============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 28 rings ring int. center anis. iso. PHE 26 1.000 -0.455 7.636 19.353 -99.200 -91.000 TYR 47 0.840 3.176 3.659 32.942 -99.200 -91.000 PHE 66 1.000 2.536 -16.740 49.687 -99.200 -91.000 PHE 82 1.000 -3.266 -5.076 41.214 -99.200 -91.000 PHE 83 1.000 0.594 -2.674 34.463 -99.200 -91.000 PHE 105 1.000 -4.475 -25.883 21.240 -99.200 -91.000 TYR 121 0.840 -10.596 -6.405 34.529 -99.200 -91.000 PHE 124 1.000 -8.563 -5.854 42.167 -99.200 -91.000 TRP 139 1.040 -14.569 -27.572 19.241 -99.200 -91.000 TRP6 139 1.020 -16.379 -26.909 17.861 -99.200 -91.000 PHE 161 1.000 -4.641 -16.112 12.058 -99.200 -91.000 PHE 163 1.000 -17.871 -18.066 5.665 -99.200 -91.000 PHE 180 1.000 -3.967 -10.491 15.601 -99.200 -91.000 TRP 187 1.040 0.720 -19.653 5.734 -99.200 -91.000 TRP6 187 1.020 -0.118 -20.501 3.683 -99.200 -91.000 HIS 188 0.900 -2.286 -16.668 1.489 -99.200 -91.000 PHE 197 1.000 -0.216 -12.693 -2.463 -99.200 -91.000 TYR 212 0.840 -18.992 -5.295 7.400 -99.200 -91.000 TYR 214 0.840 -22.595 -16.354 6.485 -99.200 -91.000 PHE 215 1.000 -19.286 -12.736 11.370 -99.200 -91.000 PHE 220 1.000 -24.643 -15.264 12.194 -99.200 -91.000 PHE 228 1.000 -5.710 -3.556 9.072 -99.200 -91.000 PHE 249 1.000 0.107 2.029 8.095 -99.200 -91.000 TYR 276 0.840 -22.240 -21.381 3.848 -99.200 -91.000 PHE 278 1.000 -17.622 -24.053 8.731 -99.200 -91.000 PHE 283 1.000 -13.082 -24.771 14.584 -99.200 -91.000 PHE 302 1.000 -1.812 -14.022 21.308 -99.200 -91.000 HIS 322 0.900 14.250 -0.704 48.654 -99.200 -91.000