============================================================================= 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 35.121-221.242 29.867 -99.200 -91.000 HIS 6 0.900 34.610-221.775 35.367 -99.200 -91.000 PHE 10 1.000 19.312-216.569 33.827 -99.200 -91.000 TYR 17 0.840 25.047-224.671 38.520 -99.200 -91.000 TYR 21 0.840 29.100-223.471 42.652 -99.200 -91.000 PHE 23 1.000 22.213-217.583 49.005 -99.200 -91.000 TYR 62 0.840 33.169-212.792 61.472 -99.200 -91.000 PHE 64 1.000 31.284-205.412 60.441 -99.200 -91.000 PHE 95 1.000 17.971-191.989 53.212 -99.200 -91.000 TYR 97 0.840 25.470-183.448 51.563 -99.200 -91.000 TYR 99 0.840 17.656-188.823 49.397 -99.200 -91.000 TYR 101 0.840 14.318-189.594 55.687 -99.200 -91.000 TYR 119 0.840 28.124-206.582 43.753 -99.200 -91.000 TYR 124 0.840 32.426-205.116 36.388 -99.200 -91.000 PHE 134 1.000 22.016-204.330 56.440 -99.200 -91.000 TYR 146 0.840 13.068-204.662 57.093 -99.200 -91.000 TYR 153 0.840 14.202-213.210 49.386 -99.200 -91.000 TYR 154 0.840 14.459-205.745 50.756 -99.200 -91.000 TYR 157 0.840 13.946-212.898 57.607 -99.200 -91.000 HIS 176 0.900 8.661-217.242 72.404 -99.200 -91.000 PHE 177 1.000 8.597-215.085 67.963 -99.200 -91.000 HIS 183 0.900 5.871-207.907 70.718 -99.200 -91.000 TRP 188 1.040 18.852-202.684 76.943 -99.200 -91.000 TRP6 188 1.020 20.885-203.830 77.335 -99.200 -91.000 PHE 194 1.000 12.877-215.346 73.602 -99.200 -91.000 HIS 198 0.900 13.686-219.426 73.216 -99.200 -91.000 PHE 207 1.000 26.325-220.115 73.342 -99.200 -91.000 PHE 222 1.000 23.960-202.167 66.733 -99.200 -91.000 PHE 223 1.000 23.059-200.578 73.709 -99.200 -91.000