#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1w02 n LEU 3 N 0.00 3.83 -4.75 3.41 7.94 -1.18 -3.56 117.00 122.68 1w02 n LEU 3 Ca 0.00 1.03 -0.41 0.00 -1.11 0.00 0.00 56.01 55.51 1w02 n LEU 3 Cb 0.00 -1.52 -0.02 0.00 0.53 0.00 0.00 43.42 42.41 1w02 n LEU 3 CO 0.00 0.08 1.12 -2.16 -1.11 0.00 0.00 177.39 175.32 1w02 s PRO 4 N 1.97 4.25 0.88 1.96 0.04 -1.26 -5.00 135.00 137.85 1w02 s PRO 4 Ca 0.80 2.34 -0.13 0.00 0.04 0.00 0.00 61.00 64.05 1w02 s PRO 4 Cb -0.54 -3.09 0.13 0.00 0.04 0.00 0.00 34.50 31.04 1w02 s PRO 4 CO 0.37 -0.44 1.18 0.95 0.04 0.00 0.00 177.00 179.10 1w02 s THR 5 N -0.13 1.98 0.11 1.26 -4.23 -1.26 -4.19 115.64 109.18 1w02 s THR 5 Ca 0.59 0.00 -0.28 0.00 -1.18 0.00 0.00 61.69 60.81 1w02 s THR 5 Cb -0.43 -2.89 -0.10 0.00 1.34 0.00 0.00 72.50 70.43 1w02 s THR 5 CO 0.45 0.00 1.47 0.00 -0.54 0.00 0.00 174.62 176.00 1w02 h ALA 6 N -1.36 -0.75 -1.02 3.99 0.00 -1.90 0.76 119.26 118.97 1w02 h ALA 6 Ca -0.47 -0.02 0.25 0.00 0.00 0.00 0.00 54.91 54.67 1w02 h ALA 6 Cb 1.32 1.03 -0.10 0.00 0.00 0.00 0.00 17.79 20.03 1w02 h ALA 6 CO 0.59 -0.96 0.64 1.96 0.00 0.00 0.00 179.25 181.48 1w02 h GLN 7 N -0.39 0.48 -0.04 0.00 4.20 -1.92 0.24 115.11 117.68 1w02 h GLN 7 Ca 0.05 -0.03 -0.11 0.00 0.06 0.00 0.00 58.65 58.62 1w02 h GLN 7 Cb 0.53 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.19 1w02 h GLN 7 CO -0.46 0.32 -0.47 0.93 -0.67 0.00 0.00 178.83 178.48 1w02 h GLU 8 N 0.50 0.10 -0.16 1.46 5.08 -1.26 -2.37 114.58 117.93 1w02 h GLU 8 Ca 0.61 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.89 1w02 h GLU 8 Cb 1.34 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.58 1w02 h GLU 8 CO -0.36 0.55 -0.02 0.28 -1.00 0.00 0.00 179.01 178.46 1w02 h VAL 9 N 0.08 1.27 -0.96 3.13 2.07 0.12 -1.25 116.25 120.71 1w02 h VAL 9 Ca 0.00 -0.91 0.13 0.00 0.82 0.00 0.00 66.70 66.74 1w02 h VAL 9 Cb 0.86 1.55 -0.08 0.00 -1.52 0.00 0.00 31.29 32.10 1w02 h VAL 9 CO 0.07 0.27 0.61 1.56 0.02 0.00 0.00 177.57 180.10 1w02 h GLN 10 N 0.02 0.86 -0.16 1.57 4.20 -1.22 -0.39 115.11 119.99 1w02 h GLN 10 Ca 0.04 -0.05 -0.10 0.00 0.06 0.00 0.00 58.65 58.60 1w02 h GLN 10 Cb 0.42 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 28.00 1w02 h GLN 10 CO 0.01 0.57 -0.29 0.78 -0.67 0.00 0.00 178.83 179.24 1w02 h GLY 11 N 0.89 0.52 0.95 3.46 0.00 -1.09 -2.22 103.07 105.58 1w02 h GLY 11 Ca 0.48 -0.60 -0.07 0.00 0.00 0.00 0.00 47.33 47.13 1w02 h GLY 11 CO -0.25 0.54 -0.04 1.41 0.00 0.00 0.00 176.54 178.20 1w02 h LEU 12 N 0.11 0.71 -0.35 3.11 3.38 -0.71 -1.78 115.31 119.78 1w02 h LEU 12 Ca 0.01 -0.34 -0.09 0.00 0.09 0.00 0.00 57.88 57.56 1w02 h LEU 12 Cb 0.87 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 1w02 h LEU 12 CO 0.06 0.88 -0.13 0.24 0.09 0.00 0.00 178.44 179.59 1w02 h MET 13 N 0.53 0.71 -0.39 1.13 2.86 -1.16 -0.38 114.93 118.23 1w02 h MET 13 Ca 0.10 -0.29 -0.01 0.00 -2.06 0.00 0.00 59.70 57.45 1w02 h MET 13 Cb 0.54 -0.03 -0.02 0.00 0.06 0.00 0.00 31.60 32.15 1w02 h MET 13 CO 0.03 0.89 0.21 0.00 1.06 0.00 0.00 176.91 179.10 1w02 h ALA 14 N 0.80 0.49 -0.95 6.32 0.00 -1.41 -1.73 119.26 122.79 1w02 h ALA 14 Ca 0.08 -0.08 0.10 0.00 0.00 0.00 0.00 54.91 55.01 1w02 h ALA 14 Cb 0.65 -0.15 -0.07 0.00 0.00 0.00 0.00 17.79 18.22 1w02 h ALA 14 CO 0.04 0.02 0.61 -0.09 0.00 0.00 0.00 179.25 179.83 1w02 h ARG 15 N 0.49 0.95 -0.38 0.00 2.43 -1.10 -1.24 114.38 115.54 1w02 h ARG 15 Ca 0.14 -0.06 0.05 0.00 -0.81 0.00 0.00 59.98 59.29 1w02 h ARG 15 Cb 0.06 -0.21 -0.04 0.00 -0.42 0.00 0.00 29.97 29.35 1w02 h ARG 15 CO -0.02 0.63 0.13 0.35 -1.51 0.00 0.00 179.97 179.55 1w02 h PHE 16 N 0.98 0.23 -0.85 2.20 3.57 -0.16 0.11 116.94 123.02 1w02 h PHE 16 Ca 0.44 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.98 1w02 h PHE 16 Cb 0.37 -0.05 -0.05 0.00 2.79 0.00 0.00 35.95 39.02 1w02 h PHE 16 CO -0.00 0.09 0.56 0.82 -2.23 0.00 0.00 178.31 177.55 1w02 h ILE 17 N 0.28 1.18 -0.11 1.41 1.08 -0.85 -0.16 117.51 120.35 1w02 h