#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1w00 h LEU 3 N 0.00 0.65 -9.70 3.41 6.46 -1.76 -3.33 115.31 111.05 1w00 h LEU 3 Ca 0.00 -0.77 -0.56 0.00 -0.12 0.00 0.00 57.88 56.42 1w00 h LEU 3 Cb 0.00 -0.21 0.09 0.00 -0.73 0.00 0.00 40.66 39.81 1w00 h LEU 3 CO 0.00 1.62 0.66 -2.65 -0.62 0.00 0.00 178.44 177.45 1w00 n PRO 4 N -3.62 2.26 -1.65 5.25 -0.02 -1.26 -4.92 135.00 131.04 1w00 n PRO 4 Ca -0.17 0.80 -0.29 0.00 -2.02 0.00 0.00 63.50 61.82 1w00 n PRO 4 Cb 1.08 -2.48 0.16 0.00 -0.02 0.00 0.00 33.50 32.25 1w00 n PRO 4 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1w00 s THR 5 N -0.35 1.93 0.18 3.45 -4.23 -1.26 -3.74 115.64 111.62 1w00 s THR 5 Ca 0.63 0.00 -0.13 0.00 -1.18 0.00 0.00 61.69 61.01 1w00 s THR 5 Cb -0.58 -2.83 0.08 0.00 1.34 0.00 0.00 72.50 70.50 1w00 s THR 5 CO 0.53 0.00 1.81 0.00 -0.54 0.00 0.00 174.62 176.42 1w00 h ALA 6 N -1.67 0.68 -0.85 3.99 0.00 -1.92 0.11 119.26 119.60 1w00 h ALA 6 Ca -0.47 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.42 1w00 h ALA 6 Cb 1.29 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.90 1w00 h ALA 6 CO 0.49 0.02 0.47 1.96 0.00 0.00 0.00 179.25 182.19 1w00 h GLN 7 N 0.62 1.19 -0.45 0.00 4.20 -1.92 -1.57 115.11 117.17 1w00 h GLN 7 Ca 0.22 -0.14 -0.11 0.00 0.06 0.00 0.00 58.65 58.68 1w00 h GLN 7 Cb 0.04 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 27.57 1w00 h GLN 7 CO -0.10 0.87 -0.14 0.93 -0.67 0.00 0.00 178.83 179.72 1w00 h GLU 8 N 1.19 0.88 -0.32 1.46 5.08 -1.76 -2.01 114.58 119.11 1w00 h GLU 8 Ca 0.30 -0.35 0.05 0.00 -1.00 0.00 0.00 59.36 58.36 1w00 h GLU 8 Cb 0.03 -0.04 -0.05 0.00 0.50 0.00 0.00 28.75 29.18 1w00 h GLU 8 CO -0.05 1.00 0.01 0.28 -1.00 0.00 0.00 179.01 179.25 1w00 h VAL 9 N 0.72 0.78 -0.76 3.13 2.07 -0.43 0.25 116.25 122.01 1w00 h VAL 9 Ca 0.11 -0.04 0.10 0.00 0.82 0.00 0.00 66.70 67.69 1w00 h VAL 9 Cb 0.69 0.66 -0.07 0.00 -1.52 0.00 0.00 31.29 31.05 1w00 h VAL 9 CO 0.05 0.02 0.41 1.56 0.02 0.00 0.00 177.57 179.63 1w00 h GLN 10 N 0.11 0.66 -0.52 1.57 4.20 -1.04 0.25 115.11 120.35 1w00 h GLN 10 Ca 0.15 -0.04 -0.10 0.00 0.06 0.00 0.00 58.65 58.72 1w00 h GLN 10 Cb 0.20 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 27.81 1w00 h GLN 10 CO -0.25 0.44 -0.08 0.78 -0.67 0.00 0.00 178.83 179.06 1w00 h GLY 11 N 0.68 1.05 0.97 3.46 0.00 -0.41 -1.48 103.07 107.35 1w00 h GLY 11 Ca 0.37 -0.83 -0.07 0.00 0.00 0.00 0.00 47.33 46.81 1w00 h GLY 11 CO -0.26 0.76 0.01 1.41 0.00 0.00 0.00 176.54 178.46 1w00 h LEU 12 N 0.83 0.75 -0.65 3.11 3.38 0.11 -1.67 115.31 121.17 1w00 h LEU 12 Ca 0.14 -0.30 -0.15 0.00 0.09 0.00 0.00 57.88 57.66 1w00 h LEU 12 Cb 0.63 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 1w00 h LEU 12 CO 0.04 0.86 -0.64 0.24 0.09 0.00 0.00 178.44 179.03 1w00 h MET 13 N 0.61 0.14 -0.42 1.13 2.86 -0.94 -1.76 114.93 116.55 1w00 h MET 13 Ca 0.13 -0.10 -0.10 0.00 -2.06 0.00 0.00 59.70 57.56 1w00 h MET 13 Cb 0.47 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.14 1w00 h MET 13 CO 0.02 0.73 -0.12 0.00 1.06 0.00 0.00 176.91 178.60 1w00 h ALA 14 N 1.24 0.58 -0.68 6.32 0.00 -1.19 -2.83 119.26 122.71 1w00 h ALA 14 Ca -0.01 -0.34 -0.04 0.00 0.00 0.00 0.00 54.91 54.52 1w00 h ALA 14 Cb 1.15 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.76 1w00 h ALA 14 CO 0.09 0.48 0.25 -0.09 0.00 0.00 0.00 179.25 179.98 1w00 h ARG 15 N 0.64 1.00 -0.12 0.00 2.43 -1.14 -2.63 114.38 114.57 1w00 h ARG 15 Ca 0.10 -0.18 0.03 0.00 -0.81 0.00 0.00 59.98 59.13 1w00 h ARG 15 Cb 0.66 -0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 30.01 1w00 h ARG 15 CO 0.05 0.83 -0.09 -0.92 -1.51 0.00 0.00 179.97 178.33 1w00 h TYR 16 N 0.98 -0.21 -0.87 2.20 3.20 -1.09 -0.46 116.97 120.73 1w00 h TYR 16 Ca 0.23 0.02 0.11 0.00 3.14 0.00 0.00 58.73 62.22 1w00 h TYR 16 Cb 0.22 0.11 -0.08 0.00 1.54 0.00 0.00 36.73 38.52 1w00 h TYR 16 CO 0.02 -0.14 0.50 0.82 -1.64 0.00 0.00 178.16 177.72 1w00 h ILE 17 N -0.09 0.88 -0.78 1.81 1.08 -1.29 -1.03 117.51 118.08 1w00 h ILE 17 Ca 0.08 -0.28 -0.03 0.00 -0.39 0.00 0.00 64.86 64.24 1w00 h ILE 17 Cb 0.21 