============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 25 rings ring int. center anis. iso. TYR 2 0.840 140.317 7.853 43.362 -99.200 -91.000 TYR 31 0.840 139.988 -1.112 52.818 -99.200 -91.000 TRP 34 1.040 133.822 -4.805 42.477 -99.200 -91.000 TRP6 34 1.020 134.048 -4.053 40.248 -99.200 -91.000 TYR 35 0.840 127.839 -0.408 45.964 -99.200 -91.000 TYR 36 0.840 122.623 -7.440 39.271 -99.200 -91.000 TYR 48 0.840 132.175 -6.248 53.191 -99.200 -91.000 PHE 51 1.000 139.684 -9.925 51.015 -99.200 -91.000 TYR 85 0.840 127.383 -7.179 37.467 -99.200 -91.000 TYR 86 0.840 126.249 1.518 38.021 -99.200 -91.000 TRP 90 1.040 134.355 5.393 50.736 -99.200 -91.000 TRP6 90 1.020 132.851 6.803 51.894 -99.200 -91.000 PHE 105 1.000 128.405 5.014 43.498 -99.200 -91.000 PHE 126 1.000 104.730 2.598 8.834 -99.200 -91.000 PHE 147 1.000 117.163 -4.412 18.270 -99.200 -91.000 TYR 148 0.840 120.268 -11.908 22.309 -99.200 -91.000 TRP 156 1.040 117.203 9.123 11.158 -99.200 -91.000 TRP6 156 1.020 115.009 8.679 10.399 -99.200 -91.000 TYR 180 0.840 116.931 -6.943 24.462 -99.200 -91.000 TYR 185 0.840 109.281 8.492 16.962 -99.200 -91.000 TRP 193 1.040 107.441 14.591 2.907 -99.200 -91.000 TRP6 193 1.020 108.817 12.669 2.925 -99.200 -91.000 HIS 196 0.900 116.188 17.499 1.249 -99.200 -91.000 TYR 199 0.840 114.447 14.016 4.325 -99.200 -91.000 HIS 205 0.900 122.132 -6.430 15.672 -99.200 -91.000