============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 34 rings ring int. center anis. iso. PHE 8 1.000 30.136 13.604 15.109 -99.200 -91.000 TYR 17 0.840 27.800 -3.429 3.694 -99.200 -91.000 TRP 24 1.040 30.311 16.525 8.417 -99.200 -91.000 TRP6 24 1.020 31.356 18.490 7.715 -99.200 -91.000 PHE 39 1.000 21.454 6.334 5.419 -99.200 -91.000 TYR 57 0.840 28.746 11.074 3.282 -99.200 -91.000 PHE 61 1.000 31.794 3.532 8.152 -99.200 -91.000 HIS 65 0.900 34.543 8.598 8.477 -99.200 -91.000 TYR 66 0.840 37.371 11.183 11.352 -99.200 -91.000 TYR 91 0.840 22.148 7.354 -3.168 -99.200 -91.000 PHE 93 1.000 18.164 10.185 -5.808 -99.200 -91.000 TYR 99 0.840 18.521 15.649 -2.109 -99.200 -91.000 TYR 103 0.840 28.940 4.780 -3.550 -99.200 -91.000 TRP 106 1.040 36.902 9.328 3.282 -99.200 -91.000 TRP6 106 1.020 37.735 11.527 3.385 -99.200 -91.000 TRP 124 1.040 28.941 15.530 -5.298 -99.200 -91.000 TRP6 124 1.020 28.084 17.692 -5.046 -99.200 -91.000 PHE 125 1.000 25.901 6.950 -7.359 -99.200 -91.000 TRP 148 1.040 31.251 9.669 -13.857 -99.200 -91.000 TRP6 148 1.020 29.555 9.376 -12.242 -99.200 -91.000 TRP 151 1.040 32.775 20.218 -10.164 -99.200 -91.000 TRP6 151 1.020 32.305 22.463 -9.567 -99.200 -91.000 PHE 163 1.000 35.937 11.090 -10.593 -99.200 -91.000 TRP 172 1.040 26.306 2.563 -12.285 -99.200 -91.000 TRP6 172 1.020 28.300 3.831 -12.040 -99.200 -91.000 PHE 174 1.000 30.262 2.748 -7.862 -99.200 -91.000 PHE 179 1.000 33.664 6.498 -10.382 -99.200 -91.000 TRP 193 1.040 49.187 7.145 -1.889 -99.200 -91.000 TRP6 193 1.020 47.945 9.128 -1.471 -99.200 -91.000 TYR 194 0.840 48.206 0.704 2.843 -99.200 -91.000 PHE 202 1.000 20.581 10.313 0.684 -99.200 -91.000 TRP 205 1.040 25.009 22.646 1.935 -99.200 -91.000 TRP6 205 1.020 25.842 20.817 0.659 -99.200 -91.000 PHE 216 1.000 27.473 0.691 0.809 -99.200 -91.000