0.01 -0.04 0.00 -3.07 0.00 0.00 36.82 33.93 1w00 h ILE 17 CO -0.18 0.15 0.35 -0.08 -0.69 0.00 0.00 178.15 177.70 1w00 h GLU 18 N 0.80 1.14 -0.47 2.37 4.57 -0.92 0.19 114.58 122.26 1w00 h GLU 18 Ca 0.43 -0.18 -0.09 0.00 -1.18 0.00 0.00 59.36 58.34 1w00 h GLU 18 Cb 0.44 -0.20 -0.02 0.00 -0.16 0.00 0.00 28.75 28.81 1w00 h GLU 18 CO -0.27 0.90 -0.06 -0.07 -1.18 0.00 0.00 179.01 178.33 1w00 h LEU 19 N 1.12 0.80 -0.50 1.64 3.38 0.02 -0.92 115.31 120.85 1w00 h LEU 19 Ca 0.27 -0.22 -0.15 0.00 0.09 0.00 0.00 57.88 57.86 1w00 h LEU 19 Cb 0.15 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1w00 h LEU 19 CO -0.03 0.90 -0.44 0.58 0.09 0.00 0.00 178.44 179.54 1w00 h VAL 20 N 0.75 1.29 -0.46 1.22 2.07 -0.84 0.27 116.25 120.55 1w00 h VAL 20 Ca 0.13 -1.63 -0.01 0.00 0.82 0.00 0.00 66.70 66.01 1w00 h VAL 20 Cb 0.54 1.54 -0.02 0.00 -1.52 0.00 0.00 31.29 31.83 1w00 h VAL 20 CO 0.03 0.53 0.25 -0.78 0.02 0.00 0.00 177.57 177.62 1w00 h ASP 21 N 0.59 0.58 1.41 0.57 3.58 -0.09 -2.75 116.42 120.31 1w00 h ASP 21 Ca 0.04 -0.09 0.00 0.00 0.42 0.00 0.00 57.03 57.40 1w00 h ASP 21 Cb 1.00 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 41.90 1w00 h ASP 21 CO 0.09 0.50 -0.38 -0.37 -2.88 0.00 0.00 179.24 176.21 1w00 h VAL 22 N 0.60 0.00 -0.04 2.25 -1.51 -1.14 -3.43 116.25 112.98 1w00 h VAL 22 Ca 0.16 -0.79 0.00 0.00 -1.23 0.00 0.00 66.70 64.84 1w00 h VAL 22 Cb 0.06 1.58 0.00 0.00 -2.13 0.00 0.00 31.29 30.79 1w00 h VAL 22 CO -0.03 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 176.92 1w00 n GLY 23 N 1.21 0.51 3.51 5.19 0.00 0.81 -4.98 105.19 111.44 1w00 n GLY 23 Ca 0.03 -0.82 -0.43 0.00 0.00 0.00 0.00 46.02 44.81 1w00 n GLY 23 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1w00 s ASP 24 N -2.92 6.75 0.19 1.61 -1.08 -0.42 -4.84 116.67 115.96 1w00 s ASP 24 Ca 0.00 -2.21 -0.11 0.00 -0.52 0.00 0.00 52.55 49.71 1w00 s ASP 24 Cb 0.00 -2.48 0.18 0.00 -1.46 0.00 0.00 42.92 39.16 1w00 s ASP 24 CO 0.00 -1.12 1.80 0.40 0.52 0.00 0.00 175.17 176.77 1w00 h ILE 25 N 5.74 0.98 -0.33 4.11 2.04 -1.94 -1.59 117.51 126.52 1w00 h ILE 25 Ca 0.26 -0.21 -0.09 0.00 1.00 0.00 0.00 64.86 65.83 1w00 h ILE 25 Cb 0.95 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 37.33 1w00 h ILE 25 CO 1.29 0.11 -0.16 -0.33 0.00 0.00 0.00 178.15 179.07 1w00 h GLU 26 N 0.61 0.59 0.00 2.37 5.08 -1.98 -0.77 114.58 120.49 1w00 h GLU 26 Ca 0.26 -0.19 -0.12 0.00 -1.00 0.00 0.00 59.36 58.30 1w00 h GLU 26 Cb 0.13 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 1w00 h GLU 26 CO -0.16 0.73 -0.57 0.00 -1.00 0.00 0.00 179.01 178.01 1w00 h ALA 27 N 1.30 0.98 -0.14 3.43 0.00 -1.90 -1.74 119.26 121.19 1w00 h ALA 27 Ca 0.09 -0.52 -0.05 0.00 0.00 0.00 0.00 54.91 54.43 1w00 h ALA 27 Cb 0.58 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 1w00 h ALA 27 CO 0.04 0.71 -0.11 0.82 0.00 0.00 0.00 179.25 180.72 1w00 h ILE 28 N 0.00 1.34 -1.00 0.00 2.04 -0.79 -2.94 117.51 116.17 1w00 h ILE 28 Ca -0.01 -1.22 0.04 0.00 1.00 0.00 0.00 64.86 64.68 1w00 h ILE 28 Cb 1.06 1.83 -0.06 0.00 -0.74 0.00 0.00 36.82 38.92 1w00 h ILE 28 CO 0.07 0.36 0.65 0.58 0.00 0.00 0.00 178.15 179.81 1w00 h VAL 29 N -0.04 1.16 0.00 1.67 2.07 -0.99 -1.72 116.25 118.40 1w00 h VAL 29 Ca 0.03 -0.43 -0.05 0.00 0.82 0.00 0.00 66.70 67.07 1w00 h VAL 29 Cb 0.61 -0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.18 1w00 h VAL 29 CO 0.03 0.23 -0.22 -0.61 0.02 0.00 0.00 177.57 177.02 1w00 h GLN 30 N 1.24 0.00 0.00 1.57 5.75 -1.25 -2.15 115.11 120.27 1w00 h GLN 30 Ca 0.40 0.00 -0.03 0.00 -0.15 0.00 0.00 58.65 58.87 1w00 h GLN 30 Cb 0.03 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 28.58 1w00 h GLN 30 CO -0.13 0.22 -0.17 0.52 -2.65 0.00 0.00 178.83 176.62 1w00 h MET 31 N 0.00 0.00 -6.90 1.69 2.86 -1.13 -3.44 114.93 108.02 1w00 h MET 31 Ca -0.00 0.00 -0.48 0.00 -2.06 0.00 0.00 59.70 57.16 1w00 h MET 31 Cb 0.52 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.17 1w00 h MET 31 CO 0.03 0.17 0.19 0.71 1.06 0.00 0.00 176.91 179.07 1w00 s TYR 32 N -4.12 3.41 0.49 -0.22 1.51 -0.81 -1.04 117.35 116.57 