#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ddb n LYS 3 N 0.00 0.00 -3.90 -1.58 2.85 -1.26 -5.04 118.16 109.23 2ddb n LYS 3 Ca 0.00 0.00 -0.32 0.00 -1.05 0.00 0.00 58.31 56.94 2ddb n LYS 3 Cb 0.00 0.00 -0.04 0.00 -0.65 0.00 0.00 35.03 34.34 2ddb n LYS 3 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 2ddb s ASN 4 N -0.64 6.37 0.26 -5.58 2.20 -1.26 -5.01 114.94 111.28 2ddb s ASN 4 Ca 0.00 0.31 -0.02 0.00 -0.94 0.00 0.00 52.86 52.21 2ddb s ASN 4 Cb 0.00 -1.98 0.47 0.00 -2.00 0.00 0.00 41.25 37.74 2ddb s ASN 4 CO 0.00 0.18 1.81 0.10 -2.94 0.00 0.00 177.10 176.25 2ddb h TYR 5 N 3.22 0.95 -0.03 1.54 -0.00 -1.99 -1.35 116.97 119.32 2ddb h TYR 5 Ca -0.46 0.03 0.03 0.00 -0.00 0.00 0.00 58.73 58.33 2ddb h TYR 5 Cb 1.17 -0.29 -0.04 0.00 -0.00 0.00 0.00 36.73 37.57 2ddb h TYR 5 CO 0.62 0.36 -0.17 1.96 -0.00 0.00 0.00 178.16 180.94 2ddb h GLN 6 N 0.84 -0.25 -0.99 0.10 4.20 -1.98 0.48 115.11 117.51 2ddb h GLN 6 Ca 0.44 0.02 0.01 0.00 0.06 0.00 0.00 58.65 59.18 2ddb h GLN 6 Cb 0.45 0.06 -0.05 0.00 0.30 0.00 0.00 27.48 28.24 2ddb h GLN 6 CO -0.27 -0.17 0.66 -0.22 -0.67 0.00 0.00 178.83 178.16 2ddb h LYS 7 N -0.26 1.30 -0.20 1.46 3.64 -1.81 -2.14 116.57 118.56 2ddb h LYS 7 Ca 0.06 -0.08 -0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2ddb h LYS 7 Cb 0.35 -0.29 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 2ddb h LYS 7 CO -0.18 0.86 0.11 1.49 -2.27 0.00 0.00 179.45 179.46 2ddb h GLU 8 N 1.34 0.28 0.26 1.90 4.81 -0.39 -0.47 114.58 122.31 2ddb h GLU 8 Ca 0.37 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.55 2ddb h GLU 8 Cb -0.15 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.18 2ddb h GLU 8 CO -0.08 0.26 -0.13 0.82 -0.73 0.00 0.00 179.01 179.15 2ddb h ILE 9 N 0.22 0.74 -0.26 2.32 2.04 -0.77 -1.61 117.51 120.20 2ddb h ILE 9 Ca 0.07 -0.02 -0.02 0.00 1.00 0.00 0.00 64.86 65.88 2ddb h ILE 9 Cb 0.06 0.76 -0.01 0.00 -0.74 0.00 0.00 36.82 36.89 2ddb h ILE 9 CO -0.01 0.01 0.07 0.58 0.00 0.00 0.00 178.15 178.79 2ddb h VAL 10 N -0.37 1.21 -1.00 1.67 2.07 -1.35 -1.91 116.25 116.57 2ddb h VAL 10 Ca -0.04 -0.68 0.02 0.00 0.82 0.00 0.00 66.70 66.82 2ddb h VAL 10 Cb 0.28 1.16 -0.05 0.00 -1.52 0.00 0.00 31.29 31.16 2ddb h VAL 10 CO 0.06 0.22 0.66 0.44 0.02 0.00 0.00 177.57 178.97 2ddb h ASP 11 N 0.25 1.14 0.01 0.57 5.19 -1.08 0.08 116.42 122.57 2ddb h ASP 11 Ca 0.08 -0.03 -0.00 0.00 -0.62 0.00 0.00 57.03 56.47 2ddb h ASP 11 Cb 0.27 -0.28 0.00 0.00 0.18 0.00 0.00 39.33 39.50 2ddb h ASP 11 CO 0.00 0.81 -0.00 0.50 -3.12 0.00 0.00 179.24 177.43 2ddb h LYS 12 N 1.34 -0.01 -0.28 3.56 1.63 -1.08 0.14 116.57 121.87 2ddb h LYS 12 Ca 0.37 0.00 0.03 0.00 -0.85 0.00 0.00 60.65 60.21 2ddb h LYS 12 Cb -0.13 0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 31.47 2ddb h LYS 12 CO -0.09 0.29 0.07 0.45 -3.45 0.00 0.00 179.45 176.73 2ddb h HIS 13 N -0.31 0.12 -0.30 1.91 3.86 -1.18 -1.90 115.15 117.35 2ddb h HIS 13 Ca -0.00 0.02 -0.06 0.00 -1.16 0.00 0.00 60.37 59.17 2ddb h HIS 13 Cb 0.31 -0.01 -0.02 0.00 1.06 0.00 0.00 27.41 28.75 2ddb h HIS 13 CO 0.03 0.04 -0.06 -0.91 0.86 0.00 0.00 177.93 177.90 2ddb h ASN 14 N 0.18 0.45 -0.51 2.45 2.35 -0.90 0.25 115.58 119.85 2ddb h ASN 14 Ca 0.13 -0.10 -0.07 0.00 -0.55 0.00 0.00 56.30 55.71 2ddb h ASN 14 Cb 0.12 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 38.34 2ddb h ASN 14 CO -0.15 0.56 0.08 0.00 -1.65 0.00 0.00 177.43 176.27 2ddb h ALA 15 N 1.49 1.07 0.03 -0.83 0.00 -0.37 -1.64 119.26 119.01 2ddb h ALA 15 Ca 0.09 -0.25 -0.21 0.00 0.00 0.00 0.00 54.91 54.54 2ddb h ALA 15 Cb 0.39 -0.22 0.02 0.00 0.00 0.00 0.00 17.79 17.97 2ddb h ALA 15 CO 0.02 0.60 -0.86 -0.07 0.00 0.00 0.00 179.25 178.94 2ddb h LEU 16 N 0.86 0.70 -1.33 0.00 3.38 -0.80 -3.08 115.31 115.03 2ddb h LEU 16 Ca 0.17 -0.78 0.02 0.00 0.09 0.00 0.00 57.88 57.38 2ddb h LEU 16 Cb 0.40 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.90 2ddb h LEU 16 CO 0.01 1.40 0.47 0.03 0.09 0.00 0.00 178.44 180.43 2ddb h ARG 17 N 0.08 0.87 0.00 1.13 3.08 -0.43 -2.58 114.38 116.53 2ddb h ARG 17 Ca -0.12 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 59.88 2ddb h ARG 17 Cb 1.56 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 31.41 2ddb h ARG 17 CO 0.17 0.58 -0.14 0.07 -1.07 0.00 0.00 179.97 179.58 2ddb h ARG 18 N 0.90 0.00 -0.40 0.04 0.11 -1.34 -3.32 114.38 110.37 2ddb h ARG 18 Ca 0.27 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.35 2ddb h ARG 18 Cb -0.02 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.06 2ddb h ARG 18 CO -0.07 0.00 0.00 -1.13 0.10 0.00 0.00 179.97 178.87 2ddb n SER 19 N -2.41 3.09 -4.68 0.08 3.41 -0.99 -4.90 113.62 107.23 2ddb n SER 19 Ca 0.05 -1.94 -0.45 0.00 -0.26 0.00 0.00 58.87 56.26 2ddb n SER 19 Cb 0.46 -0.26 -0.04 0.00 -0.26 0.00 0.00 64.21 64.11 2ddb n SER 19 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 2ddb n VAL 20 N 0.86 0.12 -4.45 -3.33 0.24 -1.13 -5.01 118.33 105.63 2ddb n VAL 20 Ca 0.15 -0.03 -0.33 0.00 -2.04 0.00 0.00 64.34 62.08 2ddb n VAL 20 Cb 0.47 -1.60 -0.16 0.00 -1.47 0.00 0.00 33.84 31.08 2ddb n VAL 20 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 2ddb s LYS 21 N 0.77 3.12 0.82 7.34 2.36 -1.26 -3.06 119.74 129.84 2ddb s LYS 21 Ca 0.77 -0.79 -0.11 0.00 -2.55 0.00 0.00 55.97 53.29 2ddb s LYS 21 Cb -0.65 -2.58 0.09 0.00 -1.05 0.00 0.00 37.83 33.64 2ddb s LYS 21 CO 0.39 -0.05 1.10 -1.25 1.55 0.00 0.00 175.35 177.08 2ddb s PRO 22 N 0.95 1.83 0.61 4.03 0.04 -1.26 -4.99 135.00 136.21 2ddb s PRO 22 Ca -0.03 1.17 -0.17 0.00 0.04 0.00 0.00 61.00 62.01 2ddb s PRO 22 Cb -0.15 -1.85 -0.02 0.00 0.04 0.00 0.00 34.50 32.52 2ddb s PRO 22 CO -0.03 -1.95 1.13 0.95 0.04 0.00 0.00 177.00 177.14 2ddb s THR 23 N -2.86 3.15 -0.02 1.26 -4.23 -1.17 -4.90 115.64 106.88 2ddb s THR 23 Ca 0.63 0.61 -0.01 0.00 -1.18 0.00 0.00 61.69 61.74 2ddb s THR 23 Cb -0.18 -3.16 -0.04 0.00 1.34 0.00 0.00 72.50 70.46 2ddb s THR 23 CO 0.57 -0.26 0.06 0.00 -0.54 0.00 0.00 174.62 174.45 2ddb s ALA 24 N -2.07 3.52 -0.13 3.99 0.00 -1.22 -1.01 121.76 124.83 2ddb s ALA 24 Ca 0.70 -0.86 0.19 0.00 0.00 0.00 0.00 51.96 51.99 2ddb s ALA 24 Cb -0.23 -1.56 -0.17 0.00 0.00 0.00 0.00 23.12 21.17 2ddb s ALA 24 CO 0.36 0.67 0.67 0.54 0.00 0.00 0.00 175.76 178.00 2ddb n ARG 25 N 1.38 0.64 -1.75 0.00 1.74 0.27 -2.45 116.66 116.48 2ddb n ARG 25 Ca -0.14 0.09 0.03 0.00 -0.77 0.00 0.00 57.85 57.06 2ddb n ARG 25 Cb 0.53 -1.71 0.03 0.00 -1.02 0.00 0.00 32.46 30.29 2ddb n ARG 25 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 2ddb n ASN 26 N -2.71 1.17 -4.58 0.55 6.94 -1.26 -1.52 115.26 113.85 2ddb n ASN 26 Ca -0.11 -2.08 -0.43 