#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dme s SER 2 N 0.00 -0.12 -0.52 1.61 0.15 -1.26 -5.11 113.70 108.46 2dme s SER 2 Ca 0.00 -0.60 0.06 0.00 0.70 0.00 0.00 55.95 56.11 2dme s SER 2 Cb 0.00 0.49 0.22 0.00 -1.71 0.00 0.00 66.02 65.02 2dme s SER 2 CO 0.00 -0.93 0.53 -0.24 1.20 0.00 0.00 173.24 173.80 2dme n SER 3 N -0.25 1.48 -0.00 5.45 2.88 -1.26 -4.86 113.62 117.05 2dme n SER 3 Ca -0.11 -2.91 -0.00 0.00 -1.33 0.00 0.00 58.87 54.52 2dme n SER 3 Cb 0.63 -0.65 -0.00 0.00 -0.75 0.00 0.00 64.21 63.44 2dme n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dme n GLY 4 N 1.69 -0.01 2.98 0.46 0.00 -1.26 -5.01 105.19 104.04 2dme n GLY 4 Ca 0.25 -0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.98 2dme n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dme s SER 5 N -3.68 2.67 -0.55 1.61 0.15 -1.26 -5.09 113.70 107.54 2dme s SER 5 Ca -0.00 -0.51 -0.26 0.00 0.70 0.00 0.00 55.95 55.88 2dme s SER 5 Cb 0.00 -1.08 0.04 0.00 -1.71 0.00 0.00 66.02 63.26 2dme s SER 5 CO 0.01 -0.09 1.04 -0.44 1.20 0.00 0.00 173.24 174.96 2dme s SER 6 N 1.54 6.41 0.00 5.45 0.01 -1.26 -4.85 113.70 121.00 2dme s SER 6 Ca 0.04 -0.10 0.00 0.00 1.31 0.00 0.00 55.95 57.20 2dme s SER 6 Cb -0.13 -2.48 0.00 0.00 0.21 0.00 0.00 66.02 63.61 2dme s SER 6 CO -0.10 -1.30 0.00 0.61 0.41 0.00 0.00 173.24 172.87 2dme n GLY 7 N 5.06 2.11 3.41 3.44 0.00 -1.26 -5.16 105.19 112.79 2dme n GLY 7 Ca 0.05 0.11 0.01 0.00 0.00 0.00 0.00 46.02 46.19 2dme n GLY 7 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dme s SER 8 N 2.00 -1.21 0.34 1.61 0.15 -1.26 -5.03 113.70 110.30 2dme s SER 8 Ca 0.00 1.20 0.13 0.00 0.70 0.00 0.00 55.95 57.99 2dme s SER 8 Cb 0.00 2.19 1.09 0.00 -1.71 0.00 0.00 66.02 67.59 2dme s SER 8 CO 0.00 -0.23 1.61 0.00 1.20 0.00 0.00 173.24 175.83 2dme h ALA 9 N 7.98 1.82 -0.31 5.45 0.00 -1.98 0.47 119.26 132.69 2dme h ALA 9 Ca -0.20 0.25 0.04 0.00 0.00 0.00 0.00 54.91 55.00 2dme h ALA 9 Cb 1.13 0.31 -0.04 0.00 0.00 0.00 0.00 17.79 19.19 2dme h ALA 9 CO 0.16 -0.71 0.06 0.22 0.00 0.00 0.00 179.25 178.98 2dme h ASP 10 N 0.14 0.01 0.16 0.00 1.82 -2.01 -2.57 116.42 113.96 2dme h ASP 10 Ca 0.73 0.05 -0.01 0.00 -0.39 0.00 0.00 57.03 57.42 2dme h ASP 10 Cb 1.75 0.07 0.00 0.00 0.68 0.00 0.00 39.33 41.83 2dme h ASP 10 CO -0.72 0.04 -0.08 -0.61 -1.61 0.00 0.00 179.24 176.26 2dme h GLN 11 N 0.17 -0.20 -0.67 0.28 5.75 -0.51 -2.59 115.11 117.35 2dme h GLN 11 Ca 0.14 0.01 0.08 0.00 -0.15 0.00 0.00 58.65 58.74 2dme h GLN 11 Cb 0.16 0.05 -0.10 0.00 1.07 0.00 0.00 27.48 28.65 2dme h GLN 11 CO -0.19 -0.12 -0.52 0.82 -2.65 0.00 0.00 178.83 176.16 2dme h ILE 12 N -0.23 0.02 -0.55 2.39 2.04 -1.10 0.89 117.51 120.99 2dme h ILE 12 Ca -0.02 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.94 2dme h ILE 12 Cb 0.17 0.02 -0.08 