============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 20 rings ring int. center anis. iso. TYR 9 0.840 48.102 65.486-112.095 -99.200 -91.000 PHE 19 1.000 47.706 56.109-121.231 -99.200 -91.000 PHE 30 1.000 44.600 61.829-113.003 -99.200 -91.000 HIS 35 0.900 57.907 62.568-111.370 -99.200 -91.000 PHE 52 1.000 49.169 62.050-106.918 -99.200 -91.000 PHE 57 1.000 60.316 59.777-107.754 -99.200 -91.000 PHE 64 1.000 43.168 55.068-109.609 -99.200 -91.000 PHE 71 1.000 39.038 63.160-111.217 -99.200 -91.000 TYR 80 0.840 48.411 69.278-124.771 -99.200 -91.000 TYR 84 0.840 40.640 65.511-127.553 -99.200 -91.000 TRP 108 1.040 50.733 63.971-130.719 -99.200 -91.000 TRP6 108 1.020 49.811 62.126-129.554 -99.200 -91.000 TYR 109 0.840 57.372 68.026-129.105 -99.200 -91.000 TYR 122 0.840 64.120 59.936-112.469 -99.200 -91.000 HIS 128 0.900 66.426 49.594-110.107 -99.200 -91.000 PHE 146 1.000 56.413 58.588-123.262 -99.200 -91.000 PHE 170 1.000 65.468 56.995-119.417 -99.200 -91.000 TYR 171 0.840 57.047 54.015-121.908 -99.200 -91.000 TRP 181 1.040 48.804 50.063-107.062 -99.200 -91.000 TRP6 181 1.020 49.937 51.884-108.061 -99.200 -91.000