0.00 -0.02 0.00 0.00 54.58 51.94 2ddb n ASN 26 Cb 0.79 -0.34 -0.03 0.00 -2.36 0.00 0.00 39.78 37.84 2ddb n ASN 26 CO 0.00 0.00 0.00 -0.32 -1.03 0.00 0.00 177.26 175.91 2ddb s MET 27 N -0.92 3.65 0.35 -3.83 1.75 -1.26 -4.67 119.30 114.36 2ddb s MET 27 Ca 0.33 0.37 -0.27 0.00 -1.25 0.00 0.00 55.69 54.87 2ddb s MET 27 Cb 0.38 -3.90 -0.09 0.00 2.84 0.00 0.00 34.83 34.05 2ddb s MET 27 CO -0.14 -1.23 1.10 -0.51 -0.65 0.00 0.00 175.02 173.59 2ddb s LEU 28 N 3.94 4.33 0.22 4.11 1.43 -0.88 -0.59 118.68 131.24 2ddb s LEU 28 Ca 0.41 2.21 -0.30 0.00 -1.03 0.00 0.00 54.13 55.42 2ddb s LEU 28 Cb -0.09 -3.91 -0.09 0.00 0.03 0.00 0.00 46.19 42.13 2ddb s LEU 28 CO 0.27 -0.38 1.33 -1.58 0.23 0.00 0.00 176.35 176.21 2ddb s GLN 29 N -2.00 4.37 0.32 1.70 0.74 0.80 -4.74 119.66 120.85 2ddb s GLN 29 Ca 0.52 2.10 -0.11 0.00 0.05 0.00 0.00 55.36 57.91 2ddb s GLN 29 Cb -0.28 -3.17 -0.07 0.00 1.10 0.00 0.00 33.01 30.58 2ddb s GLN 29 CO 0.36 -0.27 0.68 -1.64 -0.55 0.00 0.00 175.29 173.88 2ddb s MET 30 N -0.29 3.85 0.05 1.67 -1.94 -1.26 -4.71 119.30 116.69 2ddb s MET 30 Ca 0.56 0.45 -0.06 0.00 -1.71 0.00 0.00 55.69 54.94 2ddb s MET 30 Cb -0.37 -2.49 -0.01 0.00 2.01 0.00 0.00 34.83 33.96 2ddb s MET 30 CO 0.40 0.14 0.11 -1.59 -0.01 0.00 0.00 175.02 174.08 2ddb s LYS 31 N -3.25 0.68 0.25 2.03 -2.85 -0.06 -4.97 119.74 111.57 2ddb s LYS 31 Ca 0.51 -0.87 -0.30 0.00 -1.00 0.00 0.00 55.97 54.31 2ddb s LYS 31 Cb -0.10 0.27 -0.09 0.00 -2.06 0.00 0.00 37.83 35.84 2ddb s LYS 31 CO 0.23 -0.18 1.15 -0.46 0.10 0.00 0.00 175.35 176.19 2ddb s TRP 32 N -3.16 3.48 -0.10 1.78 -0.11 -1.26 -1.48 118.94 118.09 2ddb s TRP 32 Ca -0.00 1.59 0.03 0.00 1.22 0.00 0.00 56.10 58.94 2ddb s TRP 32 Cb 0.02 -3.37 0.01 0.00 -1.50 0.00 0.00 33.47 28.63 2ddb s TRP 32 CO -0.07 -0.88 -0.19 1.21 -4.62 0.00 0.00 176.95 172.40 2ddb s ASN 33 N -0.52 2.65 0.13 5.86 3.84 -0.13 -4.83 114.94 121.94 2ddb s ASN 33 Ca 0.47 -0.48 0.05 0.00 0.21 0.00 0.00 52.86 53.12 2ddb s ASN 33 Cb -0.33 -1.21 -0.17 0.00 -0.55 0.00 0.00 41.25 38.99 2ddb s ASN 33 CO 0.41 0.10 1.29 -1.28 -2.79 0.00 0.00 177.10 174.82 2ddb h SER 34 N 6.93 0.10 -0.38 -4.21 0.87 -1.96 -2.50 113.55 112.39 2ddb h SER 34 Ca -0.25 -0.10 -0.01 0.00 -1.23 0.00 0.00 61.79 60.20 2ddb h SER 34 Cb 1.21 -0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 63.12 2ddb h SER 34 CO 0.48 1.04 0.19 -0.74 -0.53 0.00 0.00 176.83 177.27 2ddb h HIS 35 N 0.02 0.55 -0.25 2.24 6.17 -1.98 -1.43 115.15 120.48 2ddb h HIS 35 Ca -0.03 -0.02 0.00 0.00 0.71 0.00 0.00 60.37 61.03 2ddb h HIS 35 Cb 1.74 -0.17 -0.01 0.00 2.52 0.00 0.00 27.41 31.48 2ddb h HIS 35 CO 0.01 0.45 0.16 0.00 0.71 0.00 0.00 177.93 179.26 2ddb h ALA 36 N 1.04 0.31 -0.61 5.26 0.00 -1.91 -1.79 119.26 121.56 2ddb h ALA 36 Ca 0.13 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 2ddb h ALA 36 Cb 0.10 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 2ddb h ALA 36 CO -0.02 -0.22 0.36 0.00 0.00 0.00 0.00 179.25 179.38 2ddb h ALA 37 N 1.10 1.50 -0.13 0.00 0.00 -1.32 0.26 119.26 120.67 2ddb h ALA 37 Ca 0.09 -0.07 -0.20 0.00 0.00 0.00 0.00 54.91 54.74 2ddb h ALA 37 Cb -0.03 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.51 2ddb h ALA 37 CO -0.03 0.43 -0.72 1.96 0.00 0.00 0.00 179.25 180.90 2ddb h GLN 38 N 0.83 0.60 -0.26 0.00 4.20 -1.04 0.34 115.11 119.78 2ddb h GLN 38 Ca 0.22 -0.47 -0.02 0.00 0.06 0.00 0.00 58.65 58.45 2ddb h GLN 38 Cb -0.03 0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.82 2ddb h GLN 38 CO -0.04 1.09 0.10 -0.91 -0.67 0.00 0.00 178.83 178.40 2ddb h ASN 39 N 0.42 0.36 -0.86 1.46 2.35 -0.80 -2.36 115.58 116.15 2ddb h ASN 39 Ca -0.03 -0.17 0.05 0.00 -0.55 0.00 0.00 56.30 55.60 2ddb h ASN 39 Cb 1.31 -0.09 -0.05 0.00 0.05 0.00 0.00 38.32 39.53 2ddb h ASN 39 CO 0.14 0.43 0.56 0.00 -1.65 0.00 0.00 177.43 176.91 2ddb h ALA 40 N 0.94 1.52 -0.27 -0.83 0.00 -0.33 -2.35 119.26 117.95 2ddb h ALA 40 Ca 0.09 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 2ddb h ALA 40 Cb 0.19 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2ddb h ALA 40 CO -0.01 0.37 0.00 -0.22 0.00 0.00 0.00 179.25 179.40 2ddb h LYS 41 N 1.01 0.47 -0.63 0.00 1.63 -0.83 -0.80 116.57 117.41 2ddb h LYS 41 Ca 0.36 -0.15 0.05 0.00 -0.85 0.00 0.00 60.65 60.06 2ddb h LYS 41 Cb 0.13 -0.04 -0.04 0.00 -0.60 0.00 0.00 32.23 31.68 2ddb h LYS 41 CO -0.12 0.63 0.42 0.00 -3.45 0.00 0.00 179.45 176.93 2ddb h ARG 42 N 0.25 0.67 0.15 1.90 3.08 -0.96 -0.54 114.38 118.93 2ddb h ARG 42 Ca 0.08 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.08 2ddb h ARG 42 Cb 0.42 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.32 2ddb h ARG 42 CO 0.01 0.44 -0.07 2.35 -1.07 0.00 0.00 179.97 181.63 2ddb h TRP 43 N 0.69 -0.18 -0.93 3.04 2.91 -1.37 -3.31 115.95 116.79 2ddb h TRP 43 Ca 0.26 -0.00 0.16 0.00 1.13 0.00 0.00 58.89 60.44 2ddb h TRP 43 Cb 0.18 0.06 -0.10 0.00 -0.51 0.00 0.00 29.16 28.79 2ddb h TRP 43 CO -0.00 0.23 0.54 0.00 -1.03 0.00 0.00 178.44 178.18 2ddb h ALA 44 N -0.45 1.46 0.00 2.65 0.00 -0.88 -0.25 119.26 121.79 2ddb h ALA 44 Ca -0.02 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2ddb h ALA 44 Cb 0.50 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2ddb h ALA 44 CO 0.03 -0.01 0.00 -0.44 0.00 0.00 0.00 179.25 178.83 2ddb h ASP 45 N 0.75 0.00 0.94 0.00 3.32 -1.23 -0.97 116.42 119.23 2ddb h ASP 45 Ca 0.51 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.56 2ddb h ASP 45 Cb 0.71 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.26 2ddb h ASP 45 CO -0.35 0.00 0.00 0.54 -1.72 0.00 0.00 179.24 177.71 2ddb n ARG 46 N -2.83 0.07 -3.75 3.56 1.74 -0.10 -4.93 116.66 110.42 2ddb n ARG 46 Ca -0.01 0.15 -0.25 0.00 -0.77 0.00 0.00 57.85 56.98 2ddb n ARG 46 Cb 0.15 -1.60 0.04 0.00 -1.02 0.00 0.00 32.46 30.02 2ddb n ARG 46 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2ddb s THR 48 N -3.47 1.55 -0.96 0.00 2.01 -1.26 -5.07 115.64 108.44 2ddb s THR 48 Ca 0.31 -0.63 -0.23 0.00 0.31 0.00 0.00 61.69 61.45 2ddb s THR 48 Cb -0.15 -1.45 0.06 0.00 0.01 0.00 0.00 72.50 70.97 2ddb s THR 48 CO 0.80 0.45 1.37 0.12 -0.69 0.00 0.00 174.62 176.67 2ddb s PHE 49 N 1.38 2.59 -0.18 4.92 5.36 -1.26 -4.85 117.98 125.94 2ddb s PHE 49 Ca 0.02 -0.81 -0.35 0.00 -0.96 0.00 0.00 56.93 54.83 2ddb s PHE 49 Cb -0.13 -4.62 0.14 0.00 -0.34 0.00 0.00 43.02 38.07 2ddb s PHE 49 CO -0.09 -1.88 1.23 0.00 -1.46 0.00 0.00 175.22 173.02 2ddb s ALA 50 N 4.71 -2.10 0.37 11.12 0.00 -1.26 -5.15 121.76 129.45 2ddb s ALA 50 Ca 0.42 1.52 -0.26 0.00 0.00 0.00 0.00 51.96 53.63 2ddb s ALA 50 Cb -0.02 -0.08 -0.09 0.00 0.00 0.00 0.00 23.12 22.93 2ddb s ALA 50 CO -0.06 -0.64 