============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 22 rings ring int. center anis. iso. HIS 41 0.900 20.184-177.594 -13.632 -99.200 -91.000 PHE 46 1.000 31.085-166.290 -1.121 -99.200 -91.000 PHE 56 1.000 27.733-171.209 5.531 -99.200 -91.000 TYR 59 0.840 30.154-177.380 6.164 -99.200 -91.000 TYR 67 0.840 21.250-185.529 -1.069 -99.200 -91.000 TYR 73 0.840 16.727-186.345 -7.710 -99.200 -91.000 PHE 83 1.000 23.669-178.834 4.204 -99.200 -91.000 TYR 98 0.840 31.160-171.169 9.199 -99.200 -91.000 TYR 107 0.840 14.437-173.659 -14.220 -99.200 -91.000 TYR 115 0.840 14.655-170.725 -1.523 -99.200 -91.000 TYR 119 0.840 24.506-162.336 11.763 -99.200 -91.000 TYR 128 0.840 12.023-157.046 -5.585 -99.200 -91.000 HIS 131 0.900 21.920-161.250 2.765 -99.200 -91.000 TYR 133 0.840 25.350-150.217 5.203 -99.200 -91.000 PHE 136 1.000 18.880-149.634 4.868 -99.200 -91.000 TYR 137 0.840 21.481-146.099 -1.649 -99.200 -91.000 PHE 139 1.000 15.348-155.252 -0.269 -99.200 -91.000 HIS 144 0.900 8.244-146.830 -9.686 -99.200 -91.000 HIS 145 0.900 11.550-148.391 -12.333 -99.200 -91.000 TYR 146 0.840 9.951-158.547 -9.789 -99.200 -91.000 PHE 174 1.000 29.195-151.078 -6.736 -99.200 -91.000 PHE 193 1.000 25.076-155.602 -15.669 -99.200 -91.000