#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cw0 s GLU 3 N 0.00 4.38 -0.35 0.00 2.02 -1.26 -4.96 118.70 118.53 2cw0 s GLU 3 Ca 0.00 1.60 -0.42 0.00 0.02 0.00 0.00 54.97 56.17 2cw0 s GLU 3 Cb 0.00 -3.54 -0.17 0.00 0.10 0.00 0.00 34.13 30.52 2cw0 s GLU 3 CO 0.00 -0.39 1.70 -2.30 0.02 0.00 0.00 175.26 174.29 2cw0 n PRO 4 N 5.02 0.79 -2.00 0.39 -0.02 -1.26 -0.96 135.00 136.95 2cw0 n PRO 4 Ca 0.10 0.29 -0.21 0.00 -2.02 0.00 0.00 63.50 61.66 2cw0 n PRO 4 Cb 0.47 -1.91 -0.05 0.00 -0.02 0.00 0.00 33.50 31.99 2cw0 n PRO 4 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2cw0 n GLY 5 N 4.14 0.71 0.30 -1.23 0.00 -1.26 -4.82 105.19 103.03 2cw0 n GLY 5 Ca 0.28 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.39 2cw0 n GLY 5 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2cw0 h ILE 6 N 0.00 0.99 0.34 -0.61 6.09 -1.45 -1.00 117.51 121.86 2cw0 h ILE 6 Ca -0.45 -0.08 -0.00 0.00 -1.37 0.00 0.00 64.86 62.96 2cw0 h ILE 6 Cb 1.35 0.74 -0.02 0.00 0.47 0.00 0.00 36.82 39.36 2cw0 h ILE 6 CO 0.60 0.04 -0.33 0.44 -3.07 0.00 0.00 178.15 175.82 2cw0 h ASP 7 N 0.23 -0.90 -0.68 2.19 3.32 -1.88 0.26 116.42 118.97 2cw0 h ASP 7 Ca 0.11 0.08 0.01 0.00 0.02 0.00 0.00 57.03 57.26 2cw0 h ASP 7 Cb 0.17 0.30 -0.04 0.00 0.22 0.00 0.00 39.33 39.99 2cw0 h ASP 7 CO -0.02 -0.47 0.44 0.11 -1.72 0.00 0.00 179.24 177.58 2cw0 h LYS 8 N -0.70 0.86 0.09 3.56 1.57 -1.77 0.37 116.57 120.56 2cw0 h LYS 8 Ca -0.02 -0.05 0.01 0.00 -1.87 0.00 0.00 60.65 58.72 2cw0 h LYS 8 Cb 0.63 -0.19 -0.04 0.00 0.08 0.00 0.00 32.23 32.70 2cw0 h LYS 8 CO -0.06 0.57 -0.48 -0.07 -0.57 0.00 0.00 179.45 178.84 2cw0 h LEU 9 N 0.89 -1.45 -2.04 2.94 3.38 -0.65 0.74 115.31 119.11 2cw0 h LEU 9 Ca 0.26 0.15 0.07 0.00 0.09 0.00 0.00 57.88 58.45 2cw0 h LEU 9 Cb -0.07 0.54 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 2cw0 h LEU 9 CO -0.07 -0.50 0.18 -0.26 0.09 0.00 0.00 178.44 177.88 2cw0 h PHE 10 N -0.67 0.00 -0.13 1.13 0.05 -0.22 -0.71 116.94 116.38 2cw0 h PHE 10 Ca -0.00 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.79 2cw0 h PHE 10 Cb 0.68 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.63 2cw0 h PHE 10 CO -0.45 0.00 0.00 0.41 -0.18 0.00 0.00 178.31 178.09 2cw0 n GLY 11 N -1.56 -0.23 0.22 -1.45 0.00 0.21 -3.77 105.19 98.61 2cw0 n GLY 11 Ca 0.03 -0.24 0.03 0.00 0.00 0.00 0.00 46.02 45.84 2cw0 n GLY 11 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2cw0 n MET 12 N -0.09 0.52 -4.41 1.61 2.81 0.13 -4.96 117.12 112.73 2cw0 n MET 12 Ca 0.11 -0.77 -0.23 0.00 -1.81 0.00 0.00 57.70 55.00 2cw0 n MET 12 Cb 0.18 -1.08 -0.10 0.00 -0.71 0.00 0.00 33.22 31.51 2cw0 n MET 12 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 2cw0 s VAL 13 N -0.65 2.19 -0.94 2.03 -7.23 -1.24 -5.01 120.40 109.54 2cw0 s VAL 13 Ca 0.07 -2.26 0.28 0.00 -1.81 0.00 0.00 61.98 58.26 2cw0 s VAL 13 Cb 0.05 -2.16 0.19 0.00 0.56 0.00 0.00 36.38 35.03 2cw0 s VAL 13 CO 0.10 -0.41 1.78 -0.90 -0.31 0.00 0.00 175.10 175.36 2cw0 n ASP 14 N -0.35 0.26 -3.69 4.85 5.75 -1.26 -4.76 116.55 117.35 2cw0 n ASP 14 Ca -0.08 0.36 -0.12 0.00 -0.01 0.00 0.00 54.79 54.94 2cw0 n ASP 14 Cb 0.59 -0.38 -0.12 0.00 -1.03 0.00 0.00 41.12 40.19 2cw0 n ASP 14 