============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 17 rings ring int. center anis. iso. TYR 35 0.840 2.494 68.770 44.753 -99.200 -91.000 PHE 41 1.000 9.773 67.525 39.100 -99.200 -91.000 TYR 80 0.840 19.920 48.019 32.152 -99.200 -91.000 HIS 87 0.900 21.086 42.054 18.740 -99.200 -91.000 TYR 104 0.840 13.408 43.865 27.376 -99.200 -91.000 PHE 126 1.000 8.785 63.864 17.236 -99.200 -91.000 PHE 135 1.000 12.451 66.046 25.111 -99.200 -91.000 HIS 172 0.900 -5.342 62.141 15.132 -99.200 -91.000 TRP 185 1.040 7.872 49.118 19.956 -99.200 -91.000 TRP6 185 1.020 8.597 50.799 18.456 -99.200 -91.000 TRP 204 1.040 -8.400 50.552 36.150 -99.200 -91.000 TRP6 204 1.020 -8.090 52.787 36.871 -99.200 -91.000 TYR 215 0.840 21.986 64.924 42.930 -99.200 -91.000 TRP 225 1.040 -6.431 52.850 26.586 -99.200 -91.000 TRP6 225 1.020 -4.079 52.746 26.400 -99.200 -91.000 TYR 237 0.840 9.049 63.504 34.739 -99.200 -91.000 PHE 238 1.000 10.585 61.303 45.341 -99.200 -91.000