============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 17 rings ring int. center anis. iso. TYR 24 0.840 -1.704 13.595 114.399 -99.200 -91.000 TRP 36 1.040 14.539 6.884 101.435 -99.200 -91.000 TRP6 36 1.020 14.631 4.894 102.704 -99.200 -91.000 TYR 38 0.840 7.077 4.598 93.877 -99.200 -91.000 PHE 43 1.000 17.696 2.997 89.313 -99.200 -91.000 TYR 45 0.840 17.965 -2.702 89.025 -99.200 -91.000 HIS 50 0.900 35.018 -1.903 82.758 -99.200 -91.000 TYR 55 0.840 28.449 -3.455 82.575 -99.200 -91.000 TYR 63 0.840 14.408 -6.086 92.328 -99.200 -91.000 PHE 77 1.000 18.960 1.316 66.605 -99.200 -91.000 HIS 88 0.900 7.962 -11.543 88.014 -99.200 -91.000 PHE 97 1.000 15.905 3.782 82.093 -99.200 -91.000 TRP 100 1.040 10.572 8.379 82.804 -99.200 -91.000 TRP6 100 1.020 12.805 9.053 82.438 -99.200 -91.000 HIS 110 0.900 12.352 -1.536 67.777 -99.200 -91.000 PHE 112 1.000 11.880 -8.006 78.391 -99.200 -91.000 PHE 118 1.000 6.209 5.878 73.553 -99.200 -91.000