ILE 17 Ca 0.17 -0.38 0.01 0.00 -0.39 0.00 0.00 64.86 64.27 1w02 h ILE 17 Cb 0.16 -0.02 -0.01 0.00 -3.07 0.00 0.00 36.82 33.87 1w02 h ILE 17 CO -0.18 0.20 0.04 -0.33 -0.69 0.00 0.00 178.15 177.19 1w02 h GLU 18 N 1.11 0.10 -0.22 2.37 5.08 -0.46 0.15 114.58 122.70 1w02 h GLU 18 Ca 0.32 -0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.69 1w02 h GLU 18 Cb -0.06 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.15 1w02 h GLU 18 CO -0.08 0.06 0.10 -0.07 -1.00 0.00 0.00 179.01 178.02 1w02 h LEU 19 N 0.10 0.15 -1.16 1.33 3.38 -0.12 -0.76 115.31 118.23 1w02 h LEU 19 Ca 0.04 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1w02 h LEU 19 Cb 0.02 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 40.71 1w02 h LEU 19 CO -0.04 0.12 0.53 0.58 0.09 0.00 0.00 178.44 179.72 1w02 h VAL 20 N 0.22 1.22 -0.18 1.22 2.07 -0.86 0.16 116.25 120.10 1w02 h VAL 20 Ca 0.09 -0.43 -0.02 0.00 0.82 0.00 0.00 66.70 67.17 1w02 h VAL 20 Cb 0.03 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 29.81 1w02 h VAL 20 CO -0.07 0.22 0.04 -0.78 0.02 0.00 0.00 177.57 177.00 1w02 h ASP 21 N 1.13 0.27 1.62 0.57 3.58 0.21 -2.93 116.42 120.86 1w02 h ASP 21 Ca 0.30 -0.23 -0.03 0.00 0.42 0.00 0.00 57.03 57.50 1w02 h ASP 21 Cb -0.10 -0.07 -0.00 0.00 1.72 0.00 0.00 39.33 40.87 1w02 h ASP 21 CO -0.06 0.42 -0.13 -0.37 -2.88 0.00 0.00 179.24 176.22 1w02 h VAL 22 N 0.10 0.25 0.00 2.25 -1.51 -0.93 -3.42 116.25 112.98 1w02 h VAL 22 Ca 0.06 -1.20 0.00 0.00 -1.23 0.00 0.00 66.70 64.32 1w02 h VAL 22 Cb 0.26 1.99 0.00 0.00 -2.13 0.00 0.00 31.29 31.41 1w02 h VAL 22 CO 0.00 0.13 0.00 0.61 -1.23 0.00 0.00 177.57 177.08 1w02 n GLY 23 N 0.86 0.79 3.27 5.19 0.00 0.52 -4.98 105.19 110.84 1w02 n GLY 23 Ca 0.03 -0.65 -0.43 0.00 0.00 0.00 0.00 46.02 44.97 1w02 n GLY 23 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1w02 n ASP 24 N 1.35 4.63 -0.38 1.61 -0.08 -0.98 -4.83 116.55 117.88 1w02 n ASP 24 Ca 0.00 -2.91 -0.09 0.00 -1.51 0.00 0.00 54.79 50.28 1w02 n ASP 24 Cb 0.22 -1.70 -0.07 0.00 2.34 0.00 0.00 41.12 41.91 1w02 n ASP 24 CO 0.00 0.00 0.00 -0.38 0.12 0.00 0.00 177.20 176.94 1w02 n ILE 25 N 5.71 -0.60 -0.15 5.18 2.08 -1.26 -1.29 119.36 129.03 1w02 n ILE 25 Ca 0.49 2.18 -0.03 0.00 0.56 0.00 0.00 62.75 65.94 1w02 n ILE 25 Cb 0.43 -2.71 0.06 0.00 -0.75 0.00 0.00 39.64 36.67 1w02 n ILE 25 CO 0.00 0.00 0.00 -0.33 0.56 0.00 0.00 176.55 176.78 1w02 h GLU 26 N 0.00 0.21 -0.35 0.38 5.08 -1.97 0.18 114.58 118.11 1w02 h GLU 26 Ca 0.16 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1w02 h GLU 26 Cb 0.39 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 1w02 h GLU 26 CO -0.85 0.14 0.21 0.00 -1.00 0.00 0.00 179.01 177.50 1w02 h ALA 27 N 1.37 1.71 0.65 3.43 0.00 -1.60 -1.08 119.26 123.74 1w02 h ALA 27 Ca 0.24 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 1w02 h ALA 27 Cb 0.31 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 17.97 1w02 h ALA 27 CO -0.32 0.26 -0.31 0.82 0.00 0.00 0.00 179.25 179.70 1w02 h ILE 28 N 0.48 0.25 -0.93 0.00 1.08 -0.02 -2.65 117.51 115.73 1w02 h ILE 28 Ca 0.13 -0.23 0.14 0.00 -0.39 0.00 0.00 64.86 64.51 1w02 h ILE 28 Cb -0.01 0.32 -0.08 0.00 -3.07 0.00 0.00 36.82 33.98 1w02 h ILE 28 CO -0.02 0.02 0.59 0.58 -0.69 0.00 0.00 178.15 178.63 1w02 h VAL 29 N -1.05 0.84 0.00 1.67 2.07 -0.96 0.45 116.25 119.27 1w02 h VAL 29 Ca -0.09 -0.26 -0.05 0.00 0.82 0.00 0.00 66.70 67.11 1w02 h VAL 29 Cb 0.71 0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 1w02 h VAL 29 CO 0.15 0.14 -0.26 -0.61 0.02 0.00 0.00 177.57 177.01 1w02 h GLN 30 N 0.76 0.00 0.00 1.57 5.75 -1.07 -1.98 115.11 120.15 1w02 h GLN 30 Ca 0.47 0.00 -0.09 0.00 -0.15 0.00 0.00 58.65 58.89 1w02 h GLN 30 Cb 0.69 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.23 1w02 h GLN 30 CO -0.23 0.26 -0.41 0.52 -2.65 0.00 0.00 178.83 176.32 1w02 h MET 31 N 0.00 0.00 -7.03 1.69 2.86 -0.54 -3.44 114.93 108.48 1w02 h MET 31 Ca -0.00 0.00 -0.45 0.00 -2.06 