============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 27 rings ring int. center anis. iso. PHE 27 1.000 133.166-108.584-187.315 -99.200 -91.000 TYR 32 0.840 130.679-110.285-191.760 -99.200 -91.000 TRP 35 1.040 130.036 -95.658-187.272 -99.200 -91.000 TRP6 35 1.020 130.669 -96.007-185.044 -99.200 -91.000 TRP 46 1.040 121.854 -96.410-191.591 -99.200 -91.000 TRP6 46 1.020 121.960 -94.860-193.356 -99.200 -91.000 TYR 55 0.840 129.888 -99.639-204.615 -99.200 -91.000 HIS 57 0.900 124.464 -96.031-199.642 -99.200 -91.000 TYR 58 0.840 128.498 -90.104-194.989 -99.200 -91.000 PHE 66 1.000 127.473 -87.146-187.782 -99.200 -91.000 TYR 78 0.840 139.321 -96.039-187.170 -99.200 -91.000 TYR 91 0.840 126.106 -90.867-182.667 -99.200 -91.000 TYR 92 0.840 123.511 -98.859-179.370 -99.200 -91.000 TYR 103 0.840 126.836-103.952-205.806 -99.200 -91.000 PHE 108 1.000 121.536-102.118-189.309 -99.200 -91.000 TRP 111 1.040 122.559-104.115-183.271 -99.200 -91.000 TRP6 111 1.020 121.659-101.962-183.606 -99.200 -91.000 PHE 129 1.000 125.606 -84.987-151.447 -99.200 -91.000 TYR 152 0.840 125.624 -87.835-163.042 -99.200 -91.000 PHE 153 1.000 126.015 -82.240-169.118 -99.200 -91.000 TRP 161 1.040 125.730-100.856-154.335 -99.200 -91.000 TRP6 161 1.020 125.650 -99.414-152.463 -99.200 -91.000 HIS 171 0.900 115.904-103.377-157.824 -99.200 -91.000 PHE 173 1.000 115.664 -96.566-158.203 -99.200 -91.000 TYR 183 0.840 122.280 -86.260-167.750 -99.200 -91.000 TYR 201 0.840 125.688-103.958-146.260 -99.200 -91.000 HIS 207 0.900 130.607 -87.901-164.236 -99.200 -91.000