============================================================================= 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. TRP 7 1.040 7.411 -18.714 24.449 -99.200 -91.000 TRP6 7 1.020 6.396 -18.310 26.556 -99.200 -91.000 TRP 26 1.040 16.823 -37.691 17.425 -99.200 -91.000 TRP6 26 1.020 16.335 -38.818 19.454 -99.200 -91.000 PHE 28 1.000 21.459 -30.854 20.452 -99.200 -91.000 TYR 61 0.840 16.168 -46.311 14.318 -99.200 -91.000 PHE 67 1.000 11.155 -41.890 14.411 -99.200 -91.000 TYR 70 0.840 7.860 -42.715 18.402 -99.200 -91.000 TYR 74 0.840 13.718 -41.262 28.152 -99.200 -91.000 HIS 81 0.900 18.682 -38.282 35.166 -99.200 -91.000 TYR 85 0.840 24.595 -32.751 38.236 -99.200 -91.000 TYR 86 0.840 23.113 -39.370 30.119 -99.200 -91.000 TYR 88 0.840 25.513 -33.642 21.527 -99.200 -91.000 PHE 141 1.000 17.122 -24.130 7.474 -99.200 -91.000 TYR 144 0.840 18.544 -17.142 8.359 -99.200 -91.000 PHE 149 1.000 15.659 -19.689 3.983 -99.200 -91.000 HIS 159 0.900 17.995 -29.416 11.582 -99.200 -91.000 TYR 166 0.840 3.218 -15.251 17.685 -99.200 -91.000 TYR 170 0.840 9.417 -12.534 13.501 -99.200 -91.000 TRP 177 1.040 22.477 -27.194 11.901 -99.200 -91.000 TRP6 177 1.020 21.715 -26.528 9.750 -99.200 -91.000 TRP 181 1.040 22.695 -21.778 9.924 -99.200 -91.000 TRP6 181 1.020 20.462 -21.534 10.656 -99.200 -91.000 TYR 186 0.840 17.554 -18.184 18.885 -99.200 -91.000 PHE 208 1.000 1.293 -28.806 22.425 -99.200 -91.000