0.00 0.00 59.70 57.19 1w02 h MET 31 Cb 0.57 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.21 1w02 h MET 31 CO 0.03 0.41 0.34 0.71 1.06 0.00 0.00 176.91 179.47 1w02 s TYR 32 N -4.07 3.37 0.64 -0.22 2.02 -0.74 -1.60 117.35 116.74 1w02 s TYR 32 Ca -0.02 1.64 -0.16 0.00 -0.37 0.00 0.00 57.07 58.16 1w02 s TYR 32 Cb 0.14 -2.87 -0.01 0.00 -0.40 0.00 0.00 41.96 38.82 1w02 s TYR 32 CO 0.73 -0.08 1.11 0.00 -1.57 0.00 0.00 175.55 175.74 1w02 s ALA 33 N -2.06 2.51 0.57 3.71 0.00 0.52 -4.74 121.76 122.27 1w02 s ALA 33 Ca 0.60 0.57 0.28 0.00 0.00 0.00 0.00 51.96 53.41 1w02 s ALA 33 Cb -0.11 -3.32 1.49 0.00 0.00 0.00 0.00 23.12 21.18 1w02 s ALA 33 CO 0.15 -1.19 1.96 0.38 0.00 0.00 0.00 175.76 177.06 1w02 h ASP 34 N 0.19 0.00 -0.01 0.00 2.03 -1.91 -1.26 116.42 115.46 1w02 h ASP 34 Ca -0.47 0.00 -0.00 0.00 -0.73 0.00 0.00 57.03 55.83 1w02 h ASP 34 Cb 1.25 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 39.75 1w02 h ASP 34 CO 0.55 0.00 -0.15 -0.90 -1.03 0.00 0.00 179.24 177.71 1w02 n ASP 35 N -3.94 2.20 -4.63 4.15 5.75 -1.26 -1.94 116.55 116.88 1w02 n ASP 35 Ca 0.08 -3.34 -0.34 0.00 -0.01 0.00 0.00 54.79 51.19 1w02 n ASP 35 Cb 0.62 -0.46 0.12 0.00 -1.03 0.00 0.00 41.12 40.37 1w02 n ASP 35 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1w02 n ALA 36 N -1.32 -0.58 -2.51 2.12 0.00 -0.48 -4.14 120.51 113.60 1w02 n ALA 36 Ca 0.17 -0.37 -0.25 0.00 0.00 0.00 0.00 53.44 52.99 1w02 n ALA 36 Cb 0.67 -2.14 -0.10 0.00 0.00 0.00 0.00 19.45 17.88 1w02 n ALA 36 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1w02 s THR 37 N -2.17 2.81 -0.09 0.00 -4.23 -0.76 -0.75 115.64 110.45 1w02 s THR 37 Ca 0.70 -2.00 -0.06 0.00 -1.18 0.00 0.00 61.69 59.15 1w02 s THR 37 Cb -0.28 -2.42 0.03 0.00 1.34 0.00 0.00 72.50 71.17 1w02 s THR 37 CO 0.54 -0.23 0.21 -0.69 -0.54 0.00 0.00 174.62 173.92 1w02 s VAL 38 N -2.00 -0.02 -0.27 2.29 1.01 -0.37 -2.64 120.40 118.40 1w02 s VAL 38 Ca 0.26 0.07 0.00 0.00 0.00 0.00 0.00 61.98 62.31 1w02 s VAL 38 Cb -0.07 -0.32 0.08 0.00 0.00 0.00 0.00 36.38 36.07 1w02 s VAL 38 CO 0.14 0.03 0.02 -1.61 0.00 0.00 0.00 175.10 173.68 1w02 s GLU 39 N 0.63 1.20 -0.26 2.72 2.02 -0.76 -0.52 118.70 123.74 1w02 s GLU 39 Ca -0.04 -1.09 -0.02 0.00 0.02 0.00 0.00 54.97 53.84 1w02 s GLU 39 Cb -0.06 -2.45 0.13 0.00 0.10 0.00 0.00 34.13 31.85 1w02 s GLU 39 CO -0.03 -0.78 0.30 0.34 0.02 0.00 0.00 175.26 175.11 1w02 s ASP 40 N 1.44 1.24 0.39 -0.19 -1.08 -1.26 -0.53 116.67 116.67 1w02 s ASP 40 Ca 0.02 -0.41 -0.24 0.00 -0.52 0.00 0.00 52.55 51.41 1w02 s ASP 40 Cb -0.18 0.63 -0.09 0.00 -1.46 0.00 0.00 42.92 41.82 1w02 s ASP 40 CO -0.12 -0.35 1.01 -2.16 0.52 0.00 0.00 175.17 174.06 1w02 s PRO 41 N 2.40 4.25 -0.18 4.34 0.04 -1.26 -4.93 135.00 139.66 1w02 s PRO 41 Ca 0.09 1.41 -0.40 0.00 0.04 0.00 0.00 61.00 62.15 1w02 s PRO 41 Cb -0.15 -2.53 -0.17 0.00 0.04 0.00 0.00 34.50 31.70 1w02 s PRO 41 CO -0.24 -0.05 1.58 0.34 0.04 0.00 0.00 177.00 178.67 1w02 n PHE 42 N -0.04 1.80 0.00 0.56 7.35 0.27 -2.36 117.46 125.04 1w02 n PHE 42 Ca 0.05 0.64 0.00 0.00 -0.76 0.00 0.00 57.45 57.38 1w02 n PHE 42 Cb 0.50 -2.38 0.00 0.00 0.35 0.00 0.00 39.48 37.95 1w02 n PHE 42 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1w02 n GLY 43 N 3.56 0.97 2.71 7.13 0.00 -1.26 -4.96 105.19 113.34 1w02 n GLY 43 Ca 0.24 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.21 1w02 n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1w02 n GLN 44 N -1.02 0.41 -4.21 1.61 -0.00 -0.99 -5.00 117.38 108.17 1w02 n GLN 44 Ca 0.00 -1.31 -0.12 0.00 -0.00 0.00 0.00 57.00 55.57 1w02 n GLN 44 Cb 0.00 -0.80 -0.10 0.00 -0.00 0.00 0.00 30.24 29.34 1w02 n GLN 44 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.06 175.81 1w02 s PRO 45 N 0.62 1.08 0.10 2.61 0.04 -1.26 -4.69 135.00 133.50 1w02 s PRO 45 Ca 0.28 -1.53 -0.31 0.00 0.04 0.00 0.00 61.00 59.49 1w02 s PRO 45 Cb 0.16 -0.07 -0.09 0.00 0.04 0.00 0.00 34.50 34.54 1w02 s PRO 45 CO -0.13 -0.20 1.60 -1.25 0.04 0.00 0.00 177.00 177.06 1w02 s PRO 46 N -3.98 4.21 0.16 0.56 0.04 -1.26 -4.72 135.00 130.02 1w02 s PRO 46 Ca 0.26 2.32 0.00 0.00 0.04 0.00 0.00 61.00 63.62 1w02 s PRO 46 Cb 0.07 -3.42 -0.04 0.00 0.04 0.00 0.00 34.50 31.15 1w02 s PRO 46 CO 0.04 -0.67 0.33 0.96 0.04 0.00 0.00 177.00 177.71 1w02 s ILE 47 N 2.02 5.26 -0.02 0.56 -4.36 0.33 -4.88 121.20 120.12 1w02 s ILE 47 Ca 0.72 -0.46 0.03 0.00 -0.26 0.00 0.00 60.65 60.68 1w02 s ILE 47 Cb -0.41 -3.72 -0.00 0.00 1.25 0.00 0.00 42.46 39.58 1w02 s ILE 47 CO 0.32 -0.10 -0.10 -2.28 0.24 0.00 0.00 174.94 173.02 1w02 s HIS 48 N -1.77 1.00 0.00 1.37 2.46 -1.26 -1.24 115.29 115.84 1w02 s HIS 48 Ca 0.37 -0.23 0.00 0.00 0.47 0.00 0.00 55.06 55.66 1w02 s HIS 48 Cb -0.11 -0.69 0.00 0.00 -0.13 0.00 0.00 32.58 31.65 1w02 s HIS 48 CO 0.28 -0.08 0.00 0.41 -2.47 0.00 0.00 174.74 172.88 1w02 n GLY 49 N 3.15 -1.55 0.30 1.59 0.00 0.08 -4.33 105.19 104.43 1w02 n GLY 49 Ca -0.17 -1.47 0.10 0.00 0.00 0.00 0.00 46.02 44.48 1w02 n GLY 49 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1w02 h ARG 50 N 0.00 0.13 -0.06 1.61 3.08 -1.62 -1.02 114.38 116.49 1w02 h ARG 50 Ca 0.00 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 1w02 h ARG 50 Cb 0.00 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.02 1w02 h ARG 50 CO 0.00 0.08 -0.00 1.49 -1.07 0.00 0.00 179.97 180.47 1w02 h GLU 51 N 0.13 0.11 -0.14 0.04 4.81 -1.87 0.05 114.58 117.72 1w02 h GLU 51 Ca 0.10 -0.04 -0.12 0.00 -0.13 0.00 0.00 59.36 59.17 1w02 h GLU 51 Cb 0.23 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.58 1w02 h GLU 51 CO -0.01 0.40 -0.45 1.96 -0.73 0.00 0.00 179.01 180.18 1w02 h GLN 52 N -0.19 0.34 -0.47 1.92 4.20 -1.69 -1.84 115.11 117.39 1w02 h GLN 52 Ca 0.02 -0.18 -0.13 0.00 0.06 0.00 0.00 58.65 58.42 1w02 h GLN 52 Cb 0.35 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.13 1w02 h GLN 52 CO 0.00 0.72 -0.23 0.82 -0.67 0.00 0.00 178.83 179.48 1w02 h ILE 53 N 0.27 1.27 -0.64 2.54 2.04 -1.14 -0.55 117.51 121.31 1w02 h ILE 53 Ca 0.02 -1.39 -0.05 0.00 1.00 0.00 0.00 64.86 64.44 1w02 h ILE 53 Cb 0.90 1.16 -0.03 0.00 -0.74 0.00 0.00 36.82 38.11 1w02 h ILE 53 CO 0.07 0.48 0.22 0.00 0.00 0.00 0.00 178.15 178.92 1w02 h ALA 54 N 0.86 0.84 -0.53 1.87 0.00 -0.82 -1.29 119.26 120.18 1w02 h ALA 54 Ca 0.11 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.74 1w02 h ALA 54 Cb 0.81 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 1w02 h ALA 54 CO 0.07 0.49 0.02 0.00 0.00 0.00 0.00 179.25 179.83 1w02 h ALA 55 N 1.08 1.04 0.35 0.00 0.00 -1.10 -0.26 119.26 120.38 1w02 h ALA 55 Ca 0.21 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1w02 h ALA 55 Cb 0.27 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1w02 h ALA 55 CO -0.01 0.60 -0.17 0.35 0.00 0.00 0.00 179.25 180.02 1w02 h PHE 56 N 0.82 -0.44 -0.64 0.00 3.57 -0.60 -0.93 116.94 118.71 1w02 h PHE 56 Ca 0.16 -0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.56 1w02 h PHE 56 Cb 0.47 0.15 -0.02 0.00 2.79 0.00 0.00 35.95 39.33 1w02 h PHE 56 CO 0.03 -0.23 0.06 1.88 -2.23 0.00 0.00 178.31 177.81 1w02 h TYR 57 N -0.54 1.18 -0.13 0.41 0.05 -1.15 -1.00 116.97 115.79 1w02 h TYR 57 Ca -0.05 -0.18 -0.04 0.00 0.05 0.00 0.00 58.73 58.51 1w02 h TYR 57 Cb 0.40 -0.32 -0.01 0.00 1.01 0.00 0.00 36.73 37.82 1w02 h TYR 57 CO -0.04 1.00 -0.10 -0.09 -1.05 0.00 0.00 178.16 177.89 1w02 h ARG 58 N 1.01 0.19 -0.30 4.88 2.43 -1.02 0.41 114.38 121.99 1w02 h ARG 58 Ca 0.19 -0.04 -0.08 0.00 -0.81 0.00 0.00 59.98 59.24 1w02 h ARG 58 Cb 0.49 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.01 1w02 h ARG 58 CO 0.02 0.30 -0.12 0.37 -1.51 0.00 0.00 179.97 179.03 1w02 h GLN 59 N 0.19 0.62 0.02 0.20 5.75 -0.55 -3.23 115.11 118.10 1w02 h GLN 59 Ca 0.04 -0.26 -0.20 0.00 -0.15 0.00 0.00 58.65 58.08 1w02 h GLN 59 Cb 0.30 -0.02 -0.02 0.00 1.07 0.00 0.00 27.48 28.81 1w02 h GLN 59 CO 0.02 0.83 -0.93 0.78 -2.65 0.00 0.00 178.83 176.88 1w02 h GLY 60 N 