============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 26 rings ring int. center anis. iso. TYR 5 0.840 8.258 19.752 21.015 -99.200 -91.000 PHE 11 1.000 6.237 38.847 14.906 -99.200 -91.000 HIS 14 0.900 -0.998 44.785 20.049 -99.200 -91.000 TRP 18 1.040 0.045 39.310 7.766 -99.200 -91.000 TRP6 18 1.020 1.492 41.127 8.133 -99.200 -91.000 TYR 20 0.840 -3.241 35.317 6.482 -99.200 -91.000 HIS 23 0.900 -1.496 31.285 -6.138 -99.200 -91.000 PHE 30 1.000 14.657 28.563 12.382 -99.200 -91.000 PHE 44 1.000 0.659 36.463 16.031 -99.200 -91.000 TYR 50 0.840 -7.412 32.508 11.032 -99.200 -91.000 PHE 57 1.000 11.634 25.329 1.939 -99.200 -91.000 HIS 66 0.900 26.852 35.030 0.782 -99.200 -91.000 TYR 81 0.840 -4.212 28.177 12.164 -99.200 -91.000 TYR 89 0.840 -3.074 25.020 15.816 -99.200 -91.000 PHE 91 1.000 7.887 21.713 10.828 -99.200 -91.000 TRP 101 1.040 24.979 24.022 9.885 -99.200 -91.000 TRP6 101 1.020 24.602 22.252 8.360 -99.200 -91.000 TRP 102 1.040 22.042 31.586 9.550 -99.200 -91.000 TRP6 102 1.020 20.632 33.348 10.213 -99.200 -91.000 TYR 103 0.840 18.329 24.611 10.091 -99.200 -91.000 TRP 106 1.040 7.223 28.187 2.695 -99.200 -91.000 TRP6 106 1.020 5.227 26.972 2.411 -99.200 -91.000 HIS 119 0.900 7.684 47.751 18.323 -99.200 -91.000 PHE 132 1.000 15.843 29.929 19.400 -99.200 -91.000 PHE 134 1.000 13.646 34.467 15.204 -99.200 -91.000 TYR 156 0.840 13.568 26.086 22.131 -99.200 -91.000