============================================================================= 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. TRP 4 1.040 -9.218 81.097 -2.107 -99.200 -91.000 TRP6 4 1.020 -7.141 80.544 -3.110 -99.200 -91.000 PHE 7 1.000 -6.151 75.397 -6.098 -99.200 -91.000 TYR 11 0.840 -2.733 71.731 -4.334 -99.200 -91.000 TYR 29 0.840 16.883 54.108 5.761 -99.200 -91.000 HIS 35 0.900 20.966 57.187 12.572 -99.200 -91.000 PHE 40 1.000 13.629 65.882 14.588 -99.200 -91.000 TYR 61 0.840 -7.570 83.182 -8.315 -99.200 -91.000 HIS 66 0.900 -1.887 73.697 -14.922 -99.200 -91.000 PHE 79 1.000 26.393 62.947 9.615 -99.200 -91.000 HIS 91 0.900 15.523 60.777 -8.802 -99.200 -91.000 TYR 103 0.840 18.305 76.933 -4.619 -99.200 -91.000 HIS 106 0.900 25.227 74.833 -8.323 -99.200 -91.000 TYR 112 0.840 17.168 78.435 1.062 -99.200 -91.000 TYR 115 0.840 18.926 68.253 -3.952 -99.200 -91.000 HIS 116 0.900 14.194 74.550 -2.661 -99.200 -91.000 TYR 121 0.840 1.214 61.923 -3.407 -99.200 -91.000 PHE 144 1.000 18.932 78.139 14.913 -99.200 -91.000 TRP 145 1.040 21.116 81.503 8.367 -99.200 -91.000 TRP6 145 1.020 20.356 82.065 6.198 -99.200 -91.000 HIS 150 0.900 9.811 82.107 4.442 -99.200 -91.000 TYR 154 0.840 4.946 88.304 6.582 -99.200 -91.000 TYR 156 0.840 13.359 93.923 9.352 -99.200 -91.000 PHE 160 1.000 16.985 90.314 5.841 -99.200 -91.000 HIS 176 0.900 29.384 75.689 4.334 -99.200 -91.000 PHE 195 1.000 21.814 51.311 21.588 -99.200 -91.000