============================================================================= 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. TYR 2 0.840 149.903 14.055 50.850 -99.200 -91.000 PHE 7 1.000 150.439 24.786 46.158 -99.200 -91.000 PHE 44 1.000 146.271 22.136 45.518 -99.200 -91.000 TYR 53 0.840 141.128 12.687 56.176 -99.200 -91.000 PHE 68 1.000 144.632 23.366 56.482 -99.200 -91.000 PHE 80 1.000 128.582 29.539 48.167 -99.200 -91.000 TRP 94 1.040 131.781 28.898 37.563 -99.200 -91.000 TRP6 94 1.020 130.597 28.711 39.623 -99.200 -91.000 PHE 100 1.000 139.398 24.371 47.969 -99.200 -91.000 PHE 105 1.000 129.452 16.826 50.436 -99.200 -91.000 TYR 107 0.840 139.857 13.534 49.376 -99.200 -91.000 HIS 118 0.900 121.413 24.356 51.870 -99.200 -91.000 TYR 121 0.840 122.149 19.569 46.599 -99.200 -91.000 PHE 125 1.000 119.523 23.316 42.408 -99.200 -91.000 HIS 147 0.900 130.439 11.131 35.910 -99.200 -91.000 PHE 163 1.000 120.673 14.339 37.994 -99.200 -91.000 PHE 170 1.000 120.534 15.742 26.739 -99.200 -91.000 PHE 189 1.000 127.252 7.857 37.673 -99.200 -91.000 TRP 194 1.040 123.185 8.627 42.528 -99.200 -91.000 TRP6 194 1.020 123.455 10.773 41.560 -99.200 -91.000 TYR 203 0.840 126.225 6.116 22.575 -99.200 -91.000 TYR 204 0.840 126.928 8.154 27.202 -99.200 -91.000 TYR 205 0.840 132.710 7.584 29.951 -99.200 -91.000