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 2cw0 s SER 15 N -3.31 -0.12 0.59 -1.12 0.15 -1.26 -4.99 113.70 103.65 2cw0 s SER 15 Ca 0.12 0.71 0.29 0.00 0.70 0.00 0.00 55.95 57.77 2cw0 s SER 15 Cb 0.17 0.74 1.39 0.00 -1.71 0.00 0.00 66.02 66.61 2cw0 s SER 15 CO 0.58 -0.21 1.79 0.50 1.20 0.00 0.00 173.24 177.10 2cw0 h LYS 16 N 7.70 0.00 0.00 5.44 3.64 -1.88 0.57 116.57 132.03 2cw0 h LYS 16 Ca -0.27 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.08 2cw0 h LYS 16 Cb 1.14 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.96 2cw0 h LYS 16 CO 0.24 0.00 -0.23 1.88 -2.27 0.00 0.00 179.45 179.07 2cw0 h TYR 17 N 0.00 0.00 0.14 1.91 0.05 -1.99 -3.26 116.97 113.83 2cw0 h TYR 17 Ca 0.27 0.00 -0.31 0.00 0.05 0.00 0.00 58.73 58.75 2cw0 h TYR 17 Cb 1.52 0.00 0.03 0.00 1.01 0.00 0.00 36.73 39.29 2cw0 h TYR 17 CO 0.00 0.15 -1.29 -0.09 -1.05 0.00 0.00 178.16 175.88 2cw0 h ARG 18 N 0.00 0.60 0.00 4.88 2.43 -0.26 -2.66 114.38 119.37 2cw0 h ARG 18 Ca -0.00 -0.83 -0.00 0.00 -0.81 0.00 0.00 59.98 58.33 2cw0 h ARG 18 Cb 1.12 0.28 -0.00 0.00 -0.42 0.00 0.00 29.97 30.95 2cw0 h ARG 18 CO 0.02 1.38 -0.00 1.25 -1.51 0.00 0.00 179.97 181.11 2cw0 h LEU 19 N 0.25 0.00 0.16 3.80 5.85 -1.59 0.27 115.31 124.05 2cw0 h LEU 19 Ca -0.20 0.00 -0.31 0.00 0.84 0.00 0.00 57.88 58.21 2cw0 h LEU 19 Cb 1.96 0.00 0.01 0.00 0.37 0.00 0.00 40.66 43.00 2cw0 h LEU 19 CO 0.24 0.00 -1.52 0.74 -0.34 0.00 0.00 178.44 177.57 2cw0 h THR 20 N 0.00 1.19 -0.09 1.05 2.02 -1.56 -3.26 112.91 112.26 2cw0 h THR 20 Ca -0.00 -2.77 -0.14 0.00 0.77 0.00 0.00 66.41 64.27 2cw0 h THR 20 Cb 0.06 2.84 0.01 0.00 -1.74 0.00 0.00 68.15 69.32 2cw0 h THR 20 CO 0.00 0.84 -0.48 0.58 0.37 0.00 0.00 175.52 176.83 2cw0 h VAL 21 N 0.09 1.38 0.10 3.16 2.07 -0.73 -3.14 116.25 119.17 2cw0 h VAL 21 Ca -0.25 -1.83 -0.00 0.00 0.82 0.00 0.00 66.70 65.45 2cw0 h VAL 21 Cb 2.05 2.24 -0.01 0.00 -1.52 0.00 0.00 31.29 34.05 2cw0 h VAL 21 CO 0.19 0.54 -0.17 0.58 0.02 0.00 0.00 177.57 178.74 2cw0 h VAL 22 N 0.06 0.00 -0.49 2.57 2.07 -0.68 -1.53 116.25 118.24 2cw0 h VAL 22 Ca -0.03 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.58 2cw0 h VAL 22 Cb 1.13 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.80 2cw0 h VAL 22 CO 0.10 0.00 -0.13 0.58 0.02 0.00 0.00 177.57 178.14 2cw0 h VAL 23 N -0.29 0.49 0.27 2.57 2.07 -1.71 0.65 116.25 120.31 2cw0 h VAL 23 Ca -0.01 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 2cw0 h VAL 23 Cb 0.27 0.49 -0.00 0.00 -1.52 0.00 0.00 31.29 30.52 2cw0 h VAL 23 CO -0.06 0.00 -0.20 0.00 0.02 0.00 0.00 177.57 177.34 2cw0 h ALA 24 N 1.47 -0.99 -0.83 1.67 0.00 -1.52 1.11 119.26 120.17 2cw0 h ALA 24 Ca 0.24 -0.09 0.21 0.00 0.00 0.00 0.00 54.91 55.27 2cw0 h ALA 24 Cb 0.37 0.36 -0.05 0.00 0.00 0.00 0.00 17.79 18.47 2cw0 h ALA 24 CO -0.51 -0.99 0.57 0.87 0.00 0.00 0.00 179.25 179.19 2cw0 h LYS 25 N -0.44 0.20 0.00 0.00 1.57 -1.05 1.35 116.57 118.20 2cw0 h LYS 25 Ca -0.04 -0.01 -0.09 0.00 -1.87 0.00 0.00 60.65 58.64 2cw0 h LYS 25 Cb 0.37 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.62 2cw0 h LYS 25 CO 0.01 0.13 -0.44 -0.09 -0.57 0.00 0.00 179.45 178.50 2cw0 h ARG 26 N 0.21 0.00 -0.09 3.15 9.65 0.84 -2.90 114.38 125.23 2cw0 h