============================================================================= 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 19.749-177.899 -13.400 -99.200 -91.000 PHE 46 1.000 30.544-166.574 -0.836 -99.200 -91.000 PHE 56 1.000 27.228-171.393 5.839 -99.200 -91.000 TYR 59 0.840 29.744-177.573 6.514 -99.200 -91.000 TYR 67 0.840 20.683-185.713 -0.819 -99.200 -91.000 TYR 73 0.840 16.224-186.757 -7.144 -99.200 -91.000 PHE 83 1.000 23.276-179.218 4.693 -99.200 -91.000 TYR 98 0.840 30.798-171.184 9.571 -99.200 -91.000 TYR 107 0.840 13.929-173.999 -13.965 -99.200 -91.000 TYR 115 0.840 14.229-170.978 -1.145 -99.200 -91.000 TYR 119 0.840 24.292-162.608 12.053 -99.200 -91.000 TYR 128 0.840 11.436-157.422 -5.377 -99.200 -91.000 HIS 131 0.900 21.428-161.543 2.949 -99.200 -91.000 TYR 133 0.840 24.623-150.415 5.553 -99.200 -91.000 PHE 136 1.000 18.449-149.778 4.914 -99.200 -91.000 TYR 137 0.840 21.524-146.946 -1.210 -99.200 -91.000 PHE 139 1.000 14.819-155.362 -0.371 -99.200 -91.000 HIS 144 0.900 7.786-147.141 -9.627 -99.200 -91.000 HIS 145 0.900 10.838-149.030 -12.164 -99.200 -91.000 TYR 146 0.840 9.305-159.271 -9.525 -99.200 -91.000 PHE 174 1.000 28.683-151.346 -6.562 -99.200 -91.000 PHE 193 1.000 24.364-155.882 -15.536 -99.200 -91.000