============================================================================= 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. PHE 19 1.000 11.151 1.281 12.597 -99.200 -91.000 HIS 20 0.900 8.415 7.074 13.959 -99.200 -91.000 TYR 22 0.840 2.742 4.698 18.313 -99.200 -91.000 HIS 33 0.900 5.566 16.013 18.521 -99.200 -91.000 HIS 38 0.900 18.515 22.706 6.972 -99.200 -91.000 TRP 45 1.040 22.781 6.053 14.689 -99.200 -91.000 TRP6 45 1.020 20.743 5.465 15.768 -99.200 -91.000 PHE 51 1.000 18.866 4.109 27.456 -99.200 -91.000 TYR 57 0.840 19.070 13.177 22.574 -99.200 -91.000 HIS 59 0.900 15.683 22.504 25.831 -99.200 -91.000 PHE 60 1.000 12.292 21.276 30.049 -99.200 -91.000 PHE 70 1.000 24.883 2.018 29.279 -99.200 -91.000 PHE 107 1.000 12.756 7.276 26.165 -99.200 -91.000 HIS 114 0.900 8.158 9.599 35.316 -99.200 -91.000 TYR 119 0.840 6.998 9.127 26.650 -99.200 -91.000 HIS 126 0.900 13.628 8.439 8.678 -99.200 -91.000 PHE 128 1.000 14.037 13.170 3.432 -99.200 -91.000 TRP 135 1.040 16.814 17.745 4.338 -99.200 -91.000 TRP6 135 1.020 16.783 17.913 1.967 -99.200 -91.000 TYR 142 0.840 3.874 11.310 23.011 -99.200 -91.000 PHE 158 1.000 5.194 17.436 30.793 -99.200 -91.000