============================================================================= 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. TYR 31 0.840 -93.623 58.921-164.334 -99.200 -91.000 TYR 37 0.840 -88.135 59.053-163.101 -99.200 -91.000 TRP 40 1.040 -76.283 51.549-162.221 -99.200 -91.000 TRP6 40 1.020 -76.029 49.575-160.956 -99.200 -91.000 TYR 41 0.840 -76.233 57.684-156.374 -99.200 -91.000 TYR 54 0.840 -78.727 61.829-165.740 -99.200 -91.000 TRP 55 1.040 -84.390 59.803-165.864 -99.200 -91.000 TRP6 55 1.020 -84.522 61.807-167.081 -99.200 -91.000 PHE 67 1.000 -66.878 54.133-164.348 -99.200 -91.000 PHE 76 1.000 -83.356 48.981-164.199 -99.200 -91.000 TYR 91 0.840 -68.511 50.832-159.068 -99.200 -91.000 TYR 92 0.840 -73.689 51.318-151.840 -99.200 -91.000 TYR 96 0.840 -83.778 58.836-160.299 -99.200 -91.000 TYR 97 0.840 -91.618 54.226-160.869 -99.200 -91.000 PHE 103 1.000 -79.178 55.192-151.814 -99.200 -91.000 PHE 121 1.000 -41.103 46.855-144.136 -99.200 -91.000 PHE 123 1.000 -42.857 49.462-137.720 -99.200 -91.000 PHE 144 1.000 -50.944 41.460-147.826 -99.200 -91.000 TYR 145 0.840 -54.584 40.070-155.631 -99.200 -91.000 TRP 153 1.040 -48.289 39.108-133.442 -99.200 -91.000 TRP6 153 1.020 -46.401 40.513-133.593 -99.200 -91.000 TYR 178 0.840 -56.340 43.521-151.206 -99.200 -91.000 TYR 191 0.840 -41.628 44.210-124.702 -99.200 -91.000 HIS 194 0.900 -42.108 35.367-122.205 -99.200 -91.000 TYR 197 0.840 -41.730 40.149-127.123 -99.200 -91.000 HIS 203 0.900 -49.489 36.593-149.875 -99.200 -91.000 PHE 214 1.000 -38.820 43.231-131.060 -99.200 -91.000