============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 18 rings ring int. center anis. iso. PHE 5 1.000 62.995 21.197 -1.226 -99.200 -91.000 TRP 19 1.040 62.933 43.007 7.821 -99.200 -91.000 TRP6 19 1.020 62.309 40.797 8.331 -99.200 -91.000 PHE 26 1.000 53.075 40.260 3.641 -99.200 -91.000 HIS 36 0.900 51.578 35.903 -13.260 -99.200 -91.000 PHE 56 1.000 49.137 35.921 0.769 -99.200 -91.000 PHE 58 1.000 46.303 31.944 -4.358 -99.200 -91.000 TYR 66 0.840 40.279 30.129 0.867 -99.200 -91.000 PHE 74 1.000 57.610 40.990 11.546 -99.200 -91.000 HIS 79 0.900 67.414 41.751 8.999 -99.200 -91.000 TYR 90 0.840 51.390 24.943 -1.939 -99.200 -91.000 TYR 97 0.840 53.415 22.364 10.154 -99.200 -91.000 TYR 98 0.840 54.107 24.628 2.066 -99.200 -91.000 PHE 102 1.000 60.288 33.772 1.775 -99.200 -91.000 TYR 120 0.840 57.562 18.213 3.114 -99.200 -91.000 HIS 122 0.900 53.055 15.453 1.290 -99.200 -91.000 TYR 142 0.840 56.831 37.216 -4.116 -99.200 -91.000 TYR 149 0.840 57.079 45.577 -8.345 -99.200 -91.000