============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 23 rings ring int. center anis. iso. PHE 15 1.000 25.774 17.728 22.985 -99.200 -91.000 TYR 17 0.840 29.290 9.102 25.720 -99.200 -91.000 PHE 31 1.000 32.375 11.047 17.605 -99.200 -91.000 HIS 34 0.900 18.736 12.199 18.284 -99.200 -91.000 PHE 69 1.000 15.807 13.126 24.551 -99.200 -91.000 TRP 71 1.040 20.929 16.210 17.087 -99.200 -91.000 TRP6 71 1.020 22.641 15.474 18.549 -99.200 -91.000 PHE 72 1.000 20.190 22.813 14.394 -99.200 -91.000 PHE 80 1.000 15.872 24.106 11.025 -99.200 -91.000 PHE 92 1.000 28.258 16.196 18.779 -99.200 -91.000 PHE 95 1.000 29.696 13.923 23.384 -99.200 -91.000 HIS 103 0.900 34.486 6.345 26.031 -99.200 -91.000 HIS 109 0.900 42.404 5.775 11.464 -99.200 -91.000 PHE 112 1.000 32.446 13.698 13.949 -99.200 -91.000 TYR 115 0.840 16.683 10.984 9.257 -99.200 -91.000 HIS 128 0.900 32.465 24.922 16.893 -99.200 -91.000 HIS 145 0.900 25.006 36.304 9.549 -99.200 -91.000 TYR 167 0.840 12.751 18.962 5.720 -99.200 -91.000 PHE 170 1.000 15.208 24.310 1.031 -99.200 -91.000 HIS 181 0.900 32.609 28.199 3.201 -99.200 -91.000 HIS 194 0.900 13.347 14.134 6.225 -99.200 -91.000 TRP 207 1.040 31.653 8.960 0.892 -99.200 -91.000 TRP6 207 1.020 31.789 9.256 3.239 -99.200 -91.000