============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 29 rings ring int. center anis. iso. TYR 3 0.840 34.458 -77.148 43.146 -99.200 -91.000 HIS 6 0.900 34.913 -77.699 48.296 -99.200 -91.000 PHE 10 1.000 50.384 -82.517 45.320 -99.200 -91.000 TYR 17 0.840 44.778 -75.277 51.709 -99.200 -91.000 TYR 21 0.840 40.752 -77.271 55.711 -99.200 -91.000 PHE 23 1.000 47.737 -84.086 60.611 -99.200 -91.000 TYR 62 0.840 37.201 -91.192 72.387 -99.200 -91.000 PHE 64 1.000 38.902 -98.240 69.914 -99.200 -91.000 PHE 95 1.000 52.171-109.910 59.900 -99.200 -91.000 TYR 97 0.840 44.701-118.129 57.131 -99.200 -91.000 TYR 99 0.840 52.473-112.475 55.772 -99.200 -91.000 TYR 101 0.840 55.915-112.780 61.917 -99.200 -91.000 TYR 119 0.840 41.966 -94.085 53.595 -99.200 -91.000 TYR 124 0.840 37.183 -94.263 46.151 -99.200 -91.000 PHE 134 1.000 48.142 -98.608 65.546 -99.200 -91.000 TYR 146 0.840 57.172 -98.220 65.996 -99.200 -91.000 TYR 153 0.840 55.814 -88.648 60.249 -99.200 -91.000 TYR 154 0.840 55.475 -96.050 60.043 -99.200 -91.000 TYR 157 0.840 56.341 -90.386 68.054 -99.200 -91.000 HIS 176 0.900 61.998 -88.652 83.019 -99.200 -91.000 PHE 177 1.000 61.945 -90.056 78.459 -99.200 -91.000 HIS 183 0.900 64.711 -97.632 79.854 -99.200 -91.000 TRP 188 1.040 51.875-103.933 85.337 -99.200 -91.000 TRP6 188 1.020 49.868-102.896 86.043 -99.200 -91.000 PHE 194 1.000 57.787 -90.829 84.054 -99.200 -91.000 HIS 198 0.900 57.014 -86.818 84.519 -99.200 -91.000 PHE 207 1.000 44.426 -86.127 85.198 -99.200 -91.000 PHE 222 1.000 46.561-102.477 75.317 -99.200 -91.000 PHE 223 1.000 47.540-105.429 81.808 -99.200 -91.000