0.37 0.11 -4.76 2.39 0.00 -0.32 -3.51 103.07 97.35 1w02 h GLY 60 Ca 0.07 -0.22 -0.69 0.00 0.00 0.00 0.00 47.33 46.49 1w02 h GLY 60 CO 0.04 0.19 -0.80 1.08 0.00 0.00 0.00 176.54 177.06 1w02 s LEU 61 N -7.13 2.58 0.00 3.11 1.43 0.14 -4.98 118.68 113.82 1w02 s LEU 61 Ca -0.01 -0.29 0.00 0.00 -1.03 0.00 0.00 54.13 52.80 1w02 s LEU 61 Cb 0.10 -1.51 0.00 0.00 0.03 0.00 0.00 46.19 44.81 1w02 s LEU 61 CO 0.82 0.32 0.00 1.17 0.23 0.00 0.00 176.35 178.89 1w02 n LYS 65 N 2.18 0.00 -3.79 1.70 4.81 -1.26 -4.89 118.16 116.90 1w02 n LYS 65 Ca -0.17 0.00 -0.13 0.00 -0.87 0.00 0.00 58.31 57.14 1w02 n LYS 65 Cb 0.52 0.00 -0.14 0.00 0.02 0.00 0.00 35.03 35.43 1w02 n LYS 65 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1w02 s VAL 66 N 0.00 -0.03 0.03 3.15 1.01 -1.26 -4.78 120.40 118.52 1w02 s VAL 66 Ca 0.00 0.11 0.04 0.00 0.00 0.00 0.00 61.98 62.12 1w02 s VAL 66 Cb 0.00 -0.16 -0.02 0.00 0.00 0.00 0.00 36.38 36.20 1w02 s VAL 66 CO 0.00 0.04 -0.11 0.00 0.00 0.00 0.00 175.10 175.03 1w02 s ARG 67 N 0.65 0.79 -0.00 2.72 1.70 -1.24 -4.77 118.95 118.80 1w02 s ARG 67 Ca -0.05 -0.62 -0.05 0.00 -0.47 0.00 0.00 55.73 54.54 1w02 s ARG 67 Cb -0.07 -0.75 -0.00 0.00 -0.57 0.00 0.00 34.95 33.56 1w02 s ARG 67 CO -0.03 0.19 0.10 0.00 -1.08 0.00 0.00 175.30 174.48 1w02 s ALA 68 N -0.74 -0.23 0.05 7.88 0.00 -1.26 -0.03 121.76 127.43 1w02 s ALA 68 Ca 0.00 -0.16 -0.19 0.00 0.00 0.00 0.00 51.96 51.62 1w02 s ALA 68 Cb -0.07 0.07 0.04 0.00 0.00 0.00 0.00 23.12 23.16 1w02 s ALA 68 CO 0.01 -0.17 0.43 0.00 0.00 0.00 0.00 175.76 176.02 1w02 s LEU 70 N -2.02 4.44 0.00 0.00 1.43 -1.26 -1.31 118.68 119.96 1w02 s LEU 70 Ca -0.05 2.43 0.05 0.00 -1.03 0.00 0.00 54.13 55.53 1w02 s LEU 70 Cb -0.01 -3.62 0.12 0.00 0.03 0.00 0.00 46.19 42.71 1w02 s LEU 70 CO -0.03 -0.45 1.01 0.35 0.23 0.00 0.00 176.35 177.46 1w02 n THR 71 N 1.95 0.73 -3.57 5.49 -2.24 -0.96 -4.90 114.28 110.79 1w02 n THR 71 Ca 0.03 -0.87 -0.05 0.00 -2.27 0.00 0.00 64.05 60.89 1w02 n THR 71 Cb 0.43 0.66 -0.02 0.00 -2.10 0.00 0.00 70.33 69.31 1w02 n THR 71 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1w02 s GLY 72 N -0.86 -0.36 0.72 3.38 0.00 -1.25 -4.96 107.32 104.00 1w02 s GLY 72 Ca 0.10 1.26 -0.13 0.00 0.00 0.00 0.00 44.72 45.96 1w02 s GLY 72 CO 0.08 0.41 1.10 2.56 0.00 0.00 0.00 173.10 177.25 1w02 s PRO 73 N -2.70 2.46 0.14 2.90 0.04 -1.26 -4.49 135.00 132.08 1w02 s PRO 73 Ca 0.08 1.30 -0.30 0.00 0.04 0.00 0.00 61.00 62.12 1w02 s PRO 73 Cb -0.01 -1.91 -0.07 0.00 0.04 0.00 0.00 34.50 32.55 1w02 s PRO 73 CO -0.06 -1.50 1.13 0.08 0.04 0.00 0.00 177.00 176.69 1w02 s VAL 74 N -2.62 3.93 -0.20 -0.36 1.01 -1.26 -4.58 120.40 116.31 1w02 s VAL 74 Ca 0.64 1.55 -0.12 0.00 0.00 0.00 0.00 61.98 64.06 1w02 s VAL 74 Cb -0.19 -3.99 -0.05 0.00 0.00 0.00 0.00 36.38 32.15 1w02 s VAL 74 CO 0.49 0.22 0.23 -0.13 0.00 0.00 0.00 175.10 175.91 1w02 s ARG 75 N 0.12 4.16 0.11 2.72 3.00 0.16 -4.89 118.95 124.34 1w02 s ARG 75 Ca 0.53 -0.08 0.06 0.00 0.00 0.00 0.00 55.73 56.23 1w02 s ARG 75 Cb -0.29 -3.48 -0.04 0.00 0.00 0.00 0.00 34.95 31.14 1w02 s ARG 75 CO 0.33 0.14 -0.15 0.00 0.00 0.00 0.00 175.30 175.63 1w02 s ALA 76 N 0.80 1.48 0.00 2.13 0.00 -1.26 -0.46 121.76 124.44 1w02 s ALA 76 Ca 0.12 -1.25 0.00 0.00 0.00 0.00 0.00 51.96 50.83 1w02 s ALA 76 Cb -0.13 -0.09 0.00 0.00 0.00 0.00 0.00 23.12 22.90 1w02 s ALA 76 CO 0.03 0.13 0.00 -1.13 0.00 0.00 0.00 175.76 174.80 1w02 n SER 77 N 0.69 0.57 -0.39 0.00 3.41 -0.56 -4.99 113.62 112.34 1w02 n SER 77 Ca -0.17 -0.75 0.06 0.00 -0.26 0.00 0.00 58.87 57.75 1w02 n SER 77 Cb 0.56 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.55 1w02 n SER 77 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1w02 n HIS 78 N -0.54 0.00 -1.77 7.33 8.25 -1.26 -3.97 115.22 123.26 1w02 n HIS 78 Ca 0.00 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.16 1w02 n HIS 78 Cb 0.00 0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.15 1w02 n HIS 78 