ARG 26 Ca 0.41 0.00 -0.13 0.00 -1.10 0.00 0.00 59.98 59.16 2cw0 h ARG 26 Cb 1.29 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.86 2cw0 h ARG 26 CO -0.09 0.44 -0.51 0.00 2.80 0.00 0.00 179.97 182.61 2cw0 h ALA 27 N 1.56 0.97 0.28 2.80 0.00 1.06 -2.96 119.26 122.97 2cw0 h ALA 27 Ca -0.00 -0.48 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 2cw0 h ALA 27 Cb 1.16 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.86 2cw0 h ALA 27 CO 0.06 0.66 -0.13 1.96 0.00 0.00 0.00 179.25 181.79 2cw0 h GLN 28 N 0.20 -0.36 0.00 0.00 4.20 -0.88 -2.90 115.11 115.37 2cw0 h GLN 28 Ca 0.01 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.74 2cw0 h GLN 28 Cb 0.97 0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.83 2cw0 h GLN 28 CO 0.08 -0.24 0.08 0.00 -0.67 0.00 0.00 178.83 178.08 2cw0 n GLN 29 N -3.03 0.03 0.09 1.46 10.64 -1.19 0.90 117.38 126.27 2cw0 n GLN 29 Ca -0.05 0.47 0.00 0.00 -1.83 0.00 0.00 57.00 55.60 2cw0 n GLN 29 Cb 0.15 -1.67 -0.03 0.00 -0.86 0.00 0.00 30.24 27.83 2cw0 n GLN 29 CO 0.00 0.00 0.00 1.25 -1.83 0.00 0.00 177.06 176.48 2cw0 h LEU 30 N 0.00 0.00 0.00 2.61 5.85 -1.34 -2.98 115.31 119.46 2cw0 h LEU 30 Ca 0.00 0.00 -0.31 0.00 0.84 0.00 0.00 57.88 58.41 2cw0 h LEU 30 Cb 0.16 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.14 2cw0 h LEU 30 CO 0.00 0.60 -1.96 0.18 -0.34 0.00 0.00 178.44 176.92 2cw0 n LEU 31 N -3.12 1.94 0.00 2.25 4.77 0.22 -2.54 117.00 120.52 2cw0 n LEU 31 Ca -0.03 0.36 0.00 0.00 -0.03 0.00 0.00 56.01 56.31 2cw0 n LEU 31 Cb 0.80 -0.81 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 2cw0 n LEU 31 CO 0.42 0.29 0.36 -1.14 -1.33 0.00 0.00 177.39 175.99 2cw0 n ARG 32 N -4.33 0.00 -0.26 3.23 3.00 0.26 -0.56 116.66 118.00 2cw0 n ARG 32 Ca -0.40 0.71 0.00 0.00 -0.00 0.00 0.00 57.85 58.16 2cw0 n ARG 32 Cb 0.75 -1.20 0.00 0.00 0.00 0.00 0.00 32.46 32.01 2cw0 n ARG 32 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.63 178.35 2cw0 n HIS 33 N -1.93 0.00 -0.98 -0.14 8.25 -1.12 -4.91 115.22 114.39 2cw0 n HIS 33 Ca 0.00 -0.66 0.00 0.00 -0.26 0.00 0.00 57.72 56.80 2cw0 n HIS 33 Cb 0.00 -0.37 0.00 0.00 1.12 0.00 0.00 29.99 30.74 2cw0 n HIS 33 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2cw0 n GLY 34 N 1.25 -3.75 2.15 -1.41 0.00 0.28 -4.43 105.19 99.27 2cw0 n GLY 34 Ca 0.00 -0.97 -0.04 0.00 0.00 0.00 0.00 46.02 45.01 2cw0 n GLY 34 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2cw0 n PHE 35 N -1.73 0.00 -2.13 1.61 3.01 -1.05 -3.85 117.46 113.31 2cw0 n PHE 35 Ca 0.00 -0.63 0.02 0.00 1.01 0.00 0.00 57.45 57.86 2cw0 n PHE 35 Cb 0.19 -0.80 0.02 0.00 -0.01 0.00 0.00 39.48 38.88 2cw0 n PHE 35 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 2cw0 n LYS 36 N 2.53 0.11 -0.31 -1.08 4.76 -1.26 -4.73 118.16 118.18 2cw0 n LYS 36 Ca 0.15 -1.52 0.06 0.00 -2.87 0.00 0.00 58.31 54.13 2cw0 n LYS 36 Cb 0.37 -0.40 0.21 0.00 -1.84 0.00 0.00 35.03 33.37 2cw0 n LYS 36 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2cw0 n ASN 37 N 0.08 2.76 -4.71 4.39 4.13 -1.25 -4.93 115.26 115.73 2cw0 n ASN 37 Ca 0.04 -2.15 -0.42 0.00 1.68 0.00 0.00 54.58 53.72 2cw0 n ASN 37 Cb 0.86 -0.38 -0.03 0.00 -1.54 0.00 0.00 39.78 38.69 2cw0 n ASN 37 CO 0.00 