============================================================================= 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 1.000 175.865-131.986-248.007 -99.200 -91.000 TYR 32 0.840 173.059-130.450-243.826 -99.200 -91.000 TRP 35 1.040 181.401-120.131-251.261 -99.200 -91.000 TRP6 35 1.020 182.759-121.666-252.426 -99.200 -91.000 TRP 46 1.040 181.955-116.746-242.859 -99.200 -91.000 TRP6 46 1.020 180.902-114.627-242.929 -99.200 -91.000 TYR 55 0.840 166.265-114.772-243.637 -99.200 -91.000 HIS 57 0.900 174.018-113.031-242.762 -99.200 -91.000 TYR 58 0.840 177.773-111.436-250.104 -99.200 -91.000 PHE 66 1.000 184.979-112.378-253.002 -99.200 -91.000 TYR 78 0.840 176.592-123.018-258.925 -99.200 -91.000 TYR 91 0.840 188.778-117.403-251.877 -99.200 -91.000 TYR 92 0.840 190.178-124.972-247.210 -99.200 -91.000 TYR 103 0.840 165.545-116.736-238.807 -99.200 -91.000 PHE 108 1.000 181.995-122.372-240.681 -99.200 -91.000 TRP 111 1.040 185.852-127.226-242.731 -99.200 -91.000 TRP6 111 1.020 186.676-125.021-242.812 -99.200 -91.000 PHE 129 1.000 216.223-126.876-264.934 -99.200 -91.000 TYR 152 0.840 205.442-124.339-259.477 -99.200 -91.000 PHE 153 1.000 201.927-116.901-260.225 -99.200 -91.000 TRP 161 1.040 209.786-139.004-256.615 -99.200 -91.000 TRP6 161 1.020 211.849-138.613-257.706 -99.200 -91.000 HIS 171 0.900 211.544-136.542-246.156 -99.200 -91.000 PHE 173 1.000 212.459-130.545-248.819 -99.200 -91.000 TYR 183 0.840 203.848-119.908-255.833 -99.200 -91.000 TYR 201 0.840 215.910-144.979-258.044 -99.200 -91.000 HIS 207 0.900 202.024-125.363-263.242 -99.200 -91.000