============================================================================= 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 35.249-221.395 29.915 -99.200 -91.000 HIS 6 0.900 34.831-221.838 35.193 -99.200 -91.000 PHE 10 1.000 19.493-216.451 33.348 -99.200 -91.000 TYR 17 0.840 25.165-224.694 38.164 -99.200 -91.000 TYR 21 0.840 29.353-223.493 42.363 -99.200 -91.000 PHE 23 1.000 22.432-217.806 48.663 -99.200 -91.000 TYR 62 0.840 33.146-212.811 61.240 -99.200 -91.000 PHE 64 1.000 31.271-205.540 60.091 -99.200 -91.000 PHE 95 1.000 17.737-192.333 52.852 -99.200 -91.000 TYR 97 0.840 25.120-183.682 51.483 -99.200 -91.000 TYR 99 0.840 17.170-189.210 49.189 -99.200 -91.000 TYR 101 0.840 14.037-189.806 55.377 -99.200 -91.000 TYR 119 0.840 28.002-206.558 43.575 -99.200 -91.000 TYR 124 0.840 32.969-205.029 36.233 -99.200 -91.000 PHE 134 1.000 22.049-204.419 56.040 -99.200 -91.000 TYR 146 0.840 13.039-204.969 56.720 -99.200 -91.000 TYR 153 0.840 14.283-213.320 49.261 -99.200 -91.000 TYR 154 0.840 14.634-206.083 50.623 -99.200 -91.000 TYR 157 0.840 13.990-213.101 57.260 -99.200 -91.000 HIS 176 0.900 8.818-217.616 71.649 -99.200 -91.000 PHE 177 1.000 8.711-215.500 67.160 -99.200 -91.000 HIS 183 0.900 5.734-208.220 69.877 -99.200 -91.000 TRP 188 1.040 18.740-203.033 76.528 -99.200 -91.000 TRP6 188 1.020 20.763-204.169 76.994 -99.200 -91.000 PHE 194 1.000 12.969-215.608 73.046 -99.200 -91.000 HIS 198 0.900 13.676-219.673 72.794 -99.200 -91.000 PHE 207 1.000 26.328-220.471 72.740 -99.200 -91.000 PHE 222 1.000 23.872-202.439 66.394 -99.200 -91.000 PHE 223 1.000 23.094-201.020 73.383 -99.200 -91.000