1w00 s TYR 32 Ca -0.02 1.27 -0.22 0.00 -1.01 0.00 0.00 57.07 57.09 1w00 s TYR 32 Cb 0.13 -2.60 -0.07 0.00 -0.11 0.00 0.00 41.96 39.31 1w00 s TYR 32 CO 0.61 -0.09 1.17 0.00 -1.11 0.00 0.00 175.55 176.14 1w00 s ALA 33 N -2.25 2.90 0.56 3.71 0.00 0.10 -4.70 121.76 122.08 1w00 s ALA 33 Ca 0.55 0.94 0.31 0.00 0.00 0.00 0.00 51.96 53.77 1w00 s ALA 33 Cb -0.10 -3.39 1.46 0.00 0.00 0.00 0.00 23.12 21.08 1w00 s ALA 33 CO 0.24 -0.75 1.84 0.38 0.00 0.00 0.00 175.76 177.47 1w00 h ASP 34 N 1.81 0.00 -0.19 0.00 3.04 -1.92 0.15 116.42 119.31 1w00 h ASP 34 Ca -0.50 0.00 -0.12 0.00 -3.24 0.00 0.00 57.03 53.18 1w00 h ASP 34 Cb 1.26 0.00 -0.08 0.00 -1.04 0.00 0.00 39.33 39.47 1w00 h ASP 34 CO 0.59 0.00 -0.40 -0.90 -2.04 0.00 0.00 179.24 176.49 1w00 n ASP 35 N -3.97 2.32 -4.68 4.15 5.75 -1.26 -2.35 116.55 116.52 1w00 n ASP 35 Ca 0.16 -3.86 -0.30 0.00 -0.01 0.00 0.00 54.79 50.78 1w00 n ASP 35 Cb 0.92 -0.55 0.16 0.00 -1.03 0.00 0.00 41.12 40.62 1w00 n ASP 35 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1w00 s ALA 36 N -3.29 1.21 0.04 2.12 0.00 0.04 -4.40 121.76 117.48 1w00 s ALA 36 Ca 0.42 0.02 0.08 0.00 0.00 0.00 0.00 51.96 52.48 1w00 s ALA 36 Cb 0.39 -3.24 -0.03 0.00 0.00 0.00 0.00 23.12 20.25 1w00 s ALA 36 CO -0.04 -2.65 -0.24 0.95 0.00 0.00 0.00 175.76 173.78 1w00 s THR 37 N -2.82 1.96 -0.05 0.00 -4.23 -0.50 -1.21 115.64 108.79 1w00 s THR 37 Ca 0.65 -1.28 0.02 0.00 -1.18 0.00 0.00 61.69 59.89 1w00 s THR 37 Cb -0.20 -1.68 0.01 0.00 1.34 0.00 0.00 72.50 71.98 1w00 s THR 37 CO 0.58 0.34 -0.09 -0.69 -0.54 0.00 0.00 174.62 174.22 1w00 s VAL 38 N -0.77 0.88 -0.30 2.29 1.01 -0.72 -1.66 120.40 121.14 1w00 s VAL 38 Ca 0.10 -0.36 0.02 0.00 0.00 0.00 0.00 61.98 61.74 1w00 s VAL 38 Cb -0.09 -0.82 0.09 0.00 0.00 0.00 0.00 36.38 35.55 1w00 s VAL 38 CO 0.02 0.29 0.03 -1.61 0.00 0.00 0.00 175.10 173.83 1w00 s GLU 39 N 0.59 1.33 -0.25 2.72 2.02 -0.45 -1.02 118.70 123.63 1w00 s GLU 39 Ca -0.11 -1.39 -0.02 0.00 0.02 0.00 0.00 54.97 53.48 1w00 s GLU 39 Cb -0.13 -2.68 0.12 0.00 0.10 0.00 0.00 34.13 31.54 1w00 s GLU 39 CO 0.02 -0.85 0.29 0.34 0.02 0.00 0.00 175.26 175.08 1w00 s ASP 40 N 1.25 1.30 0.56 -0.19 -1.08 -1.26 -1.12 116.67 116.12 1w00 s ASP 40 Ca 0.05 -0.40 -0.15 0.00 -0.52 0.00 0.00 52.55 51.53 1w00 s ASP 40 Cb -0.18 0.59 -0.06 0.00 -1.46 0.00 0.00 42.92 41.81 1w00 s ASP 40 CO -0.12 -0.35 1.02 -2.16 0.52 0.00 0.00 175.17 174.07 1w00 s PRO 41 N 2.39 3.66 0.31 4.34 0.04 -1.26 -5.00 135.00 139.47 1w00 s PRO 41 Ca 0.09 1.01 -0.30 0.00 0.04 0.00 0.00 61.00 61.85 1w00 s PRO 41 Cb -0.15 -2.09 -0.12 0.00 0.04 0.00 0.00 34.50 32.19 1w00 s PRO 41 CO -0.23 -0.52 1.53 0.34 0.04 0.00 0.00 177.00 178.16 1w00 n PHE 42 N -1.92 2.75 0.00 0.56 7.35 0.13 -1.81 117.46 124.51 1w00 n PHE 42 Ca 0.07 0.34 0.00 0.00 -0.76 0.00 0.00 57.45 57.10 1w00 n PHE 42 Cb 0.54 -2.55 0.00 0.00 0.35 0.00 0.00 39.48 37.81 1w00 n PHE 42 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1w00 n GLY 43 N 1.72 2.09 3.93 7.13 0.00 -1.26 -4.88 105.19 113.92 1w00 n GLY 43 Ca 0.07 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.83 1w00 n GLY 43 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1w00 s GLN 44 N -0.27 3.50 0.27 1.61 2.00 -0.75 -5.05 119.66 120.97 1w00 s GLN 44 Ca 0.00 -0.40 -0.31 0.00 -2.00 0.00 0.00 55.36 52.66 1w00 s GLN 44 Cb 0.00 -2.84 -0.13 0.00 0.80 0.00 0.00 33.01 30.84 1w00 s GLN 44 CO 0.00 0.39 1.49 -2.30 -0.50 0.00 0.00 175.29 174.38 1w00 n PRO 45 N -0.80 2.34 -2.07 1.67 -0.02 -1.26 -4.77 135.00 130.08 1w00 n PRO 45 Ca -0.05 0.83 -0.38 0.00 -2.02 0.00 0.00 63.50 61.88 1w00 n PRO 45 Cb 0.54 -2.55 0.00 0.00 -0.02 0.00 0.00 33.50 31.48 1w00 n PRO 45 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 1w00 s PRO 46 N -0.47 3.71 -0.09 0.52 0.02 -1.26 -4.81 135.00 132.62 1w00 s PRO 46 Ca 0.66 2.03 -0.03 0.00 0.02 0.00 0.00 61.00 63.68 1w00 s PRO 46 Cb -0.58 -2.52 -0.04 0.00 0.02 0.00 0.00 34.50 31.39 1w00 s PRO 46 CO 0.49 -0.66 0.04 0.96 -0.33 0.00 0.00 177.00 177.50 1w00 s ILE 47 N -1.38 4.63 -0.09 2.83 -4.36 -0.19 -4.91 121.20 117.73 1w00 