============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 31 rings ring int. center anis. iso. TYR 4 0.840 33.440-224.885 39.307 -99.200 -91.000 PHE 11 1.000 31.759-216.790 45.677 -99.200 -91.000 PHE 18 1.000 40.028-224.707 44.842 -99.200 -91.000 TYR 22 0.840 45.296-222.833 43.098 -99.200 -91.000 PHE 44 1.000 55.557-203.775 63.394 -99.200 -91.000 HIS 69 0.900 50.909-193.217 62.800 -99.200 -91.000 TYR 74 0.840 56.197-206.127 52.436 -99.200 -91.000 HIS 83 0.900 50.149-202.139 43.844 -99.200 -91.000 PHE 95 1.000 42.256-190.535 59.035 -99.200 -91.000 TYR 99 0.840 39.045-187.125 58.261 -99.200 -91.000 PHE 108 1.000 48.115-198.456 57.058 -99.200 -91.000 TYR 115 0.840 44.863-201.086 46.705 -99.200 -91.000 HIS 119 0.900 43.859-205.276 43.960 -99.200 -91.000 TYR 122 0.840 36.218-205.532 40.476 -99.200 -91.000 PHE 128 1.000 47.584-206.469 46.555 -99.200 -91.000 PHE 134 1.000 48.438-203.583 58.840 -99.200 -91.000 HIS 143 0.900 45.134-199.777 68.352 -99.200 -91.000 TYR 145 0.840 44.588-203.958 63.418 -99.200 -91.000 TYR 153 0.840 41.117-205.534 58.988 -99.200 -91.000 TRP 154 1.040 40.776-212.085 61.816 -99.200 -91.000 TRP6 154 1.020 38.487-211.689 62.163 -99.200 -91.000 TYR 156 0.840 46.793-212.173 64.245 -99.200 -91.000 HIS 178 0.900 55.886-219.293 80.091 -99.200 -91.000 TYR 196 0.840 69.556-215.602 65.298 -99.200 -91.000 HIS 199 0.900 67.720-219.415 58.951 -99.200 -91.000 PHE 207 1.000 69.268-215.865 60.509 -99.200 -91.000 TRP 213 1.040 62.741-199.694 68.567 -99.200 -91.000 TRP6 213 1.020 63.211-199.508 70.880 -99.200 -91.000 HIS 223 0.900 58.808-198.193 61.860 -99.200 -91.000 PHE 225 1.000 63.499-199.411 59.496 -99.200 -91.000 PHE 237 1.000 67.247-212.834 75.378 -99.200 -91.000