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1w02 n ASN 79 N 0.39 6.28 -1.43 0.41 6.94 -1.26 -4.88 115.26 121.70 1w02 n ASN 79 Ca 0.06 -3.77 -0.14 0.00 -0.02 0.00 0.00 54.58 50.71 1w02 n ASN 79 Cb 0.27 -0.68 -0.02 0.00 -2.36 0.00 0.00 39.78 36.98 1w02 n ASN 79 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1w02 n GLY 80 N -0.76 0.31 3.57 4.83 0.00 -1.26 -4.86 105.19 107.03 1w02 n GLY 80 Ca 0.52 -0.32 -0.24 0.00 0.00 0.00 0.00 46.02 45.98 1w02 n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1w02 s GLY 82 N -3.49 -0.49 -0.00 0.00 0.00 -0.14 -1.50 107.32 101.69 1w02 s GLY 82 Ca 0.30 1.07 -0.06 0.00 0.00 0.00 0.00 44.72 46.03 1w02 s GLY 82 CO 0.17 0.48 0.11 0.00 0.00 0.00 0.00 173.10 173.87 1w02 s ALA 83 N -2.70 -0.25 -0.10 3.20 0.00 0.40 0.35 121.76 122.65 1w02 s ALA 83 Ca 0.01 -0.13 -0.23 0.00 0.00 0.00 0.00 51.96 51.61 1w02 s ALA 83 Cb -0.01 0.06 0.05 0.00 0.00 0.00 0.00 23.12 23.23 1w02 s ALA 83 CO -0.06 -0.18 0.54 0.00 0.00 0.00 0.00 175.76 176.07 1w02 s MET 84 N -1.15 0.82 0.02 0.00 0.23 -0.70 0.40 119.30 118.91 1w02 s MET 84 Ca -0.12 0.32 -0.06 0.00 -1.03 0.00 0.00 55.69 54.80 1w02 s MET 84 Cb -0.07 0.39 -0.05 0.00 -1.53 0.00 0.00 34.83 33.57 1w02 s MET 84 CO 0.01 -0.21 0.27 -1.25 -2.03 0.00 0.00 175.02 171.81 1w02 s PRO 85 N -0.71 3.57 0.29 3.16 0.04 -1.26 -2.07 135.00 138.02 1w02 s PRO 85 Ca -0.08 -0.10 -0.20 0.00 0.04 0.00 0.00 61.00 60.66 1w02 s PRO 85 Cb -0.03 -3.06 0.02 0.00 0.04 0.00 0.00 34.50 31.47 1w02 s PRO 85 CO 0.05 0.64 0.71 -0.59 0.04 0.00 0.00 177.00 177.85 1w02 s PHE 86 N -1.33 -0.11 0.01 0.56 -0.71 -0.13 -2.27 117.98 114.00 1w02 s PHE 86 Ca 0.29 -0.37 0.02 0.00 -1.04 0.00 0.00 56.93 55.82 1w02 s PHE 86 Cb -0.13 0.69 -0.01 0.00 -1.21 0.00 0.00 43.02 42.36 1w02 s PHE 86 CO 0.17 -1.26 -0.06 0.50 -1.34 0.00 0.00 175.22 173.23 1w02 s ARG 87 N -3.73 0.42 -0.05 1.99 3.52 -0.43 -0.50 118.95 120.18 1w02 s ARG 87 Ca 0.12 -0.33 0.05 0.00 -0.13 0.00 0.00 55.73 55.45 1w02 s ARG 87 Cb -0.06 -0.35 -0.02 0.00 -1.56 0.00 0.00 34.95 32.97 1w02 s ARG 87 CO 0.08 0.09 -0.21 0.08 -0.81 0.00 0.00 175.30 174.52 1w02 s VAL 88 N -0.46 2.44 -0.34 7.11 1.01 -0.59 -1.34 120.40 128.23 1w02 s VAL 88 Ca -0.01 -0.94 0.03 0.00 0.00 0.00 0.00 61.98 61.05 1w02 s VAL 88 Cb -0.04 -1.91 0.10 0.00 0.00 0.00 0.00 36.38 34.53 1w02 s VAL 88 CO -0.00 0.58 0.06 -1.61 0.00 0.00 0.00 175.10 174.13 1w02 s GLU 89 N -0.43 1.66 0.00 2.72 2.02 0.96 -0.73 118.70 124.89 1w02 s GLU 89 Ca 0.04 -1.81 0.00 0.00 0.02 0.00 0.00 54.97 53.22 1w02 s GLU 89 Cb -0.12 -3.25 0.00 0.00 0.10 0.00 0.00 34.13 30.86 1w02 s GLU 89 CO 0.01 -0.93 0.00 0.00 0.02 0.00 0.00 175.26 174.37 1w02 n MET 90 N 4.34 3.73 -4.03 1.61 0.00 0.01 -3.61 117.12 119.16 1w02 n MET 90 Ca 0.01 0.00 -0.09 0.00 0.00 0.00 0.00 57.70 57.62 1w02 n MET 90 Cb 0.42 0.00 -0.11 0.00 0.00 0.00 0.00 33.22 33.53 1w02 n MET 90 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 1w02 s VAL 91 N 2.54 0.24 -0.41 3.17 0.11 -1.26 -0.35 120.40 124.44 1w02 s VAL 91 Ca 0.00 -1.21 -0.13 0.00 -2.93 0.00 0.00 61.98 57.70 1w02 s VAL 91 Cb 0.00 -0.70 -0.13 0.00 -1.53 0.00 0.00 36.38 34.01 1w02 s VAL 91 CO 0.00 -0.62 1.63 -0.81 -3.33 0.00 0.00 175.10 171.96 1w02 n PRO 96 N 1.12 0.88 -3.78 1.54 -0.04 -1.26 -5.12 135.00 128.34 1w02 n PRO 96 Ca -0.21 -1.16 -0.25 0.00 -0.04 0.00 0.00 63.50 61.85 1w02 n PRO 96 Cb 0.57 -2.43 -0.02 0.00 -0.04 0.00 0.00 33.50 31.57 1w02 n PRO 96 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1w02 s ALA 98 N -1.94 1.01 -0.08 0.00 0.00 -0.70 -0.81 121.76 119.24 1w02 s ALA 98 Ca 0.36 -0.78 -0.01 0.00 0.00 0.00 0.00 51.96 51.54 1w02 s ALA 98 Cb -0.10 -0.13 0.03 0.00 0.00 0.00 0.00 23.12 22.91 1w02 s ALA 98 CO 0.30 0.17 -0.03 -1.17 0.00 0.00 0.00 175.76 175.03 1w02 s LEU 99 N -1.18 0.91 -0.04 0.00 2.96 0.09 -0.25 118.68 121.17 1w02 s LEU 99 Ca -0.01 -0.16 -0.19 0.00 -0.22 0.00 0.00 54.13 53.55 1w02 s LEU 99 Cb -0.08 -0.57 -0.05 0.00 0.50 0.00 0.00 