s ILE 47 Ca 0.62 -0.14 0.01 0.00 -0.26 0.00 0.00 60.65 60.88 1w00 s ILE 47 Cb -0.35 -2.97 -0.02 0.00 1.25 0.00 0.00 42.46 40.36 1w00 s ILE 47 CO 0.43 0.60 -0.11 -1.00 0.24 0.00 0.00 174.94 175.10 1w00 s HIS 48 N -0.94 2.83 0.00 1.37 3.76 -1.26 -1.75 115.29 119.30 1w00 s HIS 48 Ca 0.14 -0.26 0.00 0.00 -0.15 0.00 0.00 55.06 54.80 1w00 s HIS 48 Cb -0.12 -1.74 0.00 0.00 1.11 0.00 0.00 32.58 31.83 1w00 s HIS 48 CO 0.03 0.09 0.00 0.41 -0.85 0.00 0.00 174.74 174.43 1w00 n GLY 49 N 2.74 -2.66 0.26 -2.22 0.00 -0.35 -4.06 105.19 98.90 1w00 n GLY 49 Ca -0.18 -1.39 0.06 0.00 0.00 0.00 0.00 46.02 44.51 1w00 n GLY 49 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1w00 h ARG 50 N 0.00 0.11 -0.01 1.61 3.08 -1.71 -0.93 114.38 116.53 1w00 h ARG 50 Ca 0.00 -0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.04 1w00 h ARG 50 Cb 0.00 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.03 1w00 h ARG 50 CO 0.00 0.14 0.00 1.49 -1.07 0.00 0.00 179.97 180.53 1w00 h GLU 51 N 0.11 0.02 -0.55 0.04 4.81 -1.87 0.20 114.58 117.34 1w00 h GLU 51 Ca 0.03 -0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.17 1w00 h GLU 51 Cb 0.10 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.46 1w00 h GLU 51 CO 0.00 0.30 0.01 1.96 -0.73 0.00 0.00 179.01 180.55 1w00 h GLN 52 N -0.26 0.94 -0.46 1.92 4.20 -1.64 -2.11 115.11 117.70 1w00 h GLN 52 Ca 0.00 -0.27 -0.12 0.00 0.06 0.00 0.00 58.65 58.32 1w00 h GLN 52 Cb 0.29 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.96 1w00 h GLN 52 CO 0.00 0.92 -0.20 0.82 -0.67 0.00 0.00 178.83 179.71 1w00 h ILE 53 N 0.87 1.27 -0.48 2.54 2.04 -1.10 -1.12 117.51 121.53 1w00 h ILE 53 Ca 0.16 -1.34 -0.02 0.00 1.00 0.00 0.00 64.86 64.66 1w00 h ILE 53 Cb 0.50 1.13 -0.02 0.00 -0.74 0.00 0.00 36.82 37.69 1w00 h ILE 53 CO 0.02 0.46 0.21 0.00 0.00 0.00 0.00 178.15 178.84 1w00 h ALA 54 N 0.98 0.62 -0.72 1.87 0.00 -0.37 -0.43 119.26 121.20 1w00 h ALA 54 Ca 0.11 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 1w00 h ALA 54 Cb 0.74 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 1w00 h ALA 54 CO 0.06 0.21 0.21 0.00 0.00 0.00 0.00 179.25 179.73 1w00 h ALA 55 N 1.05 0.95 -0.26 0.00 0.00 -1.25 -0.53 119.26 119.22 1w00 h ALA 55 Ca 0.16 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1w00 h ALA 55 Cb 0.16 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1w00 h ALA 55 CO -0.02 0.65 0.17 0.35 0.00 0.00 0.00 179.25 180.40 1w00 h PHE 56 N 1.08 0.32 -0.00 0.00 3.57 -0.76 -1.37 116.94 119.77 1w00 h PHE 56 Ca 0.23 0.01 -0.12 0.00 3.53 0.00 0.00 57.97 61.62 1w00 h PHE 56 Cb 0.33 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 38.94 1w00 h PHE 56 CO 0.03 0.21 -0.58 1.88 -2.23 0.00 0.00 178.31 177.62 1w00 h TYR 57 N 0.35 0.02 -0.32 0.41 0.05 -0.89 -2.66 116.97 113.92 1w00 h TYR 57 Ca 0.09 -0.01 -0.15 0.00 0.05 0.00 0.00 58.73 58.72 1w00 h TYR 57 Cb -0.04 -0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.69 1w00 h TYR 57 CO -0.06 0.59 -0.39 -0.09 -1.05 0.00 0.00 178.16 177.16 1w00 h ARG 58 N 0.01 0.78 -0.71 4.88 2.43 -0.87 0.27 114.38 121.16 1w00 h ARG 58 Ca -0.01 -0.40 -0.05 0.00 -0.81 0.00 0.00 59.98 58.71 1w00 h ARG 58 Cb 1.02 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.55 1w00 h ARG 58 CO 0.08 1.03 0.25 1.96 -1.51 0.00 0.00 179.97 181.78 1w00 h GLN 59 N 0.64 1.08 0.19 0.20 4.20 -1.11 -3.25 115.11 117.04 1w00 h GLN 59 Ca 0.05 -0.21 -0.28 0.00 0.06 0.00 0.00 58.65 58.28 1w00 h GLN 59 Cb 0.95 -0.17 0.02 0.00 0.30 0.00 0.00 27.48 28.58 1w00 h GLN 59 CO 0.09 0.90 -1.26 0.78 -0.67 0.00 0.00 178.83 178.66 1w00 h GLY 60 N 1.10 0.45 -5.03 3.46 0.00 -1.22 -3.52 103.07 98.31 1w00 h GLY 60 Ca 0.24 -1.15 -0.63 0.00 0.00 0.00 0.00 47.33 45.79 1w00 h GLY 60 CO -0.01 1.01 -0.44 1.08 0.00 0.00 0.00 176.54 178.17 1w00 s LEU 61 N -7.66 4.36 0.00 3.11 2.01 0.92 -5.01 118.68 116.41 1w00 s LEU 61 Ca -0.13 0.44 0.00 0.00 0.01 0.00 0.00 54.13 54.45 1w00 s LEU 61 Cb 0.03 -2.72 0.00 0.00 0.01 0.00 0.00 46.19 43.51 1w00 s LEU 61 CO 0.87 0.23 0.00 2.29 1.01 0.00 0.00 176.35 180.75 1w00 n LYS 65 N 0.88 -0.26 -3.79 1.70 2.85 -1.26 -4.63 118.16 113.66 1w00 n LYS 65 Ca -0.10 0.06 -0.13 0.00 -1.05 0.00 0.00 58.31 57.10 1w00 n LYS 65 Cb 0.52 -3.23 -0.13 0.00 -0.65 0.00 0.00 35.03 31.54 1w00 n LYS 65 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 1w00 s VAL 66 N -2.43 -0.01 -0.04 0.58 1.01 -1.26 -4.04 120.40 114.21 1w00 s VAL 66 Ca 0.00 0.05 0.07 0.00 0.00 0.00 0.00 61.98 62.10 1w00 s VAL 66 Cb 0.00 -0.27 -0.02 0.00 0.00 0.00 0.00 36.38 36.10 1w00 s VAL 66 CO 0.00 0.02 -0.25 -0.60 0.00 0.00 0.00 175.10 174.27 1w00 s ARG 67 N 0.41 2.33 -0.06 2.72 6.06 0.13 -4.77 118.95 125.77 1w00 s ARG 67 Ca -0.03 -0.90 -0.08 0.00 -2.50 0.00 0.00 55.73 52.22 1w00 s ARG 67 Cb -0.04 -2.11 0.02 0.00 0.06 0.00 0.00 34.95 32.87 1w00 s ARG 67 CO -0.02 0.49 0.21 0.00 -2.50 0.00 0.00 175.30 173.47 1w00 s ALA 68 N -0.42 -0.51 0.05 6.12 0.00 -1.26 0.13 121.76 125.87 1w00 s ALA 68 Ca 0.04 0.42 -0.24 0.00 0.00 0.00 0.00 51.96 52.18 1w00 s ALA 68 Cb -0.12 -0.21 0.06 0.00 0.00 0.00 0.00 23.12 22.85 1w00 s ALA 68 CO 0.01 -0.14 0.56 0.00 0.00 0.00 0.00 175.76 176.19 1w00 s LEU 70 N -2.01 4.32 0.00 0.00 1.43 -1.26 -1.87 118.68 119.28 1w00 s LEU 70 Ca -0.05 2.40 0.08 0.00 -1.03 0.00 0.00 54.13 55.53 1w00 s LEU 70 Cb -0.01 -3.86 0.15 0.00 0.03 0.00 0.00 46.19 42.50 1w00 s LEU 70 CO -0.02 -0.53 0.99 0.35 0.23 0.00 0.00 176.35 177.36 1w00 n THR 71 N 0.46 0.53 -3.64 5.49 -2.24 -0.55 -4.87 114.28 109.45 1w00 n THR 71 Ca 0.02 -0.76 -0.02 0.00 -2.27 0.00 0.00 64.05 61.01 1w00 n THR 71 Cb 0.45 0.82 -0.01 0.00 -2.10 0.00 0.00 70.33 69.49 1w00 n THR 71 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1w00 s GLY 72 N -0.86 -0.34 0.71 3.38 0.00 -1.23 -4.98 107.32 104.00 1w00 s GLY 72 Ca 0.14 0.70 -0.13 0.00 0.00 0.00 0.00 44.72 45.43 1w00 s GLY 72 CO 0.11 0.18 1.10 2.56 0.00 0.00 0.00 173.10 177.05 1w00 s PRO 73 N -2.81 2.55 0.17 2.90 0.04 -1.26 -4.55 135.00 132.03 1w00 s PRO 73 Ca 0.11 1.26 -0.30 0.00 0.04 0.00 0.00 61.00 62.12 1w00 s PRO 73 Cb 0.01 -1.93 -0.07 0.00 0.04 0.00 0.00 34.50 32.55 1w00 s PRO 73 CO -0.03 -1.43 1.05 0.08 0.04 0.00 0.00 177.00 176.71 1w00 s VAL 74 N -2.64 4.05 -0.40 -0.36 1.01 -1.26 -4.54 120.40 116.26 1w00 s VAL 74 Ca 0.64 1.78 -0.12 0.00 0.00 0.00 0.00 61.98 64.28 1w00 s VAL 74 Cb -0.18 -4.14 0.04 0.00 0.00 0.00 0.00 36.38 32.10 1w00 s VAL 74 CO 0.49 0.31 0.25 -0.13 0.00 0.00 0.00 175.10 176.02 1w00 s ARG 75 N -0.36 2.83 0.13 2.72 3.00 0.54 -4.97 118.95 122.84 1w00 s ARG 75 Ca 0.48 -1.14 0.05 0.00 0.00 0.00 0.00 55.73 55.11 1w00 s ARG 75 Cb -0.27 -3.82 -0.04 0.00 0.00 0.00 0.00 34.95 30.82 1w00 s ARG 75 CO 0.33 -0.77 0.08 0.00 0.00 0.00 0.00 175.30 174.94 1w00 s ALA 76 N 1.57 3.47 0.53 2.13 0.00 -1.26 -0.79 121.76 127.41 1w00 s ALA 76 Ca 0.03 -1.16 0.07 0.00 0.00 0.00 0.00 51.96 50.89 1w00 s ALA 76 Cb -0.20 -1.30 0.04 0.00 0.00 0.00 0.00 23.12 21.66 1w00 s ALA 76 CO 0.07 0.60 0.51 -1.54 0.00 0.00 0.00 175.76 175.40 1w00 s SER 77 N -2.75 4.83 0.00 0.00 1.04 0.40 -4.97 113.70 112.25 1w00 s SER 77 Ca 0.29 -1.06 0.21 0.00 0.48 0.00 0.00 55.95 55.87 1w00 s SER 77 Cb -0.11 0.23 0.53 0.00 0.10 0.00 0.00 66.02 66.78 1w00 s SER 77 CO 0.21 -1.10 1.44 1.41 0.98 0.00 0.00 173.24 176.18 1w00 n HIS 78 N -1.87 0.52 -2.07 5.02 8.25 -1.26 -3.92 115.22 119.89 1w00 n HIS 78 Ca 0.04 -0.26 -0.24 0.00 -0.26 0.00 0.00 57.72 57.01 1w00 n HIS 78 Cb 0.63 0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.76 1w00 n HIS 78 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1w00 n ASN 79 N 1.09 4.82 -1.90 0.41 2.04 -1.26 -4.92 115.26 115.54 1w00 n ASN 79 Ca 0.18 -3.70 -0.17 0.00 -0.44 0.00 0.00 54.58 50.46 1w00 n ASN 79 Cb 0.49 -0.35 -0.01 0.00 -2.53 0.00 0.00 39.78 37.38 1w00 n ASN 79 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1w00 n GLY 80 N -0.69 -0.29 3.44 4.83 0.00 -1.24 -4.63 105.19 106.59 1w00 n GLY 80 Ca 0.43 -0.18 -0.22 0.00 0.00 0.00 0.00 46.02 46.05 1w00 n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1w00 s GLY 82 N -3.45 -0.29 -0.07 0.00 0.00 -0.28 -0.45 107.32 102.77 1w00 s GLY 82 Ca 0.28 0.34 -0.09 0.00 0.00 0.00 