============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 31 rings ring int. center anis. iso. TYR 2 0.840 35.129 -75.227 52.554 -99.200 -91.000 PHE 9 1.000 37.328 -84.461 57.524 -99.200 -91.000 PHE 16 1.000 29.326 -76.632 57.813 -99.200 -91.000 TYR 20 0.840 23.643 -78.212 56.191 -99.200 -91.000 PHE 42 1.000 13.978-100.303 72.673 -99.200 -91.000 HIS 67 0.900 18.735-110.556 70.056 -99.200 -91.000 TYR 72 0.840 12.992 -95.983 62.520 -99.200 -91.000 HIS 81 0.900 19.001 -98.280 53.367 -99.200 -91.000 PHE 93 1.000 27.109-112.454 65.858 -99.200 -91.000 TYR 97 0.840 30.511-115.456 64.290 -99.200 -91.000 PHE 106 1.000 21.221-104.327 65.735 -99.200 -91.000 TYR 113 0.840 24.247 -99.731 55.731 -99.200 -91.000 HIS 117 0.900 25.244 -95.238 53.871 -99.200 -91.000 TYR 120 0.840 32.770 -94.074 50.148 -99.200 -91.000 PHE 126 1.000 21.636 -94.643 56.471 -99.200 -91.000 PHE 132 1.000 20.785 -99.767 68.403 -99.200 -91.000 HIS 141 0.900 24.208-104.799 76.676 -99.200 -91.000 TYR 143 0.840 24.951 -99.936 72.660 -99.200 -91.000 TYR 151 0.840 28.227 -97.728 68.351 -99.200 -91.000 TRP 152 1.040 28.898 -91.867 72.580 -99.200 -91.000 TRP6 152 1.020 31.151 -92.515 72.757 -99.200 -91.000 TYR 154 0.840 22.793 -92.438 75.153 -99.200 -91.000 HIS 176 0.900 13.869 -88.205 91.815 -99.200 -91.000 TYR 194 0.840 -0.017 -89.472 77.338 -99.200 -91.000 HIS 197 0.900 1.799 -84.700 71.804 -99.200 -91.000 PHE 205 1.000 0.648 -88.434 72.949 -99.200 -91.000 TRP 211 1.040 7.422-105.304 77.502 -99.200 -91.000 TRP6 211 1.020 6.908-105.611 79.786 -99.200 -91.000 HIS 221 0.900 10.748-105.246 70.488 -99.200 -91.000 PHE 223 1.000 5.816-103.826 68.515 -99.200 -91.000 PHE 235 1.000 2.709 -93.636 86.243 -99.200 -91.000