============================================================================= 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 5 1.000 19.704 48.783 78.890 -99.200 -91.000 TRP 10 1.040 21.458 44.545 83.475 -99.200 -91.000 TRP6 10 1.020 22.428 44.501 81.297 -99.200 -91.000 PHE 11 1.000 14.207 39.175 85.158 -99.200 -91.000 HIS 15 0.900 18.644 36.966 84.111 -99.200 -91.000 TYR 33 0.840 23.279 47.309 75.886 -99.200 -91.000 TRP 35 1.040 33.352 49.409 80.884 -99.200 -91.000 TRP6 35 1.020 34.389 50.432 79.015 -99.200 -91.000 PHE 43 1.000 20.330 34.700 77.117 -99.200 -91.000 PHE 48 1.000 8.892 42.991 82.021 -99.200 -91.000 HIS 64 0.900 21.262 31.022 94.392 -99.200 -91.000 HIS 72 0.900 6.995 37.222 94.384 -99.200 -91.000 PHE 76 1.000 1.976 25.232 85.215 -99.200 -91.000 HIS 82 0.900 23.687 28.852 83.347 -99.200 -91.000 TYR 98 0.840 29.290 33.618 77.635 -99.200 -91.000 PHE 106 1.000 9.207 23.521 89.216 -99.200 -91.000 TYR 107 0.840 10.403 32.089 85.865 -99.200 -91.000 TYR 122 0.840 3.454 44.342 82.526 -99.200 -91.000 HIS 128 0.900 17.409 38.933 92.773 -99.200 -91.000