============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 24 rings ring int. center anis. iso. TYR 6 0.840 30.004 50.256 12.381 -99.200 -91.000 TRP 48 1.040 18.990 22.119 9.808 -99.200 -91.000 TRP6 48 1.020 20.456 23.707 10.769 -99.200 -91.000 TYR 65 0.840 21.942 25.708 25.799 -99.200 -91.000 TYR 74 0.840 22.605 33.120 18.962 -99.200 -91.000 TYR 83 0.840 19.941 46.773 25.682 -99.200 -91.000 PHE 85 1.000 11.607 42.203 20.523 -99.200 -91.000 TYR 93 0.840 13.416 40.758 30.036 -99.200 -91.000 TRP 95 1.040 21.408 37.915 24.502 -99.200 -91.000 TRP6 95 1.020 22.600 36.303 23.251 -99.200 -91.000 PHE 103 1.000 16.631 39.777 17.822 -99.200 -91.000 HIS 116 0.900 15.698 52.228 32.560 -99.200 -91.000 PHE 158 1.000 27.238 44.331 17.485 -99.200 -91.000 HIS 161 0.900 31.877 46.846 24.522 -99.200 -91.000 HIS 163 0.900 25.734 49.972 26.216 -99.200 -91.000 PHE 164 1.000 17.515 51.295 22.047 -99.200 -91.000 PHE 165 1.000 24.766 55.671 24.695 -99.200 -91.000 TRP 174 1.040 28.883 55.858 27.348 -99.200 -91.000 TRP6 174 1.020 29.314 54.449 25.493 -99.200 -91.000 HIS 178 0.900 32.910 54.252 27.631 -99.200 -91.000 HIS 190 0.900 14.138 58.079 13.425 -99.200 -91.000 PHE 193 1.000 13.471 50.084 11.514 -99.200 -91.000 PHE 199 1.000 22.088 40.917 10.334 -99.200 -91.000 HIS 202 0.900 23.096 43.232 2.254 -99.200 -91.000