1.20 -1.01 0.00 0.00 0.00 175.76 175.24 2ddb s HIS 51 N -2.39 3.11 0.44 0.00 3.76 -1.26 -5.02 115.29 113.93 2ddb s HIS 51 Ca 0.10 1.54 -0.23 0.00 -0.15 0.00 0.00 55.06 56.32 2ddb s HIS 51 Cb -0.00 -3.45 -0.08 0.00 1.11 0.00 0.00 32.58 30.15 2ddb s HIS 51 CO -0.04 -1.37 1.10 -1.54 -0.85 0.00 0.00 174.74 172.03 2ddb s SER 52 N -0.95 6.42 0.30 1.40 1.04 -1.26 -4.99 113.70 115.66 2ddb s SER 52 Ca 0.54 2.13 -0.30 0.00 0.48 0.00 0.00 55.95 58.80 2ddb s SER 52 Cb -0.33 -2.59 -0.12 0.00 0.10 0.00 0.00 66.02 63.08 2ddb s SER 52 CO 0.42 -0.73 1.51 -2.65 0.98 0.00 0.00 173.24 172.77 2ddb n PRO 53 N -0.41 2.48 0.31 4.02 -0.02 -1.26 -4.87 135.00 135.25 2ddb n PRO 53 Ca 0.07 0.88 0.17 0.00 -2.02 0.00 0.00 63.50 62.60 2ddb n PRO 53 Cb 0.49 -2.61 0.99 0.00 -0.02 0.00 0.00 33.50 32.35 2ddb n PRO 53 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2ddb h PRO 54 N 4.21 0.00 0.00 0.52 0.11 -1.94 0.24 132.00 135.14 2ddb h PRO 54 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2ddb h PRO 54 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2ddb h PRO 54 CO 0.75 0.01 0.00 -2.95 -0.21 0.00 0.00 178.00 175.60 2ddb h ASN 55 N 0.00 0.00 0.41 -2.05 7.08 -1.98 -2.66 115.58 116.37 2ddb h ASN 55 Ca -0.00 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.22 2ddb h ASN 55 Cb 0.03 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.27 2ddb h ASN 55 CO 0.00 0.00 -0.34 0.35 -2.08 0.00 0.00 177.43 175.36 2ddb n THR 56 N -2.41 0.00 -2.99 6.14 -2.24 0.07 -4.37 114.28 108.49 2ddb n THR 56 Ca 0.02 -0.06 -0.23 0.00 -2.27 0.00 0.00 64.05 61.52 2ddb n THR 56 Cb 0.27 0.24 -0.03 0.00 -2.10 0.00 0.00 70.33 68.71 2ddb n THR 56 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 2ddb n ARG 57 N -1.11 2.29 -4.94 -0.78 1.85 -1.00 -4.83 116.66 108.14 2ddb n ARG 57 Ca 0.09 -4.20 -0.33 0.00 -1.00 0.00 0.00 57.85 52.42 2ddb n ARG 57 Cb 0.33 -1.99 -0.14 0.00 -1.05 0.00 0.00 32.46 29.61 2ddb n ARG 57 CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 177.63 178.57 2ddb s THR 58 N -3.71 2.83 -0.66 8.89 -4.23 -1.26 -1.62 115.64 115.88 2ddb s THR 58 Ca 0.44 -0.78 -0.08 0.00 -1.18 0.00 0.00 61.69 60.10 2ddb s THR 58 Cb 0.32 -2.12 0.17 0.00 1.34 0.00 0.00 72.50 72.21 2ddb s THR 58 CO -0.11 0.56 0.53 -0.69 -0.54 0.00 0.00 174.62 174.37 2ddb s VAL 59 N -0.22 4.45 0.00 2.29 1.01 -0.29 -4.95 120.40 122.69 2ddb s VAL 59 Ca -0.00 -2.57 0.00 0.00 0.00 0.00 0.00 61.98 59.41 2ddb s VAL 59 Cb -0.13 -3.84 0.00 0.00 0.00 0.00 0.00 36.38 32.41 2ddb s VAL 59 CO 0.03 -0.91 0.00 0.61 0.00 0.00 0.00 175.10 174.83 2ddb n GLY 60 N 3.92 0.42 0.23 4.51 0.00 -1.26 -1.29 105.19 111.72 2ddb n GLY 60 Ca 0.07 0.50 -0.13 0.00 0.00 0.00 0.00 46.02 46.46 2ddb n GLY 60 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2ddb h LYS 61 N 0.00 0.71 -5.83 1.61 -0.00 -2.02 -3.47 116.57 107.57 2ddb h LYS 61 Ca 0.00 -0.48 -0.64 0.00 -0.00 0.00 0.00 60.65 59.54 2ddb h LYS 61 Cb 0.00 0.07 -0.05 0.00 -0.00 0.00 0.00 32.23 32.25 2ddb h LYS 61 CO 0.00 1.10 -0.48 -0.51 -0.00 0.00 0.00 179.45 179.56 2ddb s LEU 62 N -8.46 4.37 -0.01 7.07 1.43 -0.41 -5.09 118.68 117.57 2ddb s LEU 62 Ca -0.09 0.37 -0.22 0.00 -1.03 0.00 0.00 54.13 53.16 2ddb s LEU 62 Cb 0.10 -2.64 -0.05 0.00 0.03 0.00 0.00 46.19 43.63 2ddb s LEU 62 CO 0.87 0.26 0.67 -0.60 0.23 0.00 0.00 176.35 177.77 2ddb s ARG 63 N -1.95 4.40 -0.06 1.70 3.52 -1.26 -1.14 118.95 124.17 2ddb s ARG 63 Ca 0.28 0.86 -0.01 0.00 -0.13 0.00 0.00 55.73 56.72 2ddb s ARG 63 Cb -0.13 -3.38 -0.03 0.00 -1.56 0.00 0.00 34.95 29.85 2ddb s ARG 63 CO 0.19 0.25 0.01 0.00 -0.81 0.00 0.00 175.30 174.94 2ddb n GLY 65 N 1.89 -1.15 3.64 0.00 0.00 0.22 -4.73 105.19 105.05 2ddb n GLY 65 Ca -0.17 -1.68 -0.07 0.00 0.00 0.00 0.00 46.02 44.09 2ddb n GLY 65 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2ddb s GLU 66 N -3.52 0.67 -0.09 1.61 2.12 -1.26 -2.09 118.70 116.14 2ddb s GLU 66 Ca 0.14 1.11 0.01 0.00 0.36 0.00 0.00 54.97 56.60 2ddb s GLU 66 Cb -0.00 0.16 -0.02 0.00 0.26 0.00 0.00 34.13 34.52 2ddb s GLU 66 CO 0.10 -0.13 -0.13 -0.80 -0.54 0.00 0.00 175.26 173.76 2ddb s ASN 67 N 1.45 4.08 0.01 -1.70 0.02 0.02 -5.00 114.94 113.82 2ddb s ASN 67 Ca -0.09 -0.24 0.06 0.00 -1.02 0.00 0.00 52.86 51.57 2ddb s ASN 67 Cb -0.05 -1.25 -0.02 0.00 0.02 0.00 0.00 41.25 39.96 2ddb s ASN 67 CO -0.17 0.26 -0.20 0.27 0.02 0.00 0.00 177.10 177.28 2ddb s ILE 68 N -0.21 1.58 -0.05 0.60 -4.36 -1.26 -1.10 121.20 116.41 2ddb s ILE 68 Ca 0.01 -0.96 -0.03 0.00 -0.26 0.00 0.00 60.65 59.40 2ddb s ILE 68 Cb -0.13 -1.33 0.02 0.00 1.25 0.00 0.00 42.46 42.27 2ddb s ILE 68 CO 0.03 0.35 0.11 0.12 0.24 0.00 0.00 174.94 175.79 2ddb s PHE 69 N -0.58 -0.12 -0.01 1.37 5.36 -0.10 -5.01 117.98 118.90 2ddb s PHE 69 Ca 0.07 0.34 0.04 0.00 -0.96 0.00 0.00 56.93 56.43 2ddb s PHE 69 Cb -0.08 -0.03 -0.01 0.00 -0.34 0.00 0.00 43.02 42.56 2ddb s PHE 69 CO 0.00 -0.10 -0.14 1.41 -1.46 0.00 0.00 175.22 174.93 2ddb s MET 70 N 0.57 1.11 0.08 10.12 -2.45 -1.26 -0.65 119.30 126.82 2ddb s MET 70 Ca -0.04 -0.50 -0.06 0.00 -1.25 0.00 0.00 55.69 53.83 2ddb s MET 70 Cb -0.06 -1.08 -0.01 0.00 1.25 0.00 0.00 34.83 34.93 2ddb s MET 70 CO -0.02 0.30 0.13 -1.54 1.05 0.00 0.00 175.02 174.93 2ddb s SER 71 N -0.34 0.22 0.00 1.11 1.04 -0.81 -5.00 113.70 109.92 2ddb s SER 71 Ca 0.05 -0.76 0.23 0.00 0.48 0.00 0.00 55.95 55.95 2ddb s SER 71 Cb -0.05 0.30 0.14 0.00 0.10 0.00 0.00 66.02 66.51 2ddb s SER 71 CO -0.00 -0.70 1.16 -1.54 0.98 0.00 0.00 173.24 173.14 2ddb n SER 72 N -0.02 0.75 -4.42 7.02 3.41 -1.26 -0.46 113.62 118.64 2ddb n SER 72 Ca -0.14 -0.63 -0.29 0.00 -0.26 0.00 0.00 58.87 57.55 2ddb n SER 72 Cb 0.62 0.62 -0.13 0.00 -0.26 0.00 0.00 64.21 65.06 2ddb n SER 72 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2ddb s GLN 73 N -3.00 1.58 0.52 4.33 -1.52 -1.26 -4.27 119.66 116.05 2ddb s GLN 73 Ca 0.10 -1.26 -0.20 0.00 -1.95 0.00 0.00 55.36 52.04 2ddb s GLN 73 Cb 0.17 -1.99 -0.06 0.00 -0.22 0.00 0.00 33.01 30.90 2ddb s GLN 73 CO 0.78 0.47 1.12 -1.25 -0.25 0.00 0.00 175.29 176.16 2ddb s PRO 74 N -2.00 3.49 0.07 2.91 0.04 -1.26 -4.86 135.00 133.39 2ddb s PRO 74 Ca 0.15 1.61 0.06 0.00 0.04 0.00 0.00 61.00 62.86 2ddb s PRO 74 Cb -0.10 -2.09 -0.03 0.00 0.04 0.00 0.00 34.50 32.32 2ddb s PRO 74 CO 0.07 -0.73 -0.16 -0.06 0.04 0.00 0.00 177.00 176.15 2ddb s PHE 75 N -1.75 1.40 0.53 0.56 0.08 -1.26 -5.13 117.98 112.40 2ddb s PHE 75 Ca 0.70 -0.42 -0.22 0.00 0.12 0.00 0.00 56.93 57.11 2ddb s PHE 75 Cb -0.24 -0.79 -0.05 0.00 -0.57 0.00 0.00 43.02 41.37 2ddb s PHE 75 CO 0.27 0.09 1.35 -1.25 -0.10 0.00 0.00 175.22 175.58 2ddb s PRO 76 N -1.61 3.25 0.34 0.24 0.04 -1.26 -4.87 