============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 19 rings ring int. center anis. iso. PHE 6 1.000 99.059 35.802 157.658 -99.200 -91.000 PHE 13 1.000 94.503 45.529 159.046 -99.200 -91.000 TYR 17 0.840 90.958 47.411 154.991 -99.200 -91.000 TYR 59 0.840 72.892 35.564 140.141 -99.200 -91.000 HIS 64 0.900 72.663 19.196 141.708 -99.200 -91.000 TYR 94 0.840 84.897 12.790 138.901 -99.200 -91.000 PHE 110 1.000 88.258 31.608 140.948 -99.200 -91.000 TYR 114 0.840 91.513 35.366 142.108 -99.200 -91.000 TYR 117 0.840 99.159 32.012 144.873 -99.200 -91.000 PHE 123 1.000 87.052 36.517 142.936 -99.200 -91.000 TYR 139 0.840 77.474 23.390 152.335 -99.200 -91.000 TYR 150 0.840 75.551 30.112 158.615 -99.200 -91.000 PHE 165 1.000 61.764 36.381 162.394 -99.200 -91.000 PHE 166 1.000 65.693 33.152 159.016 -99.200 -91.000 TYR 170 0.840 65.685 26.721 160.995 -99.200 -91.000 PHE 176 1.000 59.231 24.830 149.809 -99.200 -91.000 TYR 204 0.840 60.658 26.164 144.714 -99.200 -91.000 PHE 212 1.000 66.698 28.128 140.779 -99.200 -91.000 TYR 223 0.840 54.119 30.569 149.418 -99.200 -91.000