============================================================================= 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 34.809-221.344 30.486 -99.200 -91.000 HIS 6 0.900 34.347-221.633 35.736 -99.200 -91.000 PHE 10 1.000 18.985-216.398 33.892 -99.200 -91.000 TYR 17 0.840 24.762-224.611 38.652 -99.200 -91.000 TYR 21 0.840 29.008-223.395 42.698 -99.200 -91.000 PHE 23 1.000 22.117-217.728 49.104 -99.200 -91.000 TYR 62 0.840 32.763-212.608 61.814 -99.200 -91.000 PHE 64 1.000 30.982-205.330 60.587 -99.200 -91.000 PHE 95 1.000 17.383-192.156 53.294 -99.200 -91.000 TYR 97 0.840 24.679-183.508 51.775 -99.200 -91.000 TYR 99 0.840 16.764-188.873 49.743 -99.200 -91.000 TYR 101 0.840 13.718-189.554 55.973 -99.200 -91.000 TYR 119 0.840 27.399-206.305 44.097 -99.200 -91.000 TYR 124 0.840 32.555-204.942 36.628 -99.200 -91.000 PHE 134 1.000 21.706-204.274 56.584 -99.200 -91.000 TYR 146 0.840 12.753-204.833 57.265 -99.200 -91.000 TYR 153 0.840 13.839-213.196 49.750 -99.200 -91.000 TYR 154 0.840 14.312-206.082 51.076 -99.200 -91.000 TYR 157 0.840 13.696-212.947 57.961 -99.200 -91.000 HIS 176 0.900 8.573-217.585 72.376 -99.200 -91.000 PHE 177 1.000 8.463-215.424 67.993 -99.200 -91.000 HIS 183 0.900 5.402-208.216 70.592 -99.200 -91.000 TRP 188 1.040 18.601-202.862 77.263 -99.200 -91.000 TRP6 188 1.020 20.608-204.030 77.734 -99.200 -91.000 PHE 194 1.000 12.719-215.614 73.735 -99.200 -91.000 HIS 198 0.900 13.413-219.623 73.323 -99.200 -91.000 PHE 207 1.000 26.037-220.115 73.438 -99.200 -91.000 PHE 222 1.000 23.564-202.195 66.893 -99.200 -91.000 PHE 223 1.000 22.633-200.803 73.962 -99.200 -91.000