0.00 44.72 45.25 1w00 s GLY 82 CO 0.12 0.08 0.25 0.00 0.00 0.00 0.00 173.10 173.55 1w00 s ALA 83 N -3.23 -0.61 -0.01 3.20 0.00 0.03 -0.54 121.76 120.59 1w00 s ALA 83 Ca 0.11 0.56 -0.08 0.00 0.00 0.00 0.00 51.96 52.55 1w00 s ALA 83 Cb -0.01 -0.29 0.01 0.00 0.00 0.00 0.00 23.12 22.82 1w00 s ALA 83 CO -0.01 -0.15 0.16 0.00 0.00 0.00 0.00 175.76 175.77 1w00 s MET 84 N -0.24 0.46 -0.16 0.00 0.23 -0.33 -0.34 119.30 118.92 1w00 s MET 84 Ca -0.04 -0.27 -0.09 0.00 -1.03 0.00 0.00 55.69 54.26 1w00 s MET 84 Cb -0.03 0.20 -0.05 0.00 -1.53 0.00 0.00 34.83 33.42 1w00 s MET 84 CO 0.01 -0.11 0.15 -1.25 -2.03 0.00 0.00 175.02 171.79 1w00 s PRO 85 N -1.13 3.87 0.22 3.16 0.04 -1.26 -1.44 135.00 138.45 1w00 s PRO 85 Ca -0.12 -0.15 -0.13 0.00 0.04 0.00 0.00 61.00 60.64 1w00 s PRO 85 Cb -0.06 -3.32 -0.00 0.00 0.04 0.00 0.00 34.50 31.16 1w00 s PRO 85 CO 0.02 0.51 0.44 -0.59 0.04 0.00 0.00 177.00 177.42 1w00 s PHE 86 N -0.26 0.31 0.06 0.56 -0.71 0.55 -1.49 117.98 117.00 1w00 s PHE 86 Ca 0.12 -0.67 0.07 0.00 -1.04 0.00 0.00 56.93 55.41 1w00 s PHE 86 Cb -0.12 0.16 -0.03 0.00 -1.21 0.00 0.00 43.02 41.83 1w00 s PHE 86 CO 0.01 -0.92 -0.18 0.50 -1.34 0.00 0.00 175.22 173.29 1w00 s ARG 87 N -3.99 1.14 -0.09 1.99 3.52 -0.78 -0.15 118.95 120.59 1w00 s ARG 87 Ca 0.20 -0.94 0.03 0.00 -0.13 0.00 0.00 55.73 54.88 1w00 s ARG 87 Cb 0.00 -1.25 0.01 0.00 -1.56 0.00 0.00 34.95 32.15 1w00 s ARG 87 CO 0.06 0.31 -0.17 0.08 -0.81 0.00 0.00 175.30 174.76 1w00 s VAL 88 N -0.94 1.57 -0.23 7.11 1.01 0.39 -2.27 120.40 127.02 1w00 s VAL 88 Ca 0.05 -0.71 -0.07 0.00 0.00 0.00 0.00 61.98 61.24 1w00 s VAL 88 Cb -0.09 -1.40 -0.03 0.00 0.00 0.00 0.00 36.38 34.86 1w00 s VAL 88 CO 0.02 0.45 0.07 -1.61 0.00 0.00 0.00 175.10 174.04 1w00 s GLU 89 N 0.69 3.74 0.29 2.72 2.02 0.34 -0.69 118.70 127.82 1w00 s GLU 89 Ca -0.13 -0.44 0.05 0.00 0.02 0.00 0.00 54.97 54.47 1w00 s GLU 89 Cb -0.16 -3.31 -0.02 0.00 0.10 0.00 0.00 34.13 30.74 1w00 s GLU 89 CO 0.03 -0.08 0.17 0.00 0.02 0.00 0.00 175.26 175.41 1w00 n MET 90 N 4.60 0.47 -5.24 1.61 0.00 -0.74 0.17 117.12 117.99 1w00 n MET 90 Ca -0.16 -2.70 -0.32 0.00 0.00 0.00 0.00 57.70 54.52 1w00 n MET 90 Cb 0.52 1.86 -0.16 0.00 0.00 0.00 0.00 33.22 35.44 1w00 n MET 90 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 175.97 176.11 1w00 s VAL 91 N -2.94 2.10 -0.12 3.17 -7.23 -1.26 -1.13 120.40 112.99 1w00 s VAL 91 Ca 0.25 -1.04 -0.02 0.00 -1.81 0.00 0.00 61.98 59.35 1w00 s VAL 91 Cb 0.01 -1.77 0.04 0.00 0.56 0.00 0.00 36.38 35.23 1w00 s VAL 91 CO 0.17 0.57 0.01 0.86 -0.31 0.00 0.00 175.10 176.40 1w00 s TRP 92 N -0.11 0.84 -1.18 2.82 -0.00 0.27 -4.76 118.94 116.82 1w00 s TRP 92 Ca -0.05 -0.45 -0.07 0.00 -0.00 0.00 0.00 56.10 55.53 1w00 s TRP 92 Cb -0.14 -0.91 0.01 0.00 -0.00 0.00 0.00 33.47 32.43 1w00 s TRP 92 CO 0.04 -0.44 1.03 0.09 -0.00 0.00 0.00 176.95 177.67 1w00 n ASN 93 N 5.10 -5.28 0.00 5.86 5.03 -1.26 -0.63 115.26 124.09 1w00 n ASN 93 Ca -0.08 -0.49 0.00 0.00 0.87 0.00 0.00 54.58 54.88 1w00 n ASN 93 Cb 0.49 -4.54 0.00 0.00 -1.02 0.00 0.00 39.78 34.71 1w00 n ASN 93 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1w00 n GLY 94 N -1.73 0.09 3.57 7.41 0.00 -1.26 -4.96 105.19 108.32 1w00 n GLY 94 Ca -0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.64 1w00 n GLY 94 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1w00 s GLN 95 N -1.62 3.30 -0.02 1.61 -0.21 0.20 -5.08 119.66 117.84 1w00 s GLN 95 Ca 0.00 -0.49 -0.30 0.00 0.02 0.00 0.00 55.36 54.59 1w00 s GLN 95 Cb 0.00 -2.83 -0.03 0.00 1.00 0.00 0.00 33.01 31.16 1w00 s GLN 95 CO 0.00 0.46 1.02 -1.25 -2.12 0.00 0.00 175.29 173.40 1w00 s PRO 96 N -0.23 4.51 0.28 2.91 0.04 -1.26 0.97 135.00 142.21 1w00 s PRO 96 Ca 0.04 1.46 0.02 0.00 0.04 0.00 0.00 61.00 62.57 1w00 s PRO 96 Cb -0.13 -3.47 -0.06 0.00 0.04 0.00 0.00 34.50 30.89 1w00 s PRO 96 CO 0.02 -0.15 0.07 0.00 0.04 0.00 0.00 177.00 176.98 1w00 s ALA 98 N -3.56 0.83 -0.06 0.00 0.00 0.18 -1.79 121.76 117.37 1w00 s ALA 98 Ca 0.36 -0.86 -0.00 0.00 0.00 0.00 0.00 51.96 51.46 1w00 s ALA 98 Cb 0.08 -0.02 0.03 0.00 0.00 