0.00 0.00 0.28 0.28 0.00 0.00 177.26 177.82 2cw0 s THR 38 N -1.59 3.82 -1.50 3.41 -1.32 -1.26 -4.93 115.64 112.26 2cw0 s THR 38 Ca 0.30 1.29 0.00 0.00 -1.21 0.00 0.00 61.69 62.08 2cw0 s THR 38 Cb 0.18 -3.83 0.00 0.00 -1.51 0.00 0.00 72.50 67.34 2cw0 s THR 38 CO 0.17 0.09 0.75 1.33 -2.21 0.00 0.00 174.62 174.75 2cw0 n VAL 39 N 4.01 0.00 -3.58 5.08 0.24 -1.26 -4.80 118.33 118.02 2cw0 n VAL 39 Ca 0.10 0.00 -0.09 0.00 -2.04 0.00 0.00 64.34 62.31 2cw0 n VAL 39 Cb 0.45 -0.25 -0.04 0.00 -1.47 0.00 0.00 33.84 32.53 2cw0 n VAL 39 CO 0.00 0.00 0.00 -1.48 -2.14 0.00 0.00 176.83 173.21 2cw0 s LEU 40 N -0.50 -0.30 0.00 1.34 0.05 -1.26 -5.04 118.68 112.96 2cw0 s LEU 40 Ca 0.00 0.27 0.00 0.00 0.05 0.00 0.00 54.13 54.45 2cw0 s LEU 40 Cb 0.00 1.74 0.00 0.00 -2.05 0.00 0.00 46.19 45.88 2cw0 s LEU 40 CO 0.00 -0.33 0.00 1.21 -0.55 0.00 0.00 176.35 176.68 2cw0 n GLU 41 N 0.51 0.00 0.00 1.48 4.07 -1.26 -5.03 120.64 120.40 2cw0 n GLU 41 Ca -0.08 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.02 2cw0 n GLU 41 Cb 0.59 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.97 2cw0 n GLU 41 CO 0.00 0.00 0.00 -2.30 -0.06 0.00 0.00 177.13 174.77 2cw0 n PRO 42 N -1.41 0.00 0.00 5.31 -0.02 -1.26 -4.15 135.00 133.47 2cw0 n PRO 42 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2cw0 n PRO 42 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 2cw0 n PRO 42 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 2cw0 n GLU 43 N 0.00 0.00 -2.09 -0.52 0.28 -1.26 -4.80 120.64 112.25 2cw0 n GLU 43 Ca 0.00 0.00 -0.32 0.00 -0.16 0.00 0.00 57.16 56.68 2cw0 n GLU 43 Cb 0.00 0.00 -0.04 0.00 1.43 0.00 0.00 31.44 32.83 2cw0 n GLU 43 CO 0.00 0.00 0.00 -1.21 -0.16 0.00 0.00 177.13 175.76 2cw0 s GLU 44 N 0.00 2.66 0.17 3.44 2.02 -1.26 -4.91 118.70 120.82 2cw0 s GLU 44 Ca 0.00 -0.01 -0.09 0.00 0.02 0.00 0.00 54.97 54.89 2cw0 s GLU 44 Cb 0.00 -4.81 -0.01 0.00 0.10 0.00 0.00 34.13 29.41 2cw0 s GLU 44 CO 0.00 -3.05 0.29 1.03 0.02 0.00 0.00 175.26 173.55 2cw0 s ARG 45 N 6.87 1.18 0.00 1.61 1.81 -1.26 -4.94 118.95 124.23 2cw0 s ARG 45 Ca 0.67 -1.19 0.00 0.00 -1.72 0.00 0.00 55.73 53.48 2cw0 s ARG 45 Cb -0.08 0.38 0.00 0.00 -0.45 0.00 0.00 34.95 34.79 2cw0 s ARG 45 CO 0.07 -0.43 0.00 -2.30 -0.68 0.00 0.00 175.30 171.95 2cw0 n PRO 46 N -0.23 0.00 -3.69 3.54 -0.02 -1.26 -5.00 135.00 128.34 2cw0 n PRO 46 Ca -0.07 0.00 -0.10 0.00 -2.02 0.00 0.00 63.50 61.31 2cw0 n PRO 46 Cb 0.63 0.00 -0.11 0.00 -0.02 0.00 0.00 33.50 34.00 2cw0 n PRO 46 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 2cw0 s LYS 47 N 0.00 0.36 0.01 -0.52 -2.85 -1.26 -4.14 119.74 111.33 2cw0 s LYS 47 Ca 0.00 0.79 0.00 0.00 -1.00 0.00 0.00 55.97 55.76 2cw0 s LYS 47 Cb 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 37.83 35.77 2cw0 s LYS 47 CO 0.00 -0.17 0.01 -0.12 0.10 0.00 0.00 175.35 175.16 2cw0 n MET 48 N 4.42 0.93 -0.97 1.78 1.56 -1.25 -4.88 117.12 118.71 2cw0 n MET 48 Ca -0.21 -0.03 0.04 0.00 -0.27 0.00 0.00 57.70 57.23 2cw0 n MET 48 Cb 0.54 -0.00 0.06 0.00 2.15 0.00 0.00 33.22 35.97 2cw0 n MET 48 CO 0.00 0.00 0.00 1.04 -0.73 0.00 0.00 175.97 176.28 2cw0 n GLN 49 N -1.01 0.43 0.10 2.12 6.02 -1.26 -4.40 117.38 119.38 2cw0 n GLN 49 Ca 0.00 -2.09 0.10 0.00 -0.01 0.00 0.00 57.00 55.00 2cw0 n GLN 49 Cb 0.01 -0.57 -0.00 0.00 1.02 0.00 0.00 30.24 30.69 2cw0 n GLN 49 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 177.06 177.20 2cw0 h THR 50 N 5.17 0.09 0.00 5.09 2.02 -2.02 -3.46 112.91 119.79 2cw0 h THR 50 Ca -0.11 -1.17 0.00 0.00 0.77 0.00 0.00 66.41 65.90 2cw0 h THR 50 Cb 1.53 1.63 0.00 0.00 -1.74 0.00 0.00 68.15 69.56 2cw0 h THR 50 CO 0.05 0.05 0.00 0.00 0.37 0.00 0.00 175.52 175.99 2cw0 n LEU 51 N -2.75 0.00 -0.10 2.58 -0.00 -1.26 -5.00 117.00 110.47 2cw0 n LEU 51 Ca -0.01 0.00 0.01 0.00 -0.00 0.00 0.00 56.01 56.01 2cw0 n LEU 51 Cb 0.59 0.00 0.02 0.00 -0.00 0.00 0.00 43.42 44.04 2cw0 n LEU 51 CO 0.40 0.00 0.44 -0.62 -0.00 0.00 0.00 177.39 177.61 2cw0 n GLU 52 N 0.00 1.71 0.00 1.47 -0.58 -1.26 -4.82 120.64 117.16 2cw0 n GLU 52 Ca 0.00 -1.27 0.00 0.00 -0.42 0.00 0.00 57.16 55.47 2cw0 n GLU 52 Cb 0.00 -1.05 0.00 0.00 -0.57 0.00 0.00 31.44 29.82 2cw0 n GLU 52 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2cw0 n GLY 53 N -0.17 0.00 0.15 0.62 0.00 -1.26 -2.98 105.19 101.54 2cw0 n GLY 53 Ca 0.02 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.06 2cw0 n GLY 53 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2cw0 n LEU 54 N -2.73 0.11 0.34 0.99 0.00 -1.26 -0.55 117.00 113.90 2cw0 n LEU 54 Ca 0.00 0.34 0.18 0.00 0.00 0.00 0.00 56.01 56.53 2cw0 n LEU 54 Cb 0.00 -0.17 0.97 0.00 0.00 0.00 0.00 43.42 44.22 2cw0 n LEU 54 CO 0.00 -0.37 1.15 -0.26 0.00 0.00 0.00 177.39 177.91 2cw0 h PHE 55 N 0.00 0.00 0.00 1.96 0.04 -1.69 -3.32 116.94 113.93 2cw0 h PHE 55 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 2cw0 h PHE 55 Cb 1.15 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.30 2cw0 h PHE 55 CO 0.00 0.00 -0.13 -0.25 -0.60 0.00 0.00 178.31 177.33 2cw0 n ASP 56 N -2.97 0.28 -2.70 2.17 8.00 0.29 -5.03 116.55 116.60 2cw0 n ASP 56 Ca -0.02 0.12 -0.04 0.00 0.71 0.00 0.00 54.79 55.55 2cw0 n ASP 56 Cb 0.27 -0.54 0.11 0.00 -0.02 0.00 0.00 41.12 40.94 2cw0 n ASP 56 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 2cw0 n ASP 57 N -2.74 -1.04 0.00 -2.24 5.68 -1.25 -4.86 116.55 110.10 2cw0 n ASP 57 Ca -0.02 -2.31 0.00 0.00 -0.50 0.00 0.00 54.79 51.96 2cw0 n ASP 57 Cb 0.07 0.57 0.00 0.00 -1.14 0.00 0.00 41.12 40.62 2cw0 n ASP 57 CO 0.00 0.00 0.00 -2.65 -1.33 0.00 0.00 177.20 173.22 2cw0 n PRO 58 N -1.02 1.54 -1.75 0.11 -0.02 -1.26 -4.78 135.00 127.82 2cw0 n PRO 58 Ca -0.08 0.00 -0.41 0.00 -2.02 0.00 0.00 63.50 60.99 2cw0 n PRO 58 Cb 0.86 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 34.31 2cw0 n PRO 58 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 2cw0 s ASN 59 N -1.55 5.35 0.30 2.55 3.04 -1.26 -4.88 114.94 118.49 2cw0 s ASN 59 Ca 0.00 1.41 0.05 0.00 0.04 0.00 0.00 52.86 54.37 2cw0 s ASN 59 Cb 0.00 -2.51 0.79 0.00 -1.54 0.00 0.00 41.25 37.99 2cw0 s ASN 59 CO 0.00 -2.12 1.68 0.00 -3.04 0.00 0.00 177.10 173.62 2cw0 h ALA 60 N 15.37 1.50 -0.08 1.71 0.00 -1.91 -0.38 119.26 135.47 2cw0 h ALA 60 Ca -0.34 0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2cw0 h ALA 60 Cb 1.22 0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.20 2cw0 h ALA 60 CO 1.05 -0.42 0.00 -0.85 0.00 0.00 0.00 