============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 19 rings ring int. center anis. iso. PHE 5 1.000 1.106 12.578 22.454 -99.200 -91.000 TYR 11 0.840 0.587 25.354 31.079 -99.200 -91.000 TYR 15 0.840 -0.274 29.875 30.219 -99.200 -91.000 HIS 16 0.900 6.712 30.972 24.621 -99.200 -91.000 TYR 22 0.840 4.647 17.376 32.003 -99.200 -91.000 TRP 33 1.040 11.939 7.643 38.202 -99.200 -91.000 TRP6 33 1.020 13.388 8.435 36.509 -99.200 -91.000 PHE 54 1.000 15.018 13.535 21.188 -99.200 -91.000 TRP 69 1.040 14.469 19.812 18.283 -99.200 -91.000 TRP6 69 1.020 12.192 20.022 17.802 -99.200 -91.000 TYR 76 0.840 4.090 8.126 34.921 -99.200 -91.000 PHE 80 1.000 8.504 -0.565 35.861 -99.200 -91.000 TYR 88 0.840 9.298 21.551 25.598 -99.200 -91.000 TRP 92 1.040 8.475 28.636 22.234 -99.200 -91.000 TRP6 92 1.020 8.310 27.153 24.031 -99.200 -91.000 TYR 95 0.840 8.178 18.037 14.472 -99.200 -91.000 TYR 101 0.840 12.446 9.443 23.407 -99.200 -91.000 PHE 104 1.000 10.920 12.046 17.282 -99.200 -91.000 PHE 139 1.000 -8.239 45.930 28.641 -99.200 -91.000