135.00 131.14 2ddb s PRO 76 Ca 0.01 2.21 0.09 0.00 0.04 0.00 0.00 61.00 63.36 2ddb s PRO 76 Cb -0.09 -2.31 0.83 0.00 0.04 0.00 0.00 34.50 32.97 2ddb s PRO 76 CO 0.02 -1.09 1.81 -1.49 0.04 0.00 0.00 177.00 176.29 2ddb h TRP 77 N 1.60 0.91 -0.54 0.56 4.06 -1.97 -1.72 115.95 118.85 2ddb h TRP 77 Ca -0.51 0.03 -0.03 0.00 2.06 0.00 0.00 58.89 60.44 2ddb h TRP 77 Cb 1.29 -0.28 -0.03 0.00 -1.00 0.00 0.00 29.16 29.15 2ddb h TRP 77 CO 0.47 0.23 0.22 0.66 -3.56 0.00 0.00 178.44 176.46 2ddb h SER 78 N 0.68 0.69 -0.16 -3.49 4.64 -1.90 -1.29 113.55 112.72 2ddb h SER 78 Ca 0.54 -0.08 -0.12 0.00 -0.47 0.00 0.00 61.79 61.66 2ddb h SER 78 Cb 0.95 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 62.85 2ddb h SER 78 CO -0.30 0.62 -0.31 1.23 -0.87 0.00 0.00 176.83 177.19 2ddb h GLY 79 N 0.89 0.71 0.83 -0.77 0.00 -1.69 -1.46 103.07 101.59 2ddb h GLY 79 Ca 0.18 -0.65 -0.01 0.00 0.00 0.00 0.00 47.33 46.85 2ddb h GLY 79 CO -0.02 0.59 0.03 -2.08 0.00 0.00 0.00 176.54 175.07 2ddb h VAL 80 N 0.56 1.18 -0.57 4.60 2.07 -0.99 -0.47 116.25 122.63 2ddb h VAL 80 Ca 0.06 -0.56 -0.02 0.00 0.82 0.00 0.00 66.70 67.00 2ddb h VAL 80 Cb 0.81 1.34 -0.03 0.00 -1.52 0.00 0.00 31.29 31.89 2ddb h VAL 80 CO 0.07 0.17 0.27 0.58 0.02 0.00 0.00 177.57 178.67 2ddb h VAL 81 N 0.00 1.21 -0.66 2.57 2.07 -1.27 -2.17 116.25 117.99 2ddb h VAL 81 Ca 0.04 -0.59 -0.01 0.00 0.82 0.00 0.00 66.70 66.96 2ddb h VAL 81 Cb 0.23 0.55 -0.03 0.00 -1.52 0.00 0.00 31.29 30.52 2ddb h VAL 81 CO -0.00 0.24 0.38 -0.61 0.02 0.00 0.00 177.57 177.60 2ddb h GLN 82 N 0.77 0.90 -0.24 1.57 5.75 -1.17 -0.62 115.11 122.07 2ddb h GLN 82 Ca 0.19 -0.08 -0.01 0.00 -0.15 0.00 0.00 58.65 58.60 2ddb h GLN 82 Cb 0.13 -0.19 -0.01 0.00 1.07 0.00 0.00 27.48 28.48 2ddb h GLN 82 CO -0.02 0.64 0.11 0.00 -2.65 0.00 0.00 178.83 176.91 2ddb h ALA 83 N 1.51 0.31 -0.21 3.38 0.00 -0.65 0.14 119.26 123.74 2ddb h ALA 83 Ca 0.24 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.08 2ddb h ALA 83 Cb -0.01 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 2ddb h ALA 83 CO -0.04 -0.13 0.06 -1.49 0.00 0.00 0.00 179.25 177.65 2ddb h TRP 84 N 0.26 0.11 -0.99 0.00 6.55 -1.19 -2.89 115.95 117.79 2ddb h TRP 84 Ca 0.08 0.01 0.06 0.00 0.95 0.00 0.00 58.89 59.99 2ddb h TRP 84 Cb 0.12 -0.02 -0.07 0.00 -0.86 0.00 0.00 29.16 28.34 2ddb h TRP 84 CO -0.02 0.05 0.64 -0.92 -1.05 0.00 0.00 178.44 177.14 2ddb h TYR 85 N 0.15 1.19 0.00 0.49 3.20 -0.76 -2.88 116.97 118.36 2ddb h TYR 85 Ca 0.09 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.99 2ddb h TYR 85 Cb 0.07 -0.39 0.00 0.00 1.54 0.00 0.00 36.73 37.95 2ddb h TYR 85 CO -0.13 0.63 0.00 -0.25 -1.64 0.00 0.00 178.16 176.77 2ddb n ASP 86 N -4.50 0.00 0.11 -2.11 8.00 0.46 -1.12 116.55 117.38 2ddb n ASP 86 Ca 0.15 -0.05 0.10 0.00 0.71 0.00 0.00 54.79 55.71 2ddb n ASP 86 Cb 0.17 -0.08 0.45 0.00 -0.02 0.00 0.00 41.12 41.64 2ddb n ASP 86 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2ddb n GLU 87 N -1.08 0.14 0.06 -1.24 1.02 -1.11 -2.42 120.64 116.02 2ddb n GLU 87 Ca 0.03 0.43 0.21 0.00 -0.02 0.00 0.00 57.16 57.81 2ddb n GLU 87 Cb 0.02 -1.80 0.74 0.00 -0.02 0.00 0.00 31.44 30.37 2ddb n GLU 87 CO 0.00 0.00 0.00 0.97 1.18 0.00 0.00 177.13 179.28 2ddb h ILE 88 N 0.00 0.40 0.00 -3.67 2.10 -1.38 -0.23 117.51 114.73 2ddb h ILE 88 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.94 2ddb h ILE 88 Cb 0.27 0.64 0.00 0.00 -1.09 0.00 0.00 36.82 36.64 2ddb h ILE 88 CO 0.00 0.00 0.00 0.29 -1.08 0.00 0.00 178.15 177.36 2ddb n LYS 89 N -3.78 0.12 -0.74 2.19 5.02 -1.02 -1.37 118.16 118.58 2ddb n LYS 89 Ca 0.08 0.53 0.03 0.00 -2.02 0.00 0.00 58.31 56.94 2ddb n LYS 89 Cb 0.65 -1.84 0.19 0.00 -0.02 0.00 0.00 35.03 34.02 2ddb n LYS 89 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2ddb n ASN 90 N -2.09 1.99 -3.93 4.39 5.03 -0.10 -4.99 115.26 115.57 2ddb n ASN 90 Ca 0.00 -3.87 -0.14 0.00 0.87 0.00 0.00 54.58 51.43 2ddb n ASN 90 Cb 0.09 -0.51 -0.14 0.00 -1.02 0.00 0.00 39.78 38.20 2ddb n ASN 90 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.26 175.55 2ddb s PHE 91 N -3.24 0.31 -0.07 3.10 2.19 -0.47 -0.17 117.98 119.62 2ddb s PHE 91 Ca 0.39 -0.07 0.01 0.00 0.33 0.00 0.00 56.93 57.59 2ddb s PHE 91 Cb 0.37 -0.20 0.02 0.00 -1.31 0.00 0.00 43.02 41.90 2ddb s PHE 91 CO -0.06 -0.01 -0.10 0.08 1.83 0.00 0.00 175.22 176.96 2ddb s VAL 92 N -0.12 1.03 0.17 3.12 1.01 -0.26 -4.91 120.40 120.45 2ddb s VAL 92 Ca 0.01 -0.39 -0.33 0.00 0.00 0.00 0.00 61.98 61.27 2ddb s VAL 92 Cb -0.02 -0.98 -0.14 0.00 0.00 0.00 0.00 36.38 35.25 2ddb s VAL 92 CO -0.00 0.34 1.46 0.00 0.00 0.00 0.00 175.10 176.89 2ddb n TYR 93 N 4.11 2.05 0.00 5.22 9.36 -1.26 -0.59 117.16 136.05 2ddb n TYR 93 Ca -0.21 0.41 0.00 0.00 3.32 0.00 0.00 57.90 61.42 2ddb n TYR 93 Cb 0.51 -2.46 0.00 0.00 -0.63 0.00 0.00 39.34 36.76 2ddb n TYR 93 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2ddb n GLY 94 N 2.78 3.02 0.15 2.98 0.00 0.51 -4.72 105.19 109.90 2ddb n GLY 94 Ca 0.15 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.95 2ddb n GLY 94 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2ddb n ILE 95 N -0.94 1.49 0.00 -0.61 5.41 -0.72 -4.90 119.36 119.10 2ddb n ILE 95 Ca 0.00 -0.21 0.00 0.00 1.00 0.00 0.00 62.75 63.54 2ddb n ILE 95 Cb 0.00 -2.02 0.00 0.00 -0.71 0.00 0.00 39.64 36.91 2ddb n ILE 95 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2ddb n GLY 96 N 1.37 0.76 3.74 7.39 0.00 0.24 -4.76 105.19 113.94 2ddb n GLY 96 Ca -0.40 -1.68 -0.42 0.00 0.00 0.00 0.00 46.02 43.52 2ddb n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ddb s ALA 97 N -2.00 3.78 -0.23 4.61 0.00 -1.26 -1.10 121.76 125.56 2ddb s ALA 97 Ca 0.00 1.56 -0.03 0.00 0.00 0.00 0.00 51.96 53.48 2ddb s ALA 97 Cb 0.00 -3.65 0.12 0.00 0.00 0.00 0.00 23.12 19.59 2ddb s ALA 97 CO 0.00 -0.95 0.38 0.21 0.00 0.00 0.00 175.76 175.40 2ddb s LYS 98 N -0.12 0.34 0.65 0.00 2.20 0.76 -3.54 119.74 120.04 2ddb s LYS 98 Ca 0.65 0.63 -0.17 0.00 -0.36 0.00 0.00 55.97 56.72 2ddb s LYS 98 Cb -0.48 -0.32 -0.04 0.00 -1.51 0.00 0.00 37.83 35.48 2ddb s LYS 98 CO 0.44 -0.57 0.80 -0.35 -0.36 0.00 0.00 175.35 175.32 2ddb n PRO 99 N 5.37 0.61 0.33 4.03 -0.04 -1.26 -4.25 135.00 139.79 2ddb n PRO 99 Ca -0.04 0.25 0.21 0.00 -0.04 0.00 0.00 63.50 63.88 2ddb n PRO 99 Cb 0.50 -2.04 1.14 0.00 -0.04 0.00 0.00 33.50 33.06 2ddb n PRO 99 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 2ddb h PRO 100 N 0.07 0.00 0.00 0.54 0.13 -1.94 -1.70 132.00 129.11 2ddb h PRO 100 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2ddb h PRO 100 Cb 1.36 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.49 2ddb h PRO 