179.25 179.03 2cw0 n GLU 61 N -5.09 1.38 0.02 0.00 -0.00 -1.26 -2.78 120.64 112.91 2cw0 n GLU 61 Ca 0.24 -0.57 0.12 0.00 -0.00 0.00 0.00 57.16 56.95 2cw0 n GLU 61 Cb 0.73 -1.35 0.26 0.00 -0.00 0.00 0.00 31.44 31.07 2cw0 n GLU 61 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.13 179.54 2cw0 n THR 62 N -0.21 0.11 -0.08 3.84 -1.04 -0.15 -2.93 114.28 113.81 2cw0 n THR 62 Ca 0.15 -0.08 -0.08 0.00 -2.04 0.00 0.00 64.05 62.00 2cw0 n THR 62 Cb 0.21 0.07 -0.03 0.00 -1.82 0.00 0.00 70.33 68.75 2cw0 n THR 62 CO 0.00 0.00 0.00 0.79 -0.64 0.00 0.00 175.07 175.22 2cw0 n TRP 63 N -1.69 0.63 -0.40 -1.42 7.02 -1.12 -2.91 117.44 117.55 2cw0 n TRP 63 Ca 0.05 0.27 0.32 0.00 -1.02 0.00 0.00 57.50 57.12 2cw0 n TRP 63 Cb 0.37 -0.72 0.61 0.00 -2.42 0.00 0.00 31.31 29.15 2cw0 n TRP 63 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2cw0 h ALA 64 N -0.97 2.62 0.19 6.99 0.00 -1.63 0.50 119.26 126.96 2cw0 h ALA 64 Ca -0.05 0.08 -0.32 0.00 0.00 0.00 0.00 54.91 54.62 2cw0 h ALA 64 Cb 0.75 0.13 0.02 0.00 0.00 0.00 0.00 17.79 18.68 2cw0 h ALA 64 CO -0.03 -1.14 -1.49 0.52 0.00 0.00 0.00 179.25 177.10 2cw0 h MET 65 N 0.19 0.40 0.00 0.00 2.86 -1.70 -3.04 114.93 113.64 2cw0 h MET 65 Ca 0.72 -0.69 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 2cw0 h MET 65 Cb 2.20 0.26 0.00 0.00 0.06 0.00 0.00 31.60 34.11 2cw0 h MET 65 CO -0.32 1.31 0.00 1.17 1.06 0.00 0.00 176.91 180.13 2cw0 n LYS 66 N -3.60 0.01 -0.07 1.72 3.00 0.11 -3.03 118.16 116.30 2cw0 n LYS 66 Ca -0.16 0.07 -0.12 0.00 -0.00 0.00 0.00 58.31 58.10 2cw0 n LYS 66 Cb 1.07 -1.52 -0.08 0.00 0.00 0.00 0.00 35.03 34.50 2cw0 n LYS 66 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 2cw0 h GLU 67 N 0.00 0.00 0.00 1.64 5.08 -0.29 -3.36 114.58 117.65 2cw0 h GLU 67 Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 2cw0 h GLU 67 Cb 0.45 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.70 2cw0 h GLU 67 CO 0.00 0.64 -0.03 1.25 -1.00 0.00 0.00 179.01 179.87 2cw0 h LEU 68 N -1.00 0.00 -0.45 1.33 5.85 -1.61 -2.17 115.31 117.27 2cw0 h LEU 68 Ca -0.09 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.63 2cw0 h LEU 68 Cb 0.79 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.80 2cw0 h LEU 68 CO -0.05 0.03 0.27 0.25 -0.34 0.00 0.00 178.44 178.59 2cw0 h LEU 69 N 0.00 0.54 -8.89 2.25 6.46 -1.69 -3.37 115.31 110.60 2cw0 h LEU 69 Ca -0.00 -0.06 -0.60 0.00 -0.12 0.00 0.00 57.88 57.11 2cw0 h LEU 69 Cb 0.05 -0.14 -0.09 0.00 -0.73 0.00 0.00 40.66 39.75 2cw0 h LEU 69 CO 0.00 0.44 0.54 -0.89 -0.62 0.00 0.00 178.44 177.91 2cw0 s THR 70 N -5.98 4.68 0.00 1.05 2.01 -0.81 -4.91 115.64 111.67 2cw0 s THR 70 Ca -0.13 1.27 -0.02 0.00 0.31 0.00 0.00 61.69 63.12 2cw0 s THR 70 Cb 0.11 -4.26 -0.02 0.00 0.01 0.00 0.00 72.50 68.35 2cw0 s THR 70 CO 0.74 -0.39 0.49 0.61 -0.69 0.00 0.00 174.62 175.38 2cw0 n GLY 71 N 4.21 0.65 0.03 4.40 0.00 -1.26 -4.13 105.19 109.09 2cw0 n GLY 71 Ca 0.06 -0.05 -0.03 0.00 0.00 0.00 0.00 46.02 46.00 2cw0 n GLY 71 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cw0 n ARG 72 N 3.78 2.82 -2.06 1.61 1.74 -1.26 -5.05 116.66 118.25 2cw0 n ARG 72 Ca 0.02 -0.01 -0.29 0.00 -0.77 0.00 0.00 57.85 56.81 2cw0 n ARG 72 Cb 0.04 -1.17 0.04 