============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 18 rings ring int. center anis. iso. PHE 7 1.000 -22.148 19.033 -3.248 -99.200 -91.000 PHE 34 1.000 -26.330 16.139 -4.018 -99.200 -91.000 PHE 62 1.000 -27.796 19.255 -12.024 -99.200 -91.000 PHE 66 1.000 -27.278 23.571 -2.309 -99.200 -91.000 TYR 69 0.840 -13.704 26.608 -4.420 -99.200 -91.000 TYR 91 0.840 -26.754 29.054 -11.334 -99.200 -91.000 TYR 115 0.840 -19.171 32.043 6.843 -99.200 -91.000 PHE 130 1.000 5.955 13.110 6.718 -99.200 -91.000 TYR 139 0.840 -3.116 15.138 7.539 -99.200 -91.000 PHE 153 1.000 -16.457 14.194 7.492 -99.200 -91.000 PHE 160 1.000 -23.345 21.516 2.303 -99.200 -91.000 PHE 193 1.000 -19.222 12.023 20.807 -99.200 -91.000 TYR 197 0.840 -15.499 10.641 32.030 -99.200 -91.000 PHE 221 1.000 2.757 27.583 3.438 -99.200 -91.000 TYR 229 0.840 12.233 21.626 4.925 -99.200 -91.000 HIS 237 0.900 1.427 13.897 7.764 -99.200 -91.000 HIS 265 0.900 -29.401 11.867 4.389 -99.200 -91.000 PHE 277 1.000 -26.054 -3.462 15.732 -99.200 -91.000