0.00 -0.74 0.00 0.00 36.82 36.20 2dme h ILE 12 CO 0.04 0.00 0.09 0.03 0.00 0.00 0.00 178.15 178.31 2dme h ARG 13 N -0.21 0.22 0.20 2.37 3.08 -1.40 -1.07 114.38 117.57 2dme h ARG 13 Ca 0.15 -0.01 0.01 0.00 0.07 0.00 0.00 59.98 60.19 2dme h ARG 13 Cb 0.53 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.50 2dme h ARG 13 CO -0.75 0.14 -0.40 0.37 -1.07 0.00 0.00 179.97 178.27 2dme h GLN 14 N 0.22 -0.66 -0.75 0.04 4.15 -0.51 -2.06 115.11 115.55 2dme h GLN 14 Ca 0.28 0.04 0.12 0.00 0.77 0.00 0.00 58.65 59.87 2dme h GLN 14 Cb 0.40 0.15 -0.08 0.00 0.21 0.00 0.00 27.48 28.16 2dme h GLN 14 CO -0.38 -0.44 0.35 0.77 -1.93 0.00 0.00 178.83 177.20 2dme h SER 15 N -0.68 0.40 -0.30 -0.69 0.02 -0.54 -1.88 113.55 109.88 2dme h SER 15 Ca 0.01 0.09 0.07 0.00 -0.84 0.00 0.00 61.79 61.11 2dme h SER 15 Cb 0.68 0.03 -0.07 0.00 0.14 0.00 0.00 62.40 63.18 2dme h SER 15 CO -0.19 0.19 -0.15 0.58 -1.14 0.00 0.00 176.83 176.12 2dme h VAL 16 N 0.55 0.53 0.00 2.27 2.07 -0.59 -2.10 116.25 118.97 2dme h VAL 16 Ca 0.40 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.92 2dme h VAL 16 Cb 0.52 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 30.83 2dme h VAL 16 CO -0.34 0.00 0.00 0.54 0.02 0.00 0.00 177.57 177.79 2dme n ARG 17 N -5.33 0.00 -0.33 1.57 1.74 -0.71 -0.92 116.66 112.68 2dme n ARG 17 Ca 0.00 0.78 0.17 0.00 -0.77 0.00 0.00 57.85 58.03 2dme n ARG 17 Cb 0.24 -1.47 0.34 0.00 -1.02 0.00 0.00 32.46 30.54 2dme n ARG 17 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 2dme h HIS 18 N 0.00 0.12 -0.12 -1.55 2.76 -1.45 0.48 115.15 115.40 2dme h HIS 18 Ca 0.00 0.06 0.03 0.00 -2.20 0.00 0.00 60.37 58.26 2dme h HIS 18 Cb 0.00 0.11 -0.03 0.00 1.55 0.00 0.00 27.41 29.04 2dme h HIS 18 CO -0.45 -0.42 -0.05 0.77 -1.30 0.00 0.00 177.93 176.48 2dme h SER 19 N 0.02 -0.15 -0.53 3.26 0.02 -0.59 0.27 113.55 115.85 2dme h SER 19 Ca 0.64 0.04 0.03 0.00 -0.84 0.00 0.00 61.79 61.65 2dme h SER 19 Cb 1.38 0.09 -0.04 0.00 0.14 0.00 0.00 62.40 63.98 2dme h SER 19 CO -0.88 -0.06 0.32 -0.07 -1.14 0.00 0.00 176.83 175.00 2dme h LEU 20 N -0.03 0.51 -1.09 5.07 3.38 0.18 -2.00 115.31 121.33 2dme h LEU 20 Ca 0.06 0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.96 2dme h LEU 20 Cb 0.12 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 2dme h LEU 20 CO -0.14 0.36 -0.20 0.50 0.09 0.00 0.00 178.44 179.05 2dme h LYS 21 N 0.63 0.40 -0.05 1.13 3.64 -0.75 -3.05 116.57 118.52 2dme h LYS 21 Ca 0.22 -0.13 0.04 0.00 -1.27 0.00 0.00 60.65 59.50 2dme h LYS 21 Cb 0.03 -0.04 -0.06 0.00 -0.41 0.00 0.00 32.23 31.76 2dme h LYS 21 CO -0.10 0.59 -0.38 0.22 -2.27 0.00 0.00 179.45 177.51 2dme h ASP 22 N 0.36 -1.17 0.39 4.20 1.82 0.31 0.56 116.42 122.89 2dme h ASP 22 Ca 0.06 0.15 -0.02 0.00 -0.39 0.00 0.00 57.03 56.83 2dme h ASP 22 Cb 0.56 0.47 -0.00 0.00 0.68 0.00 0.00 39.33 41.04 2dme h ASP 22 CO 0.04 -0.42 -0.22 0.40 -1.61 0.00 0.00 179.24 177.42 2dme h ILE 23 N -0.51 0.00 -1.09 2.25 2.04 -1.49 -2.40 117.51 116.32 2dme h ILE 23 Ca 0.06 0.00 0.30 0.00 1.00 0.00 0.00 64.86 66.23 2dme h ILE 23 Cb 0.61 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.59 2dme h ILE 23 CO -0.33 0.00 0.70 -0.07 0.00 0.00 0.00 178.15 178.45 2dme h LEU 24 N -0.57 0.41 -1.43 1.44 3.38 -1.47 0.76 115.31 117.83 2dme h LEU 24 Ca -0.05 0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 2dme h LEU 24 Cb 0.45 0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 2dme h LEU 24 CO 0.06 0.02 0.25 0.24 0.09 0.00 0.00 178.44 179.11 2dme h MET 25 N 0.33 0.63 0.00 1.13 2.86 0.44 0.18 114.93 120.51 2dme h MET 25 Ca 0.64 -0.06 -0.17 0.00 -2.06 0.00 0.00 59.70 58.05 2dme h MET 25 Cb 1.72 -0.13 -0.03 0.00 0.06 0.00 0.00 31.60 33.22 2dme h MET 25 CO -0.34 0.47 -1.21 -0.22 1.06 0.00 0.00 176.91 176.68 2dme h LYS 26 N 0.64 0.00 0.00 1.72 3.11 0.89 -3.05 116.57 119.88 2dme h LYS 26 Ca 0.17 0.00 -0.11 0.00 -2.81 0.00 0.00 60.65 57.90 2dme h LYS 26 Cb 0.03 0.00 -0.02 0.00 -1.00 0.00 0.00 32.23 31.24 2dme h LYS 26 CO -0.03 0.43 -0.52 0.00 -2.81 0.00 0.00 179.45 176.53 2dme h ARG 27 N 0.00 0.00 0.08 1.90 2.47 -0.20 -1.93 114.38 116.69 2dme h ARG 27 Ca -0.13 0.00 -0.29 0.00 -1.26 0.00 0.00 59.98 58.30 2dme h ARG 27 Cb 1.62 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 29.92 2dme h ARG 27 CO 0.06 0.52 -1.49 1.37 0.56 0.00 0.00 179.97 180.99 2dme h LEU 28 N 0.00 0.26 -0.09 3.04 8.10 -0.76 -2.95 115.31 122.91 2dme h LEU 28 Ca -0.01 -0.38 -0.20 0.00 0.11 0.00 0.00 57.88 57.41 2dme h LEU 28 Cb 1.31 -0.09 -0.03 0.00 -0.44 0.00 0.00 40.66 41.41 2dme h LEU 28 CO 0.07 1.32 -0.94 0.00 -4.11 0.00 0.00 178.44 174.77 2dme h THR 29 N 0.05 1.67 0.03 0.15 1.03 -1.58 -3.26 112.91 110.99 2dme h THR 29 Ca -0.22 -3.25 -0.23 0.00 -0.01 0.00 0.00 66.41 62.71 2dme h THR 29 Cb 1.98 2.76 -0.00 0.00 -1.07 0.00 0.00 68.15 71.81 2dme h THR 29 CO 0.14 0.92 -0.99 0.44 -0.01 0.00 0.00 175.52 176.03 2dme h ASP 30 N 0.00 0.40 -4.15 0.00 5.19 -1.47 -3.46 116.42 112.93 2dme h ASP 30 Ca -0.01 -0.35 -0.28 0.00 -0.62 0.00 0.00 57.03 55.77 2dme h ASP 30 Cb 1.68 -0.13 0.07 0.00 0.18 0.00 0.00 39.33 41.14 2dme h ASP 30 CO 0.12 1.18 0.14 -1.20 -3.12 0.00 0.00 179.24 176.36 2dme n SER 31 N -3.66 0.57 -2.12 6.45 7.64 -1.11 -4.96 113.62 116.43 2dme n SER 31 Ca -0.06 -1.57 -0.19 0.00 1.01 0.00 0.00 58.87 58.06 2dme n SER 31 Cb 0.87 -0.48 -0.03 0.00 -1.01 0.00 0.00 64.21 63.56 2dme n SER 31 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2dme n ASN 32 N -3.14 6.26 -4.64 6.43 3.02 -1.26 -4.90 115.26 117.02 2dme n ASN 32 Ca 0.10 -3.01 -0.35 0.00 -0.03 0.00 0.00 54.58 51.30 2dme n ASN 32 Cb 0.36 -1.18 -0.