0.00 -1.02 0.00 0.00 32.46 30.34 2cw0 n ARG 72 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2cw0 s LEU 73 N -4.47 3.07 -0.05 0.55 1.43 -1.26 -5.10 118.68 112.85 2cw0 s LEU 73 Ca -0.03 1.05 -0.02 0.00 -1.03 0.00 0.00 54.13 54.09 2cw0 s LEU 73 Cb 0.02 -3.89 0.04 0.00 0.03 0.00 0.00 46.19 42.39 2cw0 s LEU 73 CO 0.28 -1.17 0.09 -0.69 0.23 0.00 0.00 176.35 175.09 2cw0 s VAL 74 N -3.21 -0.14 0.01 -1.59 1.01 -1.26 -5.08 120.40 110.13 2cw0 s VAL 74 Ca 0.56 0.36 0.02 0.00 0.00 0.00 0.00 61.98 62.92 2cw0 s VAL 74 Cb -0.11 -0.19 -0.01 0.00 0.00 0.00 0.00 36.38 36.07 2cw0 s VAL 74 CO 0.50 0.15 -0.08 0.72 0.00 0.00 0.00 175.10 176.39 2cw0 s PHE 75 N 1.96 0.69 0.00 5.22 -0.12 -1.26 -5.08 117.98 119.40 2cw0 s PHE 75 Ca 0.01 -0.22 0.00 0.00 -0.05 0.00 0.00 56.93 56.68 2cw0 s PHE 75 Cb -0.12 -0.43 0.00 0.00 -0.63 0.00 0.00 43.02 41.83 2cw0 s PHE 75 CO -0.04 -0.02 0.00 0.41 -0.05 0.00 0.00 175.22 175.52 2cw0 n GLY 76 N 2.52 3.70 0.09 1.99 0.00 -1.26 -5.03 105.19 107.20 2cw0 n GLY 76 Ca -0.15 -1.37 -0.03 0.00 0.00 0.00 0.00 46.02 44.46 2cw0 n GLY 76 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2cw0 h GLU 77 N 0.00 0.00 0.00 1.61 4.39 -2.03 -3.41 114.58 115.14 2cw0 h GLU 77 Ca 0.00 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.53 2cw0 h GLU 77 Cb 0.00 0.00 -0.13 0.00 -0.10 0.00 0.00 28.75 28.52 2cw0 h GLU 77 CO 0.00 0.71 -0.19 -1.71 -1.16 0.00 0.00 179.01 176.66 2cw0 n ASN 78 N -3.23 -1.80 0.00 1.42 2.85 -1.26 -5.07 115.26 108.16 2cw0 n ASN 78 Ca -0.02 -2.81 0.00 0.00 -0.11 0.00 0.00 54.58 51.64 2cw0 n ASN 78 Cb 0.87 1.56 0.00 0.00 1.24 0.00 0.00 39.78 43.45 2cw0 n ASN 78 CO 0.00 0.00 0.00 -0.11 -2.11 0.00 0.00 177.26 175.04 2cw0 n LEU 79 N 0.42 0.01 -4.41 1.20 7.94 -1.26 -4.81 117.00 116.09 2cw0 n LEU 79 Ca 0.00 0.94 -0.33 0.00 -1.11 0.00 0.00 56.01 55.52 2cw0 n LEU 79 Cb 0.73 -0.49 -0.14 0.00 0.53 0.00 0.00 43.42 44.05 2cw0 n LEU 79 CO -0.03 -0.49 -0.46 -0.69 -1.11 0.00 0.00 177.39 174.61 2cw0 s VAL 80 N -2.76 2.93 0.19 1.96 1.01 -1.26 -5.10 120.40 117.37 2cw0 s VAL 80 Ca 0.00 -0.74 -0.23 0.00 0.00 0.00 0.00 61.98 61.01 2cw0 s VAL 80 Cb 0.00 -2.17 -0.14 0.00 0.00 0.00 0.00 36.38 34.06 2cw0 s VAL 80 CO 0.00 0.56 0.41 -2.65 0.00 0.00 0.00 175.10 173.42 2cw0 n PRO 81 N 2.88 0.00 -0.16 2.72 -0.02 -1.26 -4.91 135.00 134.25 2cw0 n PRO 81 Ca -0.18 0.00 -0.02 0.00 -2.02 0.00 0.00 63.50 61.28 2cw0 n PRO 81 Cb 0.52 -0.85 0.06 0.00 -0.02 0.00 0.00 33.50 33.21 2cw0 n PRO 81 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 2cw0 h GLU 82 N 0.80 0.15 0.03 -0.52 9.09 -1.99 -3.20 114.58 118.94 2cw0 h GLU 82 Ca -0.25 -0.01 -0.39 0.00 0.05 0.00 0.00 59.36 58.77 2cw0 h GLU 82 Cb 1.22 -0.03 -0.05 0.00 -1.65 0.00 0.00 28.75 28.24 2cw0 h GLU 82 CO 0.48 0.10 -2.27 -3.47 0.05 0.00 0.00 179.01 173.89 2cw0 n ASP 83 N -5.19 2.00 0.29 3.06 -0.08 -1.26 -4.40 116.55 110.97 2cw0 n ASP 83 Ca 0.05 0.09 0.16 0.00 -1.51 0.00 0.00 54.79 53.58 2cw0 n ASP 83 Cb 0.26 -0.65 0.90 0.00 2.34 0.00 0.00 41.12 43.97 2cw0 n ASP 83 CO 0.00 0.00 0.00 -0.09 0.12 0.00 0.00 177.20 177.23 2cw0 h ARG 84 N -0.27 0.00 0.25 -0.67 2.43 -1.98 -3.12 114.38 111.02 2cw0 h ARG 84 Ca -0.55 0.00 0.01 0.00 -0.81 0.00 0.00 59.98 