============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 25 rings ring int. center anis. iso. PHE 16 1.000 46.871 58.238 15.735 -99.200 -91.000 PHE 21 1.000 45.482 59.982 20.199 -99.200 -91.000 HIS 34 0.900 69.762 39.437 10.150 -99.200 -91.000 TYR 39 0.840 62.693 48.265 21.034 -99.200 -91.000 TYR 41 0.840 58.037 52.574 21.577 -99.200 -91.000 TRP 72 1.040 63.328 69.548 22.864 -99.200 -91.000 TRP6 72 1.020 65.463 70.509 22.539 -99.200 -91.000 PHE 74 1.000 66.022 66.518 30.505 -99.200 -91.000 PHE 103 1.000 50.551 61.130 6.818 -99.200 -91.000 TYR 107 0.840 54.492 65.323 5.372 -99.200 -91.000 HIS 108 0.900 53.340 73.364 0.850 -99.200 -91.000 TYR 122 0.840 42.119 52.594 -2.931 -99.200 -91.000 TYR 123 0.840 39.957 61.505 -3.833 -99.200 -91.000 TYR 136 0.840 58.525 59.755 6.500 -99.200 -91.000 TRP 142 1.040 47.628 54.395 -3.596 -99.200 -91.000 TRP6 142 1.020 49.954 54.843 -3.637 -99.200 -91.000 PHE 148 1.000 36.697 61.507 1.691 -99.200 -91.000 TYR 151 0.840 44.943 50.202 -0.573 -99.200 -91.000 PHE 155 1.000 55.848 56.577 4.675 -99.200 -91.000 TYR 156 0.840 58.743 57.847 -3.265 -99.200 -91.000 TYR 168 0.840 47.772 54.101 6.997 -99.200 -91.000 PHE 171 1.000 41.175 50.972 8.257 -99.200 -91.000 TYR 197 0.840 49.257 52.983 16.396 -99.200 -91.000 PHE 209 1.000 52.220 67.370 26.415 -99.200 -91.000 TYR 213 0.840 53.088 63.661 33.400 -99.200 -91.000