============================================================================= 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. TYR 12 0.840 -19.366 31.611 20.495 -99.200 -91.000 TRP 15 1.040 -18.352 29.455 14.046 -99.200 -91.000 TRP6 15 1.020 -17.131 28.733 15.934 -99.200 -91.000 TYR 35 0.840 -10.665 37.004 30.532 -99.200 -91.000 PHE 42 1.000 -10.618 46.805 24.778 -99.200 -91.000 HIS 45 0.900 -4.022 51.357 23.197 -99.200 -91.000 PHE 50 1.000 -13.164 43.148 35.567 -99.200 -91.000 TYR 51 0.840 -14.505 34.580 34.066 -99.200 -91.000 PHE 54 1.000 -15.241 32.249 29.995 -99.200 -91.000 HIS 69 0.900 -13.209 51.130 22.752 -99.200 -91.000 TYR 80 0.840 -9.604 35.275 18.196 -99.200 -91.000 PHE 82 1.000 -15.135 33.988 17.681 -99.200 -91.000 TYR 95 0.840 -27.490 47.791 36.959 -99.200 -91.000 TYR 108 0.840 -26.173 50.039 16.240 -99.200 -91.000 TYR 131 0.840 -14.382 58.702 40.538 -99.200 -91.000 HIS 136 0.900 -7.131 42.202 44.134 -99.200 -91.000 TYR 153 0.840 -17.773 20.493 42.825 -99.200 -91.000 TYR 156 0.840 -16.385 25.067 41.149 -99.200 -91.000 TYR 173 0.840 -23.880 49.589 49.063 -99.200 -91.000 PHE 178 1.000 -17.394 41.816 36.251 -99.200 -91.000 PHE 179 1.000 -12.880 33.040 40.995 -99.200 -91.000 PHE 185 1.000 -14.617 36.677 45.176 -99.200 -91.000 PHE 197 1.000 -16.271 48.244 48.914 -99.200 -91.000 PHE 201 1.000 -15.398 43.536 52.693 -99.200 -91.000 TYR 208 0.840 -22.457 32.582 52.799 -99.200 -91.000