100 CO 0.47 0.00 0.00 0.78 -0.23 0.00 0.00 178.00 179.02 2ddb h GLY 101 N 0.00 0.00 -2.19 1.56 0.00 -1.97 -3.46 103.07 97.01 2ddb h GLY 101 Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.81 2ddb h GLY 101 CO -0.00 0.00 0.48 -0.56 0.00 0.00 0.00 176.54 176.46 2ddb s SER 102 N -4.73 5.34 -0.18 0.19 0.01 -0.64 -5.01 113.70 108.68 2ddb s SER 102 Ca 0.09 2.39 -0.19 0.00 1.31 0.00 0.00 55.95 59.54 2ddb s SER 102 Cb 0.11 -2.60 -0.03 0.00 0.21 0.00 0.00 66.02 63.71 2ddb s SER 102 CO 0.57 -1.49 0.56 -0.69 0.41 0.00 0.00 173.24 172.59 2ddb s VAL 103 N -1.59 5.09 0.00 3.43 1.01 -1.26 -4.82 120.40 122.26 2ddb s VAL 103 Ca 0.75 1.05 0.00 0.00 0.00 0.00 0.00 61.98 63.78 2ddb s VAL 103 Cb -0.30 -3.88 0.00 0.00 0.00 0.00 0.00 36.38 32.20 2ddb s VAL 103 CO 0.33 0.18 0.31 2.30 0.00 0.00 0.00 175.10 178.22 2ddb n ILE 104 N 4.45 0.02 0.27 2.22 -6.64 -1.26 -4.85 119.36 113.56 2ddb n ILE 104 Ca -0.04 -0.30 0.14 0.00 -1.77 0.00 0.00 62.75 60.78 2ddb n ILE 104 Cb 0.50 1.39 0.73 0.00 -1.44 0.00 0.00 39.64 40.82 2ddb n ILE 104 CO 0.00 0.00 0.00 1.23 -1.77 0.00 0.00 176.55 176.01 2ddb h GLY 105 N 0.00 0.00 0.88 3.28 0.00 -1.95 -1.39 103.07 103.88 2ddb h GLY 105 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.19 2ddb h GLY 105 CO 0.00 0.00 -0.45 0.45 0.00 0.00 0.00 176.54 176.54 2ddb h HIS 106 N 0.00 0.70 -0.16 5.60 3.86 -1.88 -2.54 115.15 120.73 2ddb h HIS 106 Ca -0.00 -0.29 0.00 0.00 -1.16 0.00 0.00 60.37 58.92 2ddb h HIS 106 Cb 0.40 -0.12 -0.01 0.00 1.06 0.00 0.00 27.41 28.75 2ddb h HIS 106 CO 0.00 1.06 0.10 -0.92 0.86 0.00 0.00 177.93 179.03 2ddb h TYR 107 N 0.15 0.20 0.00 2.45 3.20 -1.24 -2.09 116.97 119.64 2ddb h TYR 107 Ca -0.02 0.00 -0.08 0.00 3.14 0.00 0.00 58.73 61.77 2ddb h TYR 107 Cb 1.08 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 39.27 2ddb h TYR 107 CO 0.11 0.15 -0.40 1.79 -1.64 0.00 0.00 178.16 178.17 2ddb h THR 108 N 0.20 1.04 -0.25 1.81 1.35 -1.34 -2.35 112.91 113.37 2ddb h THR 108 Ca 0.06 -1.49 -0.17 0.00 -0.55 0.00 0.00 66.41 64.26 2ddb h THR 108 Cb -0.00 1.86 -0.00 0.00 -1.73 0.00 0.00 68.15 68.28 2ddb h THR 108 CO -0.01 0.39 -0.52 -0.61 -0.25 0.00 0.00 175.52 174.51 2ddb h GLN 109 N 0.00 0.72 -0.66 4.72 5.75 -1.28 0.11 115.11 124.48 2ddb h GLN 109 Ca -0.00 -0.44 0.06 0.00 -0.15 0.00 0.00 58.65 58.11 2ddb h GLN 109 Cb 0.83 0.05 -0.05 0.00 1.07 0.00 0.00 27.48 29.37 2ddb h GLN 109 CO 0.05 1.06 0.36 0.28 -2.65 0.00 0.00 178.83 177.94 2ddb h VAL 110 N 0.56 0.96 -0.61 2.39 2.07 -0.89 -2.89 116.25 117.84 2ddb h VAL 110 Ca 0.02 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 67.31 2ddb h VAL 110 Cb 1.09 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 31.10 2ddb h VAL 110 CO 0.11 0.12 0.00 1.33 0.02 0.00 0.00 177.57 179.15 2ddb n VAL 111 N -4.80 2.14 -2.09 2.57 0.24 -0.93 -4.84 118.33 110.62 2ddb n VAL 111 Ca 0.08 -1.30 -0.42 0.00 -2.04 0.00 0.00 64.34 60.66 2ddb n VAL 111 Cb 0.17 -0.01 -0.03 0.00 -1.47 0.00 0.00 33.84 32.51 2ddb n VAL 111 CO 0.00 0.00 0.00 0.86 -2.14 0.00 0.00 176.83 175.55 2ddb s TRP 112 N -2.17 2.27 0.27 6.34 -0.11 0.02 -4.42 118.94 121.14 2ddb s TRP 112 Ca 0.52 0.41 -0.00 0.00 1.22 0.00 0.00 56.10 58.25 2ddb s TRP 112 Cb 0.36 -3.82 0.50 0.00 -1.50 0.00 0.00 33.47 29.00 2ddb s TRP 112 CO 0.21 -3.33 1.84 0.10 -4.62 0.00 0.00 176.95 171.15 2ddb h TYR 113 N 9.00 1.11 0.00 5.86 -0.00 -1.60 -2.75 116.97 128.59 2ddb h TYR 113 Ca -0.37 0.03 -0.01 0.00 -0.00 0.00 0.00 58.73 58.37 2ddb h TYR 113 Cb 1.17 -0.35 -0.00 0.00 -0.00 0.00 0.00 36.73 37.54 2ddb h TYR 113 CO 0.85 0.47 -0.65 -0.22 -0.00 0.00 0.00 178.16 178.61 2ddb h LYS 114 N 1.00 0.00 -5.89 0.10 1.63 -1.85 -2.34 116.57 109.23 2ddb h LYS 114 Ca 0.47 0.00 -0.47 0.00 -0.85 0.00 0.00 60.65 59.80 2ddb h LYS 114 Cb 0.40 0.00 -0.07 0.00 -0.60 0.00 0.00 32.23 31.96 2ddb h LYS 114 CO -0.24 0.04 1.25 -1.12 -3.45 0.00 0.00 179.45 175.92 2ddb s SER 115 N -5.73 5.91 0.00 4.20 0.01 -1.04 -4.31 113.70 112.74 2ddb s SER 115 Ca 0.02 -1.28 0.22 0.00 1.31 0.00 0.00 55.95 56.22 2ddb s SER 115 Cb 0.08 -2.57 -0.21 0.00 0.21 0.00 0.00 66.02 63.53 2ddb s SER 115 CO 0.75 -2.06 0.74 0.00 0.41 0.00 0.00 173.24 173.08 2ddb n HIS 116 N 11.18 0.09 -4.26 2.43 1.44 -1.05 -4.77 115.22 120.28 2ddb n HIS 116 Ca 0.38 0.03 -0.34 0.00 -2.01 0.00 0.00 57.72 55.77 2ddb n HIS 116 Cb 0.49 -0.35 -0.10 0.00 0.12 0.00 0.00 29.99 30.14 2ddb n HIS 116 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 2ddb s LEU 117 N -3.96 3.56 -0.01 2.39 1.43 -0.65 -0.88 118.68 120.56 2ddb s LEU 117 Ca -0.00 0.04 0.01 0.00 -1.03 0.00 0.00 54.13 53.14 2ddb s LEU 117 Cb 0.15 -1.86 -0.00 0.00 0.03 0.00 0.00 46.19 44.51 2ddb s LEU 117 CO 0.87 0.24 -0.04 -0.51 0.23 0.00 0.00 176.35 177.15 2ddb s ILE 118 N -0.06 0.30 -0.09 -0.59 2.07 -0.55 -0.45 121.20 121.83 2ddb s ILE 118 Ca 0.04 -0.15 -0.05 0.00 -1.41 0.00 0.00 60.65 59.08 2ddb s ILE 118 Cb -0.13 -0.26 0.04 0.00 0.13 0.00 0.00 42.46 42.24 2ddb s ILE 118 CO 0.02 0.09 0.21 -0.83 -1.91 0.00 0.00 174.94 172.52 2ddb s GLY 119 N -0.00 -0.12 0.11 1.50 0.00 -0.68 -0.96 107.32 107.16 2ddb s GLY 119 Ca 0.00 0.79 0.02 0.00 0.00 0.00 0.00 44.72 45.54 2ddb s GLY 119 CO -0.00 0.95 -0.07 0.00 0.00 0.00 0.00 173.10 173.97 2ddb s ALA 121 N -3.48 -1.53 0.20 0.00 0.00 -0.05 -4.77 121.76 112.13 2ddb s ALA 121 Ca 0.12 1.27 0.11 0.00 0.00 0.00 0.00 51.96 53.46 2ddb s ALA 121 Cb 0.04 -0.27 -0.04 0.00 0.00 0.00 0.00 23.12 22.84 2ddb s ALA 121 CO -0.04 -0.33 -0.24 -1.54 0.00 0.00 0.00 175.76 173.62 2ddb s SER 122 N -0.79 3.44 -0.03 0.00 1.04 -1.26 -0.94 113.70 115.15 2ddb s SER 122 Ca -0.08 -0.87 0.01 0.00 0.48 0.00 0.00 55.95 55.49 2ddb s SER 122 Cb -0.02 -0.26 0.02 0.00 0.10 0.00 0.00 66.02 65.86 2ddb s SER 122 CO 0.06 0.12 -0.05 0.00 0.98 0.00 0.00 173.24 174.35 2ddb s ALA 123 N -1.70 0.65 -0.54 5.32 0.00 -0.15 -4.92 121.76 120.43 2ddb s ALA 123 Ca 0.21 -0.10 -0.25 0.00 0.00 0.00 0.00 51.96 51.82 2ddb s ALA 123 Cb -0.08 -0.35 0.04 0.00 0.00 0.00 0.00 23.12 22.73 2ddb s ALA 123 CO 0.10 0.03 0.97 0.21 0.00 0.00 0.00 175.76 177.07 2ddb s LYS 124 N 0.65 3.40 0.07 0.00 2.20 -1.26 -1.22 119.74 123.58 2ddb s LYS 124 Ca -0.09 -0.10 -0.05 0.00 -0.36 0.00 0.00 55.97 55.37 2ddb s LYS 124 Cb -0.12 -4.02 -0.29 0.00 -1.51 0.00 0.00 37.83 31.89 2ddb s LYS 124 CO 0.00 -1.45 1.12 0.00 -0.36 0.00 0.00 175.35 174.65 2ddb n SER 126 N -3.53 -1.53 0.11 0.00 3.41 -1.07 -4.96 113.62 106.05 2ddb n SER 126 Ca -0.09 -1.81 0.10 0.00 -0.26 0.00 0.00 58.87 56.81 2ddb n SER 126 Cb 1.03 2.49 0.45 0.00 -0.26 0.00 0.00 64.21 67.91 2ddb n SER 126 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2ddb n SER 127 N -1.21 