58.63 2cw0 h ARG 84 Cb 1.82 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 31.34 2cw0 h ARG 84 CO -0.12 0.05 -0.40 1.25 -1.51 0.00 0.00 179.97 179.23 2cw0 h LEU 85 N 0.00 -1.14 -1.22 3.80 5.85 -1.76 -1.95 115.31 118.90 2cw0 h LEU 85 Ca -0.00 0.11 -0.05 0.00 0.84 0.00 0.00 57.88 58.78 2cw0 h LEU 85 Cb 0.17 0.41 -0.02 0.00 0.37 0.00 0.00 40.66 41.59 2cw0 h LEU 85 CO 0.01 -0.51 -0.03 0.06 -0.34 0.00 0.00 178.44 177.63 2cw0 h GLN 86 N -0.72 0.50 0.54 1.25 3.07 -1.80 -2.33 115.11 115.62 2cw0 h GLN 86 Ca -0.00 -0.11 -0.02 0.00 0.09 0.00 0.00 58.65 58.61 2cw0 h GLN 86 Cb 0.69 -0.07 -0.02 0.00 0.08 0.00 0.00 27.48 28.16 2cw0 h GLN 86 CO -0.16 0.55 -0.51 -0.22 0.09 0.00 0.00 178.83 178.58 2cw0 h LYS 87 N 0.48 -1.00 -0.55 0.06 3.64 -1.41 -1.61 116.57 116.19 2cw0 h LYS 87 Ca 0.10 0.07 -0.10 0.00 -1.27 0.00 0.00 60.65 59.45 2cw0 h LYS 87 Cb 0.36 0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 32.38 2cw0 h LYS 87 CO 0.01 -0.67 -0.05 0.93 -2.27 0.00 0.00 179.45 177.41 2cw0 h GLU 88 N -1.04 1.00 -0.13 1.90 4.39 -1.35 -2.60 114.58 116.75 2cw0 h GLU 88 Ca -0.07 -0.34 0.03 0.00 0.34 0.00 0.00 59.36 59.32 2cw0 h GLU 88 Cb 0.89 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.46 2cw0 h GLU 88 CO -0.05 1.02 0.09 1.98 -1.16 0.00 0.00 179.01 180.90 2cw0 h MET 89 N 0.87 0.03 0.00 2.33 4.05 -1.38 0.50 114.93 121.34 2cw0 h MET 89 Ca 0.15 -0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.57 2cw0 h MET 89 Cb 0.60 -0.01 0.00 0.00 -0.80 0.00 0.00 31.60 31.40 2cw0 h MET 89 CO 0.04 0.02 0.00 0.93 0.23 0.00 0.00 176.91 178.13 2cw0 h GLU 90 N 0.03 0.00 0.07 0.39 5.08 -0.91 -3.06 114.58 116.18 2cw0 h GLU 90 Ca 0.06 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.14 2cw0 h GLU 90 Cb 0.20 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 2cw0 h GLU 90 CO -0.00 0.00 -1.46 -0.09 -1.00 0.00 0.00 179.01 176.45 2cw0 h ARG 91 N 0.00 0.14 0.00 2.33 2.43 0.23 -3.37 114.38 116.13 2cw0 h ARG 91 Ca 0.00 -0.24 -0.03 0.00 -0.81 0.00 0.00 59.98 58.90 2cw0 h ARG 91 Cb 0.74 0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.37 2cw0 h ARG 91 CO 0.00 0.96 -1.20 -0.89 -1.51 0.00 0.00 179.97 177.33 2cw0 n ILE 92 N -3.34 0.66 -3.99 1.20 5.41 -0.71 -4.87 119.36 113.72 2cw0 n ILE 92 Ca -0.13 -0.57 -0.34 0.00 1.00 0.00 0.00 62.75 62.70 2cw0 n ILE 92 Cb 1.02 -0.37 -0.15 0.00 -0.71 0.00 0.00 39.64 39.43 2cw0 n ILE 92 CO 0.00 0.00 0.00 -0.31 0.00 0.00 0.00 176.55 176.24 2cw0 s TYR 93 N -3.30 3.04 0.32 1.39 4.12 -1.16 -5.11 117.35 116.66 2cw0 s TYR 93 Ca -0.02 -1.61 -0.03 0.00 0.02 0.00 0.00 57.07 55.43 2cw0 s TYR 93 Cb 0.10 -2.03 -0.04 0.00 -1.52 0.00 0.00 41.96 38.46 2cw0 s TYR 93 CO 0.81 -0.75 0.57 -1.25 0.02 0.00 0.00 175.55 174.95 2cw0 s PRO 94 N 1.31 3.57 0.00 -1.71 0.04 -1.26 -4.68 135.00 132.27 2cw0 s PRO 94 Ca 0.00 -0.10 0.00 0.00 0.04 0.00 0.00 61.00 60.95 2cw0 s PRO 94 Cb -0.16 -2.63 0.00 0.00 0.04 0.00 0.00 34.50 31.74 2cw0 s PRO 94 CO -0.06 0.16 0.00 0.41 0.04 0.00 0.00 177.00 177.56 2cw0 n GLY 95 N -1.31 1.09 2.61 0.56 0.00 -1.26 -4.89 105.19 101.98 2cw0 n GLY 95 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 2cw0 n GLY 95 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11