46.19 45.99 1w02 s LEU 99 CO 0.01 -0.14 0.53 -1.81 -1.32 0.00 0.00 176.35 173.62 1w02 s ASP 100 N 1.70 6.87 0.02 3.68 1.01 -0.92 -1.54 116.67 127.47 1w02 s ASP 100 Ca 0.02 1.03 -0.05 0.00 0.71 0.00 0.00 52.55 54.26 1w02 s ASP 100 Cb -0.13 -2.33 -0.01 0.00 1.01 0.00 0.00 42.92 41.47 1w02 s ASP 100 CO -0.05 0.10 0.09 -0.69 0.21 0.00 0.00 175.17 174.83 1w02 s VAL 101 N -0.07 0.10 -0.07 -1.27 1.01 0.35 -4.77 120.40 115.68 1w02 s VAL 101 Ca 0.29 -0.86 0.03 0.00 0.00 0.00 0.00 61.98 61.43 1w02 s VAL 101 Cb -0.17 -0.54 0.01 0.00 0.00 0.00 0.00 36.38 35.68 1w02 s VAL 101 CO 0.15 -0.47 -0.15 -0.63 0.00 0.00 0.00 175.10 173.99 1w02 s ILE 102 N -1.77 1.36 0.03 2.22 1.01 -0.98 -0.95 121.20 122.12 1w02 s ILE 102 Ca -0.12 -0.61 0.05 0.00 0.00 0.00 0.00 60.65 59.97 1w02 s ILE 102 Cb -0.06 -1.22 -0.03 0.00 0.01 0.00 0.00 42.46 41.16 1w02 s ILE 102 CO -0.01 0.40 -0.11 -0.76 0.00 0.00 0.00 174.94 174.47 1w02 s LEU 103 N 0.56 2.95 -0.11 2.97 1.43 -0.88 0.12 118.68 125.73 1w02 s LEU 103 Ca -0.15 -0.28 0.02 0.00 -1.03 0.00 0.00 54.13 52.69 1w02 s LEU 103 Cb -0.16 -1.72 0.01 0.00 0.03 0.00 0.00 46.19 44.35 1w02 s LEU 103 CO 0.05 0.26 -0.16 -0.69 0.23 0.00 0.00 176.35 176.04 1w02 s VAL 104 N -1.01 1.55 0.05 -1.59 1.01 -0.20 -1.72 120.40 118.49 1w02 s VAL 104 Ca 0.17 -0.67 0.06 0.00 0.00 0.00 0.00 61.98 61.54 1w02 s VAL 104 Cb -0.11 -1.40 -0.02 0.00 0.00 0.00 0.00 36.38 34.84 1w02 s VAL 104 CO 0.08 0.45 -0.17 -0.04 0.00 0.00 0.00 175.10 175.42 1w02 s MET 105 N 0.94 1.11 -0.11 2.72 -1.94 0.15 -1.17 119.30 121.00 1w02 s MET 105 Ca -0.07 -0.87 0.03 0.00 -1.71 0.00 0.00 55.69 53.07 1w02 s MET 105 Cb -0.15 -1.18 -0.00 0.00 2.01 0.00 0.00 34.83 35.51 1w02 s MET 105 CO -0.01 0.29 -0.22 0.50 -0.01 0.00 0.00 175.02 175.57 1w02 s ARG 106 N -1.25 3.09 0.25 2.03 3.52 -0.53 -0.97 118.95 125.09 1w02 s ARG 106 Ca 0.04 -0.85 0.05 0.00 -0.13 0.00 0.00 55.73 54.84 1w02 s ARG 106 Cb -0.08 -2.36 -0.03 0.00 -1.56 0.00 0.00 34.95 30.91 1w02 s ARG 106 CO 0.02 0.15 0.35 -0.06 -0.81 0.00 0.00 175.30 174.95 1w02 s PHE 107 N 0.42 3.37 0.56 5.12 0.40 0.60 0.20 117.98 128.65 1w02 s PHE 107 Ca -0.16 -0.05 0.08 0.00 -0.60 0.00 0.00 56.93 56.20 1w02 s PHE 107 Cb -0.17 -1.60 0.07 0.00 0.51 0.00 0.00 43.02 41.83 1w02 s PHE 107 CO 0.07 0.40 0.66 0.16 0.70 0.00 0.00 175.22 177.21 1w02 s ASP 108 N -3.98 4.94 0.00 1.36 1.47 -0.35 -4.76 116.67 115.34 1w02 s ASP 108 Ca 0.35 -0.99 0.02 0.00 1.18 0.00 0.00 52.55 53.11 1w02 s ASP 108 Cb -0.09 0.34 0.09 0.00 -0.34 0.00 0.00 42.92 42.92 1w02 s ASP 108 CO 0.29 -1.26 0.93 -1.84 0.68 0.00 0.00 175.17 173.96 1w02 n GLU 109 N -2.08 0.02 -0.18 2.11 0.00 -1.26 -0.35 120.64 118.89 1w02 n GLU 109 Ca 0.10 0.34 0.09 0.00 0.00 0.00 0.00 57.16 57.69 1w02 n GLU 109 Cb 0.62 -1.50 0.19 0.00 0.00 0.00 0.00 31.44 30.75 1w02 n GLU 109 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 1w02 n HIS 110 N -1.36 0.48 -1.10 -1.84 8.25 -1.26 -3.13 115.22 115.25 1w02 n HIS 110 Ca 0.01 -0.31 -0.03 0.00 -0.26 0.00 0.00 57.72 57.12 1w02 n HIS 110 Cb 0.02 -0.01 -0.01 0.00 1.12 0.00 0.00 29.99 31.10 1w02 n HIS 110 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1w02 n GLY 111 N 1.11 0.63 3.61 -1.41 0.00 0.52 -4.91 105.19 104.74 1w02 n GLY 111 Ca 0.16 -0.45 -0.32 0.00 0.00 0.00 0.00 46.02 45.41 1w02 n GLY 111 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1w02 s ARG 112 N -1.67 2.57 0.01 1.61 0.52 -1.26 -4.81 118.95 115.92 1w02 s ARG 112 Ca 0.00 -0.73 -0.32 0.00 -0.52 0.00 0.00 55.73 54.16 1w02 s ARG 112 Cb 0.00 -2.52 -0.11 0.00 0.52 0.00 0.00 34.95 32.84 1w02 s ARG 112 CO 0.00 0.60 1.90 -0.89 0.02 0.00 0.00 175.30 176.93 1w02 n ILE 113 N 1.44 0.59 -0.03 1.52 5.41 -0.63 -1.22 119.36 126.44 1w02 n ILE 113 Ca -0.15 -0.11 -0.21 0.00 1.00 0.00 0.00 62.75 63.29 1w02 n ILE 113 Cb 0.52 -2.08 -0.13 0.00 -0.71 0.00 0.00 39.64 37.24 1w02 n ILE 113 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 176.55 178.22 1w02 n GLN 114 N 6.67 