0.48 -0.31 4.04 3.41 -1.26 -2.08 113.62 116.68 2ddb n SER 127 Ca -0.02 0.66 0.06 0.00 -0.26 0.00 0.00 58.87 59.31 2ddb n SER 127 Cb 0.51 -0.74 0.13 0.00 -0.26 0.00 0.00 64.21 63.84 2ddb n SER 127 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2ddb n SER 128 N -2.07 2.66 -3.42 4.04 3.41 -1.26 -4.76 113.62 112.21 2ddb n SER 128 Ca 0.01 -2.58 -0.11 0.00 -0.26 0.00 0.00 58.87 55.92 2ddb n SER 128 Cb 0.13 -0.30 -0.10 0.00 -0.26 0.00 0.00 64.21 63.69 2ddb n SER 128 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 2ddb s LYS 129 N -2.02 0.30 -0.17 4.33 2.20 -0.88 -4.22 119.74 119.28 2ddb s LYS 129 Ca 0.23 0.51 0.01 0.00 -0.36 0.00 0.00 55.97 56.36 2ddb s LYS 129 Cb 0.19 -0.56 0.03 0.00 -1.51 0.00 0.00 37.83 35.98 2ddb s LYS 129 CO 0.05 -0.59 -0.14 0.71 -0.36 0.00 0.00 175.35 175.02 2ddb s TYR 130 N 2.49 2.34 -0.17 4.03 1.51 0.39 -0.66 117.35 127.28 2ddb s TYR 130 Ca 0.10 -1.39 -0.05 0.00 -1.01 0.00 0.00 57.07 54.72 2ddb s TYR 130 Cb -0.15 -1.66 -0.03 0.00 -0.11 0.00 0.00 41.96 40.01 2ddb s TYR 130 CO -0.14 -0.71 -0.00 -1.17 -1.11 0.00 0.00 175.55 172.41 2ddb s LEU 131 N 1.43 3.40 -0.15 -1.29 2.96 -0.36 -1.92 118.68 122.75 2ddb s LEU 131 Ca 0.03 -0.09 0.02 0.00 -0.22 0.00 0.00 54.13 53.87 2ddb s LEU 131 Cb -0.14 -1.84 0.01 0.00 0.50 0.00 0.00 46.19 44.73 2ddb s LEU 131 CO -0.10 0.15 -0.19 -0.31 -1.32 0.00 0.00 176.35 174.57 2ddb s TYR 132 N 0.51 2.52 -0.12 5.38 1.51 0.17 -0.97 117.35 126.34 2ddb s TYR 132 Ca -0.01 -1.33 0.02 0.00 -1.01 0.00 0.00 57.07 54.73 2ddb s TYR 132 Cb -0.14 -1.75 0.01 0.00 -0.11 0.00 0.00 41.96 39.98 2ddb s TYR 132 CO 0.02 -0.65 -0.18 0.08 -1.11 0.00 0.00 175.55 173.72 2ddb s VAL 133 N 1.04 1.74 -0.06 0.71 1.01 -0.12 -0.92 120.40 123.80 2ddb s VAL 133 Ca -0.03 -0.79 0.04 0.00 0.00 0.00 0.00 61.98 61.21 2ddb s VAL 133 Cb -0.14 -1.57 -0.02 0.00 0.00 0.00 0.00 36.38 34.65 2ddb s VAL 133 CO -0.06 0.49 -0.20 0.00 0.00 0.00 0.00 175.10 175.33 2ddb s GLN 135 N -0.26 2.15 -0.10 0.00 -0.21 0.46 -0.80 119.66 120.91 2ddb s GLN 135 Ca 0.00 -0.91 0.02 0.00 0.02 0.00 0.00 55.36 54.49 2ddb s GLN 135 Cb -0.13 -2.11 0.02 0.00 1.00 0.00 0.00 33.01 31.78 2ddb s GLN 135 CO 0.03 0.57 -0.13 0.71 -2.12 0.00 0.00 175.29 174.34 2ddb s TYR 136 N -0.68 1.76 -0.07 0.91 1.51 -0.89 -1.69 117.35 118.21 2ddb s TYR 136 Ca 0.11 -0.79 0.03 0.00 -1.01 0.00 0.00 57.07 55.40 2ddb s TYR 136 Cb -0.10 -1.30 0.01 0.00 -0.11 0.00 0.00 41.96 40.46 2ddb s TYR 136 CO 0.00 -0.43 -0.15 0.00 -1.11 0.00 0.00 175.55 173.86 2ddb s PRO 138 N 0.49 1.92 0.37 0.00 0.04 -1.26 -1.64 135.00 134.92 2ddb s PRO 138 Ca -0.13 0.70 -0.28 0.00 0.04 0.00 0.00 61.00 61.33 2ddb s PRO 138 Cb -0.15 -1.89 -0.11 0.00 0.04 0.00 0.00 34.50 32.38 2ddb s PRO 138 CO 0.04 -1.75 1.48 0.00 0.04 0.00 0.00 177.00 176.81 2ddb s ALA 139 N -3.10 3.57 0.31 8.56 0.00 -0.12 -4.17 121.76 126.82 2ddb s ALA 139 Ca 0.61 1.56 0.00 0.00 0.00 0.00 0.00 51.96 54.13 2ddb s ALA 139 Cb -0.15 -3.60 0.00 0.00 0.00 0.00 0.00 23.12 19.36 2ddb s ALA 139 CO 0.55 -1.04 0.00 0.41 0.00 0.00 0.00 175.76 175.68 2ddb n GLY 140 N 0.48 1.08 3.15 0.00 0.00 -1.26 -4.84 105.19 103.81 2ddb n GLY 140 Ca 0.01 -1.92 -0.18 0.00 0.00 0.00 0.00 46.02 43.93 2ddb n GLY 140 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2ddb n ASN 141 N -0.13 -5.03 -4.71 1.61 3.02 -1.26 -4.96 115.26 103.81 2ddb n ASN 141 Ca 0.00 -0.44 -0.42 0.00 -0.03 0.00 0.00 54.58 53.69 2ddb n ASN 141 Cb 0.00 -4.15 -0.03 0.00 -0.61 0.00 0.00 39.78 34.99 2ddb n ASN 141 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2ddb s ILE 142 N -3.26 3.13 0.18 2.41 -1.09 -1.26 -4.86 121.20 116.46 2ddb s ILE 142 Ca 0.40 0.75 -0.33 0.00 -2.23 0.00 0.00 60.65 59.25 2ddb s ILE 142 Cb -0.18 -3.48 -0.15 0.00 -1.58 0.00 0.00 42.46 37.07 2ddb s ILE 142 CO 0.59 0.04 1.28 -1.14 -1.23 0.00 0.00 174.94 174.47 2ddb n ARG 143 N 4.40 1.48 0.00 2.79 0.63 -1.26 -1.08 116.66 123.62 2ddb n ARG 143 Ca 0.13 0.53 0.00 0.00 -0.92 0.00 0.00 57.85 57.59 2ddb n ARG 143 Cb 0.41 -2.10 0.00 0.00 0.45 0.00 0.00 32.46 31.22 2ddb n ARG 143 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2ddb n GLY 144 N 2.18 2.74 0.65 5.14 0.00 -1.26 -4.77 105.19 109.86 2ddb n GLY 144 Ca 0.14 -0.64 0.11 0.00 0.00 0.00 0.00 46.02 45.63 2ddb n GLY 144 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2ddb n SER 145 N 1.09 2.35 0.26 1.61 7.64 -0.24 -4.46 113.62 121.87 2ddb n SER 145 Ca 0.00 -1.67 0.09 0.00 1.01 0.00 0.00 58.87 58.29 2ddb n SER 145 Cb 0.00 0.30 0.66 0.00 -1.01 0.00 0.00 64.21 64.16 2ddb n SER 145 CO 0.00 0.00 0.00 -0.29 -3.01 0.00 0.00 175.04 171.74 2ddb h ILE 146 N 3.19 0.96 0.00 0.44 2.10 -1.76 0.05 117.51 122.48 2ddb h ILE 146 Ca 0.00 -0.06 0.00 0.00 1.08 0.00 0.00 64.86 65.88 2ddb h ILE 146 Cb 0.83 1.03 0.00 0.00 -1.09 0.00 0.00 36.82 37.59 2ddb h ILE 146 CO 0.00 0.02 0.00 0.00 -1.08 0.00 0.00 178.15 177.09 2ddb n ALA 147 N -2.51 2.18 -3.48 0.18 0.00 -1.26 -3.98 120.51 111.64 2ddb n ALA 147 Ca -0.03 -0.03 -0.27 0.00 0.00 0.00 0.00 53.44 53.11 2ddb n ALA 147 Cb 0.10 -1.45 -0.10 0.00 0.00 0.00 0.00 19.45 18.01 2ddb n ALA 147 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2ddb n THR 148 N -2.03 -0.09 0.32 0.00 -2.24 -0.00 -0.36 114.28 109.87 2ddb n THR 148 Ca 0.05 -4.05 0.15 0.00 -2.27 0.00 0.00 64.05 57.93 2ddb n THR 148 Cb 0.37 -1.88 0.67 0.00 -2.10 0.00 0.00 70.33 67.39 2ddb n THR 148 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 2ddb h PRO 149 N 5.14 0.00 -3.94 -0.78 0.13 -1.67 -3.42 132.00 127.46 2ddb h PRO 149 Ca 0.20 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.22 2ddb h PRO 149 Cb 0.84 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 31.83 2ddb h PRO 149 CO 0.52 0.00 -0.41 1.52 -0.23 0.00 0.00 178.00 179.39 2ddb s TYR 150 N -3.58 0.33 -0.21 1.56 -0.85 -1.26 -1.61 117.35 111.72 2ddb s TYR 150 Ca 0.01 -0.75 -0.28 0.00 -0.52 0.00 0.00 57.07 55.53 2ddb s TYR 150 Cb 0.09 -0.13 0.00 0.00 0.38 0.00 0.00 41.96 42.30 2ddb s TYR 150 CO 0.42 -0.58 0.97 0.21 -1.52 0.00 0.00 175.55 175.05 2ddb s LYS 151 N -3.92 4.27 0.45 -3.49 2.20 -1.26 -5.00 119.74 113.00 2ddb s LYS 151 Ca 0.11 1.24 -0.21 0.00 -0.36 0.00 0.00 55.97 56.75 2ddb s LYS 151 Cb 0.05 -3.62 -0.10 0.00 -1.51 0.00 0.00 37.83 32.65 2ddb s LYS 151 CO -0.06 -0.54 1.00 -1.54 -0.36 0.00 0.00 175.35 173.84 2ddb s SER 152 N 1.21 6.65 0.00 1.43 1.04 -1.26 -0.57 113.70 122.20 2ddb s SER 152 Ca 0.42 1.82 0.00 0.00 0.48 0.00 0.00 55.95 58.67 2ddb s SER 152 Cb -0.16 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.41 2ddb s SER 152 CO 0.08 -0.57 0.00 0.61 0.98 0.00 0.00 173.24 174.35 2ddb n GLY 153 N -0.40 0.08 3.72 7.32 0.00 -0.18 -4.70 105.19 111.03 2ddb n GLY 153 Ca 0.08 -1.74 -0.42 0.00 0.00 0.00 0.00 46.02 43.94 2ddb n GLY 153 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2ddb n PRO 154 N -0.91 2.30 -1.63 1.61 -0.02 -1.26 -3.38 135.00 131.70 2ddb n PRO 154 Ca 0.00 0.81 -0.49 0.00 -2.02 0.00 0.00 63.50 61.79 2ddb n PRO 154 Cb 0.00 -2.43 -0.05 0.00 -0.02 0.00 0.00 33.50 30.99 2ddb n PRO 154 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2ddb n PRO 155 N 0.54 1.61 -1.62 0.52 -0.02 -1.22 -1.96 135.00 132.84 2ddb n PRO 155 Ca 0.04 0.58 -0.20 0.00 -2.02 0.00 0.00 63.50 61.90 2ddb n PRO 155 Cb 0.37 -2.29 -0.08 0.00 -0.02 0.00 0.00 33.50 31.48 2ddb n PRO 155 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ddb h ALA 157 N 0.06 1.50 -0.01 0.00 0.00 -1.21 0.16 119.26 119.76 2ddb h ALA 157 Ca -0.41 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.49 2ddb h ALA 157 Cb 1.28 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2ddb h ALA 157 CO 0.59 0.02 -0.17 -0.25 0.00 0.00 0.00 179.25 179.43 2ddb n ASP 158 N -3.82 1.25 -3.16 0.00 9.92 -0.58 -4.43 116.55 115.74 2ddb n ASP 158 Ca -0.03 -1.13 -0.19 0.00 -0.53 0.00 0.00 54.79 52.90 2ddb n ASP 158 Cb 0.10 0.10 -0.04 0.00 -0.64 0.00 0.00 41.12 40.64 2ddb n ASP 158 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2ddb h PRO 160 N 3.36 0.00 -0.31 0.00 0.13 -1.73 -2.47 132.00 130.98 2ddb h PRO 160 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 2ddb h PRO 160 Cb 0.95 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.08 2ddb h PRO 160 CO 0.46 0.03 0.00 0.43 -0.23 0.00 0.00 178.00 178.70 2ddb n SER 161 N -4.15 2.99 -2.14 1.44 7.64 -1.26 -4.52 113.62 113.62 2ddb n SER 161 Ca -0.03 -1.87 0.01 0.00 1.01 0.00 0.00 58.87 57.99 2ddb n SER 161 Cb 0.12 -0.20 0.04 0.00 -1.01 0.00 0.00 64.21 63.16 2ddb n SER 161 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ddb n ALA 162 N 1.03 2.62 -2.81 -0.43 0.00 -0.94 -5.09 120.51 114.89 2ddb n ALA 162 Ca 0.14 -2.63 -0.35 0.00 0.00 0.00 0.00 53.44 50.60 2ddb n ALA 162 Cb 0.48 -0.78 -0.10 0.00 0.00 0.00 0.00 19.45 19.06 2ddb n ALA 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ddb s VAL 164 N -0.12 -0.03 -1.46 0.00 1.01 -0.18 -4.92 120.40 114.69 2ddb s VAL 164 Ca 0.05 0.33 -0.00 0.00 0.00 0.00 0.00 61.98 62.36 2ddb s VAL 164 Cb -0.12 -0.18 0.00 0.00 0.00 0.00 0.00 36.38 36.08 2ddb s VAL 164 CO 0.02 0.16 0.27 0.59 0.00 0.00 0.00 175.10 176.14 2ddb n ASN 165 N 4.95 0.13 -0.57 3.32 3.02 -1.26 -0.77 115.26 124.08 2ddb n ASN 165 Ca -0.11 -1.11 -0.07 0.00 -0.03 0.00 0.00 54.58 53.26 2ddb n ASN 165 Cb 0.50 -2.51 -0.03 0.00 -0.61 0.00 0.00 39.78 37.13 2ddb n ASN 165 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2ddb n ARG 166 N -4.47 -1.13 -5.02 3.52 1.74 -1.26 -4.82 116.66 105.23 2ddb n ARG 166 Ca -0.32 0.69 -0.28 0.00 -0.77 0.00 0.00 57.85 57.17 2ddb n ARG 166 Cb 0.69 -4.73 -0.15 0.00 -1.02 0.00 0.00 32.46 27.25 2ddb n ARG 166 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2ddb s LEU 167 N -1.70 2.07 0.25 0.55 1.43 0.05 -4.63 118.68 116.68 2ddb s LEU 167 Ca 0.00 -0.42 -0.24 0.00 -1.03 0.00 0.00 54.13 52.44 2ddb s LEU 167 Cb 0.00 -1.12 -0.09 0.00 0.03 0.00 0.00 46.19 45.01 2ddb s LEU 167 CO 0.00 0.26 0.82 0.00 0.23 0.00 0.00 176.35 177.66 2ddb n THR 169 N 0.89 2.00 -2.93 0.00 -2.24 -0.10 -0.14 114.28 111.76 2ddb n THR 169 Ca -0.01 -1.99 -0.28 0.00 -2.27 0.00 0.00 64.05 59.50 2ddb n THR 169 Cb 0.50 -0.19 -0.04 0.00 -2.10 0.00 0.00 70.33 68.51 2ddb n THR 169 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2ddb n ASN 170 N -0.89 4.62 -4.77 3.42 6.94 -1.26 -5.04 115.26 118.27 2ddb n ASN 170 Ca 0.18 -3.69 -0.37 0.00 -0.02 0.00 0.00 54.58 50.68 2ddb n ASN 170 Cb 0.73 -0.58 -0.01 0.00 -2.36 0.00 0.00 39.78 37.55 2ddb n ASN 170 CO 0.00 0.00 0.00 -2.16 -1.03 0.00 0.00 177.26 174.07 2ddb s PRO 171 N -3.52 3.81 0.08 -0.53 0.04 -1.26 0.01 135.00 133.63 2ddb s PRO 171 Ca 0.49 1.75 -0.31 0.00 0.04 0.00 0.00 61.00 62.96 2ddb s PRO 171 Cb 0.28 -2.43 -0.06 0.00 0.04 0.00 0.00 34.50 32.33 2ddb s PRO 171 CO -0.14 -0.50 1.28 0.00 0.04 0.00 0.00 177.00 177.68 2ddb h ASN 173 N 6.87 0.44 -4.34 0.00 4.21 -1.93 -3.46 115.58 117.38 2ddb h ASN 173 Ca -0.41 -0.18 -0.49 0.00 1.21 0.00 0.00 56.30 56.43 2ddb h ASN 173 Cb 1.21 -0.12 0.07 0.00 -1.12 0.00 0.00 38.32 38.36 2ddb h ASN 173 CO 0.84 0.78 0.38 -0.31 -1.29 0.00 0.00 177.43 177.82 2ddb s TYR 174 N -4.28 3.32 -0.09 1.19 2.02 -1.26 -5.08 117.35 113.17 2ddb s TYR 174 Ca -0.06 0.98 -0.01 0.00 -0.37 0.00 0.00 57.07 57.61 2ddb s TYR 174 Cb 0.13 -3.01 0.03 0.00 -0.40 0.00 0.00 41.96 38.71 2ddb s TYR 174 CO 0.80 -1.11 -0.02 1.21 -1.57 0.00 0.00 175.55 174.86 2ddb s ASN 175 N -4.35 1.77 0.45 2.29 3.84 -1.26 -4.61 114.94 113.07 2ddb s ASN 175 Ca 0.57 -0.16 -0.24 0.00 0.21 0.00 0.00 52.86 53.25 2ddb s ASN 175 Cb -0.11 -0.55 -0.07 0.00 -0.55 0.00 0.00 41.25 39.97 2ddb s ASN 175 CO 0.51 -0.18 1.25 0.20 -2.79 0.00 0.00 177.10 176.09 2ddb s ASN 176 N 1.90 6.10 0.24 -4.21 0.01 -1.26 -4.53 114.94 113.18 2ddb s ASN 176 Ca 0.05 2.51 0.17 0.00 -0.71 0.00 0.00 52.86 54.88 2ddb s ASN 176 Cb -0.12 -2.62 0.04 0.00 0.41 0.00 0.00 41.25 38.95 2ddb s ASN 176 CO -0.06 -0.98 1.28 0.44 -1.51 0.00 0.00 177.10 176.27 2ddb h ASP 177 N 2.23 0.00 -4.32 -1.22 3.32 -1.29 -3.47 116.42 111.67 2ddb h ASP 177 Ca -0.50 0.00 -0.59 0.00 0.02 0.00 0.00 57.03 55.97 2ddb h ASP 177 Cb 1.25 0.00 -0.27 0.00 0.22 0.00 0.00 39.33 40.54 2ddb h ASP 177 CO 0.61 0.42 -0.84 -0.36 -1.72 0.00 0.00 179.24 177.34 2ddb s PHE 178 N -3.01 1.82 0.57 4.55 0.08 -1.26 -5.03 117.98 115.70 2ddb s PHE 178 Ca 0.02 -0.37 0.26 0.00 0.12 0.00 0.00 56.93 56.96 2ddb s PHE 178 Cb 0.08 -1.11 1.59 0.00 -0.57 0.00 0.00 43.02 43.01 2ddb s PHE 178 CO 0.76 0.06 2.15 0.77 -0.10 0.00 0.00 175.22 178.85 2ddb h SER 179 N 5.08 0.00 -0.51 1.36 0.02 -1.99 -2.61 113.55 114.91 2ddb h SER 179 Ca -0.42 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.53 2ddb h SER 179 Cb 1.15 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.69 2ddb h SER 179 CO 0.45 0.00 0.00 -0.46 -1.14 0.00 0.00 176.83 175.68 2ddb n ASN 180 N -4.05 4.82 0.10 3.07 6.94 -1.26 -4.56 115.26 120.32 2ddb n ASN 180 Ca -0.00 -2.75 0.16 0.00 -0.02 0.00 0.00 54.58 51.97 2ddb n ASN 180 Cb 0.22 -0.59 0.69 0.00 -2.36 0.00 0.00 39.78 37.74 2ddb n ASN 180 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2ddb h LYS 182 N 0.00 0.27 -0.61 0.00 1.63 -1.85 0.06 116.57 116.07 2ddb h LYS 182 Ca 0.16 -0.05 -0.07 0.00 -0.85 0.00 0.00 60.65 59.84 2ddb h LYS 182 Cb 0.64 -0.04 -0.02 0.00 -0.60 0.00 0.00 32.23 32.20 2ddb h LYS 182 CO -0.00 0.34 0.13 1.03 -3.45 0.00 0.00 179.45 177.50 2ddb h SER 183 N 0.14 0.95 -0.20 4.20 0.87 -1.56 -2.07 113.55 115.89 2ddb h SER 183 Ca 0.06 -0.25 0.01 0.00 -1.23 0.00 0.00 61.79 60.39 2ddb h SER 183 Cb 0.17 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 61.86 2ddb h SER 183 CO -0.01 0.95 0.09 -0.07 -0.53 0.00 0.00 176.83 177.27 2ddb h LEU 184 N 0.90 0.13 -0.66 2.23 3.38 -0.91 -1.76 115.31 118.63 2ddb h LEU 184 Ca 0.19 0.01 -0.10 0.00 0.09 0.00 0.00 57.88 58.07 2ddb h LEU 184 Cb 0.39 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 2ddb h LEU 184 CO 0.01 0.10 -0.05 0.00 0.09 0.00 0.00 178.44 178.60 2ddb h ALA 185 N 1.11 0.86 -0.22 1.53 0.00 -0.90 -1.67 119.26 119.96 2ddb h ALA 185 Ca 0.08 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 2ddb h ALA 185 Cb 0.03 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2ddb h ALA 185 CO -0.06 0.66 0.11 0.87 0.00 0.00 0.00 179.25 180.82 2ddb h LYS 186 N 0.91 0.32 -0.53 0.00 1.57 -1.26 -1.16 116.57 116.42 2ddb h LYS 186 Ca 0.16 -0.04 -0.07 0.00 -1.87 0.00 0.00 60.65 58.82 2ddb h LYS 186 Cb 0.59 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.82 2ddb h LYS 186 CO 0.04 0.32 0.04 0.87 -0.57 0.00 0.00 179.45 180.15 2ddb h LYS 187 N 0.24 0.90 0.00 3.15 1.57 -1.17 -3.29 116.57 117.98 2ddb h LYS 187 Ca 0.08 -0.27 0.00 0.00 -1.87 0.00 0.00 60.65 58.59 2ddb h LYS 187 Cb 0.11 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.32 2ddb h LYS 187 CO -0.01 0.91 -1.19 -1.13 -0.57 0.00 0.00 179.45 177.45 2ddb n SER 188 N -4.33 0.56 -2.29 0.86 3.41 -0.64 -4.95 113.62 106.24 2ddb n SER 188 Ca 0.02 -0.14 -0.18 0.00 -0.26 0.00 0.00 58.87 58.31 2ddb n SER 188 Cb 0.30 0.97 -0.02 0.00 -0.26 0.00 0.00 64.21 65.20 2ddb n SER 188 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2ddb n LYS 189 N -2.09 -1.78 -3.18 4.33 5.02 -0.44 -2.17 118.16 117.84 2ddb n LYS 189 Ca 0.01 0.92 -0.20 0.00 -2.02 0.00 0.00 58.31 57.02 2ddb n LYS 189 Cb 0.47 -5.53 -0.01 0.00 -0.02 0.00 0.00 35.03 29.95 2ddb n LYS 189 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2ddb n GLN 191 N -3.48 0.18 -3.35 0.00 6.02 -0.92 -4.78 117.38 111.04 2ddb n GLN 191 Ca -0.03 0.06 -0.38 0.00 -0.01 0.00 0.00 57.00 56.63 2ddb n GLN 191 Cb 0.55 -1.62 -0.06 0.00 1.02 0.00 0.00 30.24 30.13 2ddb n GLN 191 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 2ddb s THR 192 N -3.10 4.94 0.08 5.09 2.01 -1.26 -5.02 115.64 118.37 2ddb s THR 192 Ca 0.09 1.04 -0.34 0.00 0.31 0.00 0.00 61.69 62.79 2ddb s THR 192 Cb 0.15 -3.82 -0.18 0.00 0.01 0.00 0.00 72.50 68.66 2ddb s THR 192 CO 0.69 0.50 1.60 -0.33 -0.69 0.00 0.00 174.62 176.40 2ddb h GLU 193 N 5.15 -0.95 -0.02 4.92 4.39 -2.01 -2.99 114.58 123.07 2ddb h GLU 193 Ca -0.48 0.06 0.01 0.00 0.34 0.00 0.00 59.36 59.29 2ddb h GLU 193 Cb 1.21 0.22 -0.00 0.00 -0.10 0.00 0.00 28.75 30.07 2ddb h GLU 193 CO 0.66 -0.63 0.02 0.11 -1.16 0.00 0.00 179.01 178.00 2ddb h TRP 194 N -0.99 0.00 -0.37 4.33 5.08 -1.99 -1.35 115.95 120.66 2ddb h TRP 194 Ca -0.08 0.00 -0.11 0.00 1.08 0.00 0.00 58.89 59.78 2ddb h TRP 194 Cb 0.79 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.94 2ddb h TRP 194 CO -0.09 0.00 -0.19 0.82 -1.28 0.00 0.00 178.44 177.69 2ddb h ILE 195 N 0.00 1.28 -0.77 0.12 2.04 -1.94 0.13 117.51 118.37 2ddb h ILE 195 Ca 0.01 -1.32 -0.03 0.00 1.00 0.00 0.00 64.86 64.51 2ddb h ILE 195 Cb 0.04 1.35 -0.03 0.00 -0.74 0.00 0.00 36.82 37.43 2ddb h ILE 195 CO -0.00 0.44 0.36 0.11 0.00 0.00 0.00 178.15 179.06 2ddb h LYS 196 N 0.57 1.11 -0.01 2.37 1.57 -1.12 0.42 116.57 121.49 2ddb h LYS 196 Ca 0.08 -0.17 -0.00 0.00 -1.87 0.00 0.00 60.65 58.69 2ddb h LYS 196 Cb 0.74 -0.20 -0.00 0.00 0.08 0.00 0.00 32.23 32.86 2ddb h LYS 196 CO 0.06 0.87 -0.00 0.87 -0.57 0.00 0.00 179.45 180.68 2ddb h LYS 197 N 1.09 0.01 0.00 3.15 1.57 -1.31 -3.28 116.57 117.80 2ddb h LYS 197 Ca 0.26 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.04 2ddb h LYS 197 Cb 0.14 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.44 2ddb h LYS 197 CO -0.03 0.33 -0.76 0.87 -0.57 0.00 0.00 179.45 179.29 2ddb h LYS 198 N -0.30 0.00 -1.60 3.15 1.79 -0.66 -3.37 116.57 115.58 2ddb h LYS 198 Ca 0.00 0.00 -0.54 0.00 -2.18 0.00 0.00 60.65 57.94 2ddb h LYS 198 Cb 0.32 0.00 -0.41 0.00 -1.58 0.00 0.00 32.23 30.56 2ddb h LYS 198 CO 0.00 0.00 -0.84 0.00 -1.08 0.00 0.00 179.45 177.53 2ddb h PRO 200 N 2.77 1.27 0.52 0.00 0.13 -1.74 -1.11 132.00 133.84 2ddb h PRO 200 Ca 0.17 -0.10 -0.01 0.00 -0.87 0.00 0.00 66.00 65.19 2ddb h PRO 200 Cb 0.89 -0.28 -0.02 0.00 0.13 0.00 0.00 31.00 31.73 2ddb h PRO 200 CO 0.75 0.86 -0.43 0.00 -0.23 0.00 0.00 178.00 178.96 2ddb h ALA 201 N 1.33 -0.99 -0.21 -0.56 0.00 -1.81 0.41 119.26 117.43 2ddb h ALA 201 Ca 0.34 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 2ddb h ALA 201 Cb -0.10 0.58 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 2ddb h ALA 201 CO -0.07 -1.09 0.12 0.77 0.00 0.00 0.00 179.25 178.98 2ddb h SER 202 N -0.93 0.24 0.15 0.00 0.02 -1.83 -1.98 113.55 109.21 2ddb h SER 202 Ca -0.06 -0.01 -0.34 0.00 -0.84 0.00 0.00 61.79 60.54 2ddb h SER 202 Cb 0.80 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 63.27 2ddb h SER 202 CO -0.01 0.20 -1.76 0.00 -1.14 0.00 0.00 176.83 174.11 2ddb n PHE 204 N -3.64 0.00 -2.33 0.00 3.72 0.14 -4.90 117.46 110.44 2ddb n PHE 204 Ca -0.28 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.69 2ddb n PHE 204 Cb 1.02 -0.35 -0.02 0.00 -0.94 0.00 0.00 39.48 39.19 2ddb n PHE 204 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2ddb s HIS 206 N 5.40 2.91 -1.25 0.00 3.76 -1.26 -4.58 115.29 120.27 2ddb s HIS 206 Ca 0.62 -0.09 -0.08 0.00 -0.15 0.00 0.00 55.06 55.37 2ddb s HIS 206 Cb -0.15 -1.74 0.01 0.00 1.11 0.00 0.00 32.58 31.81 2ddb s HIS 206 CO 0.32 0.23 1.04 0.09 -0.85 0.00 0.00 174.74 175.57 2ddb n ASN 207 N 2.48 -5.99 -4.05 1.40 4.13 -1.26 -5.02 115.26 106.95 2ddb n ASN 207 Ca -0.18 -0.47 -0.13 0.00 1.68 0.00 0.00 54.58 55.48 2ddb n ASN 207 Cb 0.53 -4.62 -0.12 0.00 -1.54 0.00 0.00 39.78 34.03 2ddb n ASN 207 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 2ddb s LYS 208 N -6.15 0.50 -0.23 3.52 -0.14 -1.26 -4.94 119.74 111.04 2ddb s LYS 208 Ca 0.52 -0.72 -0.28 0.00 -1.36 0.00 0.00 55.97 54.14 2ddb s LYS 208 Cb -0.23 -0.27 0.00 0.00 -1.68 0.00 0.00 37.83 35.66 2ddb s LYS 208 CO 0.64 0.05 0.97 0.42 -0.76 0.00 0.00 175.35 176.66 2ddb s ILE 209 N -1.32 4.73 -1.23 2.17 -1.09 0.10 -4.79 121.20 119.78 2ddb s ILE 209 Ca -0.10 1.88 0.10 0.00 -2.23 0.00 0.00 60.65 60.30 2ddb s ILE 209 Cb -0.10 -4.25 0.08 0.00 -1.58 0.00 0.00 42.46 36.62 2ddb s ILE 209 CO 0.00 -0.14 0.81 0.00 -1.23 0.00 0.00 174.94 174.38