============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 21 rings ring int. center anis. iso. PHE 2 1.000 61.966 -32.154 -36.293 -99.200 -91.000 PHE 11 1.000 57.199 -22.573 -23.749 -99.200 -91.000 HIS 37 0.900 55.869 -1.958 -26.525 -99.200 -91.000 HIS 53 0.900 59.725 -17.271 -34.138 -99.200 -91.000 HIS 64 0.900 58.402 -7.266 -39.372 -99.200 -91.000 PHE 91 1.000 62.910 -12.834 -30.629 -99.200 -91.000 HIS 96 0.900 71.980 -8.252 -23.381 -99.200 -91.000 TYR 107 0.840 62.672 5.611 -24.073 -99.200 -91.000 PHE 113 1.000 52.776 2.438 -30.812 -99.200 -91.000 PHE 120 1.000 56.852 -1.486 -32.681 -99.200 -91.000 PHE 140 1.000 60.718 -4.591 -23.033 -99.200 -91.000 PHE 148 1.000 69.003 -22.853 -15.342 -99.200 -91.000 TYR 149 0.840 61.462 -25.238 -19.333 -99.200 -91.000 PHE 229 1.000 83.947 -23.433 -20.913 -99.200 -91.000 TYR 241 0.840 92.114 -18.108 -10.729 -99.200 -91.000 TYR 266 0.840 79.385 -22.861 -21.125 -99.200 -91.000 TYR 269 0.840 72.301 -27.207 -14.029 -99.200 -91.000 PHE 275 1.000 77.384 -29.288 -9.454 -99.200 -91.000 TYR 290 0.840 87.132 -28.041 -3.541 -99.200 -91.000 HIS 292 0.900 79.821 -34.107 -10.239 -99.200 -91.000 TYR 295 0.840 89.764 -31.628 -8.447 -99.200 -91.000