============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 21 rings ring int. center anis. iso. TRP 14 1.040 14.197 36.390 23.967 -99.200 -91.000 TRP6 14 1.020 15.019 34.262 23.316 -99.200 -91.000 TYR 36 0.840 11.283 19.905 11.428 -99.200 -91.000 TYR 42 0.840 -0.765 18.003 17.861 -99.200 -91.000 PHE 43 1.000 -0.783 24.210 15.421 -99.200 -91.000 HIS 45 0.900 -7.704 24.567 15.696 -99.200 -91.000 TRP 46 1.040 -5.042 27.844 14.004 -99.200 -91.000 TRP6 46 1.020 -2.709 28.139 14.076 -99.200 -91.000 HIS 59 0.900 -0.596 29.515 18.595 -99.200 -91.000 HIS 73 0.900 8.737 34.893 35.102 -99.200 -91.000 PHE 78 1.000 11.347 21.914 34.839 -99.200 -91.000 PHE 80 1.000 6.377 32.540 33.385 -99.200 -91.000 HIS 88 0.900 0.761 24.003 25.184 -99.200 -91.000 PHE 99 1.000 5.290 20.631 24.394 -99.200 -91.000 HIS 104 0.900 16.124 22.458 13.971 -99.200 -91.000 TYR 113 0.840 14.291 37.325 10.899 -99.200 -91.000 PHE 114 1.000 18.327 39.365 15.705 -99.200 -91.000 PHE 118 1.000 21.732 31.176 17.518 -99.200 -91.000 HIS 123 0.900 22.987 26.417 18.128 -99.200 -91.000 PHE 129 1.000 14.757 30.394 27.351 -99.200 -91.000 TYR 141 0.840 2.000 16.935 27.945 -99.200 -91.000