0.72 -3.86 0.38 7.27 0.13 -0.35 117.38 128.35 1w02 n GLN 114 Ca 0.21 0.24 -0.11 0.00 0.07 0.00 0.00 57.00 57.41 1w02 n GLN 114 Cb 0.35 -1.66 -0.10 0.00 2.41 0.00 0.00 30.24 31.25 1w02 n GLN 114 CO 0.00 0.00 0.00 0.95 0.07 0.00 0.00 177.06 178.08 1w02 s THR 115 N -2.54 0.08 -0.10 1.69 -4.23 -1.11 -1.84 115.64 107.59 1w02 s THR 115 Ca -0.26 -0.68 -0.07 0.00 -1.18 0.00 0.00 61.69 59.50 1w02 s THR 115 Cb 0.07 -0.49 0.04 0.00 1.34 0.00 0.00 72.50 73.46 1w02 s THR 115 CO 0.72 -0.38 0.25 -0.32 -0.54 0.00 0.00 174.62 174.35 1w02 s MET 116 N -1.47 0.24 -0.10 3.99 1.75 -1.08 -1.46 119.30 121.17 1w02 s MET 116 Ca -0.14 0.45 0.02 0.00 -1.25 0.00 0.00 55.69 54.78 1w02 s MET 116 Cb -0.07 -0.01 0.01 0.00 2.84 0.00 0.00 34.83 37.60 1w02 s MET 116 CO 0.02 -0.11 -0.17 -0.65 -0.65 0.00 0.00 175.02 173.46 1w02 s GLN 117 N 0.80 2.34 -0.20 4.11 1.11 -0.32 -1.82 119.66 125.68 1w02 s GLN 117 Ca -0.05 -0.62 -0.05 0.00 0.01 0.00 0.00 55.36 54.64 1w02 s GLN 117 Cb -0.07 -1.90 -0.02 0.00 -1.01 0.00 0.00 33.01 30.01 1w02 s GLN 117 CO -0.05 0.02 0.01 0.00 0.01 0.00 0.00 175.29 175.28 1w02 s ALA 118 N 0.73 3.05 -0.23 6.09 0.00 0.31 -1.03 121.76 130.67 1w02 s ALA 118 Ca -0.12 -1.00 -0.07 0.00 0.00 0.00 0.00 51.96 50.78 1w02 s ALA 118 Cb -0.16 -1.80 -0.03 0.00 0.00 0.00 0.00 23.12 21.13 1w02 s ALA 118 CO 0.02 -0.17 0.05 0.71 0.00 0.00 0.00 175.76 176.37 1w02 s TYR 119 N 1.04 3.10 0.00 0.00 1.51 0.12 0.94 117.35 124.06 1w02 s TYR 119 Ca 0.02 -0.36 0.00 0.00 -1.01 0.00 0.00 57.07 55.72 1w02 s TYR 119 Cb -0.14 -2.18 0.00 0.00 -0.11 0.00 0.00 41.96 39.52 1w02 s TYR 119 CO 0.02 -0.26 0.00 -2.67 -1.11 0.00 0.00 175.55 171.52 1w02 n TRP 120 N 4.59 0.00 -3.74 2.71 4.27 -1.26 -2.32 117.44 121.69 1w02 n TRP 120 Ca -0.16 0.00 -0.03 0.00 -3.89 0.00 0.00 57.50 53.42 1w02 n TRP 120 Cb 0.52 0.00 0.02 0.00 -1.36 0.00 0.00 31.31 30.48 1w02 n TRP 120 CO 0.00 0.00 0.00 -1.13 -2.29 0.00 0.00 177.69 174.27 1w02 n SER 121 N 0.00 -1.29 -0.35 -0.67 3.41 -1.26 -4.80 113.62 108.66 1w02 n SER 121 Ca 0.00 -1.71 0.26 0.00 -0.26 0.00 0.00 58.87 57.16 1w02 n SER 121 Cb 0.00 2.10 0.54 0.00 -0.26 0.00 0.00 64.21 66.60 1w02 n SER 121 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1w02 h GLU 122 N 0.00 0.31 0.00 4.33 3.07 -2.01 0.23 114.58 120.51 1w02 h GLU 122 Ca -0.20 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.64 1w02 h GLU 122 Cb 0.86 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 28.70 1w02 h GLU 122 CO 0.27 0.20 0.06 -0.39 -1.40 0.00 0.00 179.01 177.75 1w02 h VAL 123 N 0.32 0.00 -0.43 3.13 -1.51 -2.01 0.12 116.25 115.86 1w02 h VAL 123 Ca 0.64 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 66.11 1w02 h VAL 123 Cb 1.75 0.50 0.00 0.00 -2.13 0.00 0.00 31.29 31.41 1w02 h VAL 123 CO -0.32 0.00 0.00 0.59 -1.23 0.00 0.00 177.57 176.61 1w02 n ASN 124 N -2.32 3.49 -4.88 4.19 4.13 0.81 -4.97 115.26 115.72 1w02 n ASN 124 Ca -0.02 -2.22 -0.34 0.00 1.68 0.00 0.00 54.58 53.69 1w02 n ASN 124 Cb 0.10 -0.37 -0.05 0.00 -1.54 0.00 0.00 39.78 37.92 1w02 n ASN 124 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1w02 s LEU 125 N -1.40 4.33 0.30 3.41 0.20 0.41 -2.18 118.68 123.76 1w02 s LEU 125 Ca 0.34 0.71 0.05 0.00 0.69 0.00 0.00 54.13 55.92 1w02 s LEU 125 Cb 0.20 -3.01 -0.03 0.00 -0.43 0.00 0.00 46.19 42.92 1w02 s LEU 125 CO 0.19 0.16 0.26 -0.44 -0.29 0.00 0.00 176.35 176.22 1w02 s SER 126 N -1.90 1.28 0.00 3.68 0.01 0.65 -4.96 113.70 112.46 1w02 s SER 126 Ca 0.34 -1.66 0.00 0.00 1.31 0.00 0.00 55.95 55.94 1w02 s SER 126 Cb -0.13 0.52 0.00 0.00 0.21 0.00 0.00 66.02 66.62 1w02 s SER 126 CO 0.19 -1.03 0.00 0.55 0.41 0.00 0.00 173.24 173.37 1w02 n VAL 127 N -0.54 0.00 0.00 3.43 3.14 -1.26 -1.73 118.33 121.38 1w02 n VAL 127 Ca 0.06 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.44 1w02 n VAL 127 Cb 0.63 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.41 1w02 n VAL 127 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91