0.00 0.00 23.12 23.21 1w00 s ALA 98 CO 0.14 0.06 -0.02 -1.17 0.00 0.00 0.00 175.76 174.77 1w00 s LEU 99 N -1.63 0.94 -0.10 0.00 2.96 0.14 -0.34 118.68 120.65 1w00 s LEU 99 Ca -0.06 -0.11 -0.20 0.00 -0.22 0.00 0.00 54.13 53.54 1w00 s LEU 99 Cb -0.10 -0.45 -0.04 0.00 0.50 0.00 0.00 46.19 46.10 1w00 s LEU 99 CO 0.01 -0.13 0.55 -1.81 -1.32 0.00 0.00 176.35 173.65 1w00 s ASP 100 N 1.48 6.79 0.04 3.68 -0.00 -0.75 -0.46 116.67 127.45 1w00 s ASP 100 Ca -0.02 0.95 -0.01 0.00 -0.00 0.00 0.00 52.55 53.46 1w00 s ASP 100 Cb -0.13 -2.33 -0.03 0.00 -0.00 0.00 0.00 42.92 40.43 1w00 s ASP 100 CO -0.03 -0.03 -0.02 -0.69 -0.00 0.00 0.00 175.17 174.40 1w00 s VAL 101 N 0.64 0.18 -0.12 -1.27 1.01 0.79 -4.79 120.40 116.83 1w00 s VAL 101 Ca 0.30 -1.47 -0.01 0.00 0.00 0.00 0.00 61.98 60.80 1w00 s VAL 101 Cb -0.16 -1.06 0.03 0.00 0.00 0.00 0.00 36.38 35.19 1w00 s VAL 101 CO 0.13 -0.81 -0.04 -0.63 0.00 0.00 0.00 175.10 173.75 1w00 s ILE 102 N -3.02 0.87 -0.09 2.22 1.01 -1.08 -0.33 121.20 120.78 1w00 s ILE 102 Ca -0.01 -0.31 -0.05 0.00 0.00 0.00 0.00 60.65 60.27 1w00 s ILE 102 Cb 0.01 -1.00 -0.04 0.00 0.01 0.00 0.00 42.46 41.45 1w00 s ILE 102 CO -0.07 0.24 0.13 -0.76 0.00 0.00 0.00 174.94 174.48 1w00 s LEU 103 N 1.76 4.29 -0.09 2.97 1.43 -0.52 -1.08 118.68 127.43 1w00 s LEU 103 Ca 0.03 0.40 0.04 0.00 -1.03 0.00 0.00 54.13 53.58 1w00 s LEU 103 Cb -0.14 -2.17 -0.00 0.00 0.03 0.00 0.00 46.19 43.91 1w00 s LEU 103 CO -0.07 0.37 -0.24 -0.69 0.23 0.00 0.00 176.35 175.95 1w00 s VAL 104 N -1.09 2.00 0.06 -1.59 1.01 -0.03 -1.19 120.40 119.57 1w00 s VAL 104 Ca 0.18 -1.00 0.04 0.00 0.00 0.00 0.00 61.98 61.20 1w00 s VAL 104 Cb -0.12 -1.72 -0.03 0.00 0.00 0.00 0.00 36.38 34.51 1w00 s VAL 104 CO 0.08 0.55 -0.12 -0.04 0.00 0.00 0.00 175.10 175.57 1w00 s MET 105 N 0.23 0.71 -0.11 2.72 -1.94 0.30 -1.10 119.30 120.10 1w00 s MET 105 Ca -0.15 -0.87 0.00 0.00 -1.71 0.00 0.00 55.69 52.96 1w00 s MET 105 Cb -0.17 -0.62 0.02 0.00 2.01 0.00 0.00 34.83 36.07 1w00 s MET 105 CO 0.07 0.13 -0.10 0.50 -0.01 0.00 0.00 175.02 175.62 1w00 s ARG 106 N -1.66 1.69 0.20 2.03 3.52 -0.77 -1.12 118.95 122.84 1w00 s ARG 106 Ca -0.05 -0.33 0.02 0.00 -0.13 0.00 0.00 55.73 55.24 1w00 s ARG 106 Cb -0.10 -1.65 -0.04 0.00 -1.56 0.00 0.00 34.95 31.61 1w00 s ARG 106 CO 0.02 -0.21 0.35 -0.06 -0.81 0.00 0.00 175.30 174.59 1w00 s PHE 107 N 1.49 3.48 0.44 5.12 0.40 0.19 -0.03 117.98 129.08 1w00 s PHE 107 Ca 0.02 0.17 0.02 0.00 -0.60 0.00 0.00 56.93 56.54 1w00 s PHE 107 Cb -0.13 -1.72 0.08 0.00 0.51 0.00 0.00 43.02 41.76 1w00 s PHE 107 CO -0.07 0.43 0.61 -0.40 0.70 0.00 0.00 175.22 176.49 1w00 n ASP 108 N -0.86 1.09 0.00 1.36 5.68 0.16 -0.45 116.55 123.53 1w00 n ASP 108 Ca -0.07 -1.85 0.05 0.00 -0.50 0.00 0.00 54.79 52.42 1w00 n ASP 108 Cb 0.55 -0.37 0.27 0.00 -1.14 0.00 0.00 41.12 40.42 1w00 n ASP 108 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 1w00 n GLU 109 N -2.07 0.24 -0.27 0.11 0.28 -1.26 -1.54 120.64 116.13 1w00 n GLU 109 Ca 0.11 0.07 0.07 0.00 -0.16 0.00 0.00 57.16 57.24 1w00 n GLU 109 Cb 0.39 -1.50 0.18 0.00 1.43 0.00 0.00 31.44 31.95 1w00 n GLU 109 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 1w00 n HIS 110 N -1.10 0.59 -1.35 -1.84 8.25 -1.26 -4.65 115.22 113.86 1w00 n HIS 110 Ca 0.06 -0.70 -0.11 0.00 -0.26 0.00 0.00 57.72 56.71 1w00 n HIS 110 Cb 0.05 -0.16 -0.05 0.00 1.12 0.00 0.00 29.99 30.95 1w00 n HIS 110 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1w00 n GLY 111 N -0.18 1.19 3.70 -1.41 0.00 -0.59 -5.01 105.19 102.89 1w00 n GLY 111 Ca 0.15 -0.52 -0.31 0.00 0.00 0.00 0.00 46.02 45.35 1w00 n GLY 111 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1w00 s ARG 112 N -3.00 2.66 -0.11 1.61 0.52 -1.26 -4.85 118.95 114.53 1w00 s ARG 112 Ca 0.00 -0.76 -0.29 0.00 -0.52 0.00 0.00 55.73 54.16 1w00 s ARG 112 Cb 0.00 -2.60 -0.04 0.00 0.52 0.00 0.00 34.95 32.83 1w00 s ARG 112 CO 0.00 0.57 1.52 0.42 0.02 0.00 0.00 175.30 177.83 1w00 s ILE 113 N -1.27 3.82 -0.16 1.52 1.01 -0.20 0.38 121.20 126.30 1w00 s ILE 113 Ca 0.25 0.99 -0.15 0.00 0.00 0.00 0.00 60.65 