============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 20 rings ring int. center anis. iso. HIS 14 0.900 5.835 21.768 16.015 -99.200 -91.000 TRP 16 1.040 5.872 28.656 24.194 -99.200 -91.000 TRP6 16 1.020 6.825 30.805 24.475 -99.200 -91.000 TRP 20 1.040 9.466 28.526 27.856 -99.200 -91.000 TRP6 20 1.020 10.601 30.603 28.060 -99.200 -91.000 TYR 24 0.840 16.079 22.884 22.087 -99.200 -91.000 PHE 36 1.000 9.473 41.090 31.306 -99.200 -91.000 PHE 40 1.000 11.008 46.921 31.483 -99.200 -91.000 PHE 50 1.000 7.242 44.442 35.065 -99.200 -91.000 PHE 63 1.000 14.563 42.488 34.125 -99.200 -91.000 HIS 66 0.900 9.714 40.052 36.353 -99.200 -91.000 HIS 93 0.900 -3.688 30.995 40.787 -99.200 -91.000 HIS 98 0.900 -0.653 39.406 35.982 -99.200 -91.000 HIS 108 0.900 0.708 48.872 32.131 -99.200 -91.000 PHE 109 1.000 -1.946 41.671 30.935 -99.200 -91.000 PHE 116 1.000 5.697 37.180 25.099 -99.200 -91.000 PHE 127 1.000 5.640 34.224 15.396 -99.200 -91.000 TRP 132 1.040 2.450 35.435 19.343 -99.200 -91.000 TRP6 132 1.020 3.417 33.831 20.787 -99.200 -91.000 PHE 136 1.000 0.403 37.628 24.271 -99.200 -91.000