000 PHE 207 1.000 25.718-220.081 73.302 -99.200 -91.000 PHE 222 1.000 23.223-202.108 66.779 -99.200 -91.000 PHE 223 1.000 22.456-200.456 73.662 -99.200 -91.000