61.74 1w00 s ILE 113 Cb -0.12 -3.66 -0.23 0.00 0.01 0.00 0.00 42.46 38.46 1w00 s ILE 113 CO 0.17 -0.11 0.32 -0.61 0.00 0.00 0.00 174.94 174.71 1w00 h GLN 114 N 9.22 0.14 -4.09 2.79 5.75 -0.75 0.29 115.11 128.47 1w00 h GLN 114 Ca -0.34 -0.25 -0.24 0.00 -0.15 0.00 0.00 58.65 57.67 1w00 h GLN 114 Cb 1.15 0.09 -0.25 0.00 1.07 0.00 0.00 27.48 29.54 1w00 h GLN 114 CO 0.96 1.12 -0.72 0.95 -2.65 0.00 0.00 178.83 178.49 1w00 s THR 115 N -2.46 0.23 -0.01 2.39 -4.23 -1.01 -1.41 115.64 109.14 1w00 s THR 115 Ca -0.25 -0.51 0.01 0.00 -1.18 0.00 0.00 61.69 59.75 1w00 s THR 115 Cb 0.06 -0.27 0.01 0.00 1.34 0.00 0.00 72.50 73.64 1w00 s THR 115 CO 0.69 -0.19 -0.02 -0.32 -0.54 0.00 0.00 174.62 174.24 1w00 s MET 116 N -0.74 0.27 -0.09 3.99 1.75 -0.66 -1.85 119.30 121.97 1w00 s MET 116 Ca -0.06 -0.04 -0.01 0.00 -1.25 0.00 0.00 55.69 54.32 1w00 s MET 116 Cb -0.05 -0.33 0.03 0.00 2.84 0.00 0.00 34.83 37.32 1w00 s MET 116 CO -0.00 -0.01 0.00 -0.65 -0.65 0.00 0.00 175.02 173.71 1w00 s GLN 117 N 0.32 0.66 -0.28 4.11 -0.21 -0.26 -1.34 119.66 122.66 1w00 s GLN 117 Ca -0.03 0.03 -0.10 0.00 0.02 0.00 0.00 55.36 55.29 1w00 s GLN 117 Cb -0.06 -1.13 -0.03 0.00 1.00 0.00 0.00 33.01 32.79 1w00 s GLN 117 CO -0.01 -0.34 0.14 0.00 -2.12 0.00 0.00 175.29 172.97 1w00 s ALA 118 N 1.95 3.35 -0.22 6.09 0.00 -0.28 -0.85 121.76 131.80 1w00 s ALA 118 Ca 0.04 -1.17 -0.15 0.00 0.00 0.00 0.00 51.96 50.68 1w00 s ALA 118 Cb -0.13 -2.33 -0.04 0.00 0.00 0.00 0.00 23.12 20.62 1w00 s ALA 118 CO -0.06 -0.62 0.36 0.71 0.00 0.00 0.00 175.76 176.15 1w00 s TYR 119 N 1.68 3.34 0.00 0.00 2.02 -0.24 0.19 117.35 124.33 1w00 s TYR 119 Ca 0.06 0.51 0.00 0.00 -0.37 0.00 0.00 57.07 57.27 1w00 s TYR 119 Cb -0.16 -2.49 0.00 0.00 -0.40 0.00 0.00 41.96 38.91 1w00 s TYR 119 CO 0.07 -0.04 0.00 -2.67 -1.57 0.00 0.00 175.55 171.34 1w00 n TRP 120 N 4.62 0.00 -4.15 2.71 4.27 -1.26 -2.64 117.44 120.99 1w00 n TRP 120 Ca -0.09 0.00 -0.15 0.00 -3.89 0.00 0.00 57.50 53.36 1w00 n TRP 120 Cb 0.51 0.00 -0.06 0.00 -1.36 0.00 0.00 31.31 30.40 1w00 n TRP 120 CO 0.00 0.00 0.00 -1.54 -2.29 0.00 0.00 177.69 173.86 1w00 s SER 121 N 0.00 0.98 0.64 -0.67 1.04 -1.26 -4.75 113.70 109.67 1w00 s SER 121 Ca 0.00 -1.52 0.42 0.00 0.48 0.00 0.00 55.95 55.34 1w00 s SER 121 Cb 0.00 0.59 2.27 0.00 0.10 0.00 0.00 66.02 68.98 1w00 s SER 121 CO 0.00 -1.16 2.30 -0.33 0.98 0.00 0.00 173.24 175.02 1w00 h GLU 122 N 2.19 0.00 0.00 4.02 3.07 -2.00 0.16 114.58 122.02 1w00 h GLU 122 Ca -0.28 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.58 1w00 h GLU 122 Cb 1.24 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.15 1w00 h GLU 122 CO 0.39 0.00 0.00 1.55 -1.40 0.00 0.00 179.01 179.55 1w00 n VAL 123 N -3.03 0.23 0.47 3.13 3.14 -1.26 -1.77 118.33 119.25 1w00 n VAL 123 Ca -0.03 0.06 0.09 0.00 -2.96 0.00 0.00 64.34 61.51 1w00 n VAL 123 Cb 0.09 -0.67 0.13 0.00 -1.06 0.00 0.00 33.84 32.33 1w00 n VAL 123 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 1w00 n ASN 124 N -1.26 2.84 -4.86 6.55 4.13 0.04 -4.95 115.26 117.75 1w00 n ASN 124 Ca 0.12 -1.84 -0.35 0.00 1.68 0.00 0.00 54.58 54.18 1w00 n ASN 124 Cb 0.18 -0.11 -0.06 0.00 -1.54 0.00 0.00 39.78 38.25 1w00 n ASN 124 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1w00 s LEU 125 N -1.40 4.37 -0.21 3.41 0.20 -0.73 -1.81 118.68 122.52 1w00 s LEU 125 Ca 0.27 0.84 -0.04 0.00 0.69 0.00 0.00 54.13 55.89 1w00 s LEU 125 Cb 0.17 -2.93 0.10 0.00 -0.43 0.00 0.00 46.19 43.10 1w00 s LEU 125 CO 0.24 0.20 0.23 -0.94 -0.29 0.00 0.00 176.35 175.79 1w00 s SER 126 N -1.63 1.37 0.66 3.68 1.04 0.54 -4.99 113.70 114.37 1w00 s SER 126 Ca 0.32 -0.24 -0.01 0.00 0.48 0.00 0.00 55.95 56.50 1w00 s SER 126 Cb -0.14 0.41 0.09 0.00 0.10 0.00 0.00 66.02 66.47 1w00 s SER 126 CO 0.17 -0.33 0.92 0.68 0.98 0.00 0.00 173.24 175.66 1w00 s VAL 127 N 2.33 2.35 0.00 5.02 -7.23 -1.26 0.52 120.40 122.12 1w00 s VAL 127 Ca 0.07 -0.58 0.00 0.00 -1.81 0.00 0.00 61.98 59.67 1w00 s VAL 127 Cb -0.16 -2.77 0.00 0.00 0.56 0.00 0.00 36.38 34.01 1w00 s VAL 127 CO -0.13 0.00 0.00 -1.14 -0.31 0.00 0.00 175.10 173.52