============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 27 rings ring int. center anis. iso. TRP 35 1.040 -31.986 41.636 142.336 -99.200 -91.000 TRP6 35 1.020 -29.914 42.405 143.135 -99.200 -91.000 TYR 36 0.840 -32.381 33.703 144.492 -99.200 -91.000 TYR 49 0.840 -40.682 35.963 138.641 -99.200 -91.000 TYR 55 0.840 -41.908 33.346 144.565 -99.200 -91.000 PHE 62 1.000 -37.501 43.208 150.291 -99.200 -91.000 PHE 71 1.000 -29.319 42.716 135.048 -99.200 -91.000 PHE 83 1.000 -29.099 41.019 160.127 -99.200 -91.000 TYR 86 0.840 -31.541 41.950 151.215 -99.200 -91.000 TYR 87 0.840 -25.800 35.700 148.951 -99.200 -91.000 TYR 91 0.840 -32.784 33.448 135.704 -99.200 -91.000 TYR 93 0.840 -26.891 25.766 129.640 -99.200 -91.000 TYR 94 0.840 -22.204 32.886 126.411 -99.200 -91.000 PHE 96 1.000 -27.776 28.528 139.279 -99.200 -91.000 PHE 98 1.000 -26.834 32.068 143.508 -99.200 -91.000 PHE 116 1.000 -28.175 40.158 183.089 -99.200 -91.000 PHE 118 1.000 -24.965 34.067 183.549 -99.200 -91.000 PHE 139 1.000 -23.887 44.832 172.561 -99.200 -91.000 TYR 140 0.840 -26.835 50.186 166.357 -99.200 -91.000 TRP 148 1.040 -13.291 38.119 180.685 -99.200 -91.000 TRP6 148 1.020 -14.950 37.390 182.192 -99.200 -91.000 TYR 173 0.840 -25.405 44.190 166.252 -99.200 -91.000 TYR 186 0.840 -13.040 29.570 189.574 -99.200 -91.000 HIS 189 0.900 -5.417 34.225 190.544 -99.200 -91.000 TYR 192 0.840 -11.947 34.348 188.992 -99.200 -91.000 HIS 198 0.900 -22.434 49.834 173.743 -99.200 -91.000 PHE 209 1.000 -17.452 35.000 189.858 -99.200 -91.000