============================================================================= 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 33 0.840 4.886 21.793 -4.928 -99.200 -91.000 TRP 36 1.040 5.517 12.634 -15.044 -99.200 -91.000 TRP6 36 1.020 3.753 11.102 -15.520 -99.200 -91.000 TYR 37 0.840 9.749 8.676 -8.640 -99.200 -91.000 TYR 50 0.840 13.280 18.159 -9.710 -99.200 -91.000 PHE 63 1.000 12.395 9.654 -20.903 -99.200 -91.000 PHE 72 1.000 0.236 17.808 -12.420 -99.200 -91.000 PHE 84 1.000 10.226 -3.393 -21.151 -99.200 -91.000 TYR 87 0.840 8.426 5.513 -18.921 -99.200 -91.000 TYR 93 0.840 -0.481 20.426 -2.032 -99.200 -91.000 TRP 97 1.040 5.592 13.081 0.647 -99.200 -91.000 TRP6 97 1.020 5.315 12.435 2.935 -99.200 -91.000 PHE 99 1.000 6.168 6.625 -5.248 -99.200 -91.000 PHE 117 1.000 18.407 -22.186 -29.951 -99.200 -91.000 PHE 119 1.000 18.252 -25.911 -24.014 -99.200 -91.000 PHE 140 1.000 8.810 -15.014 -28.773 -99.200 -91.000 TYR 141 0.840 6.900 -6.873 -31.123 -99.200 -91.000 TRP 149 1.040 6.124 -28.997 -24.237 -99.200 -91.000 TRP6 149 1.020 8.411 -29.617 -24.556 -99.200 -91.000 TYR 174 0.840 7.918 -9.271 -25.755 -99.200 -91.000 TYR 187 0.840 12.924 -38.259 -20.351 -99.200 -91.000 HIS 190 0.900 5.401 -42.233 -23.659 -99.200 -91.000 TYR 193 0.840 10.110 -37.305 -24.173 -99.200 -91.000 HIS 199 0.900 6.337 -15.113 -33.643 -99.200 -91.000 PHE 210 1.000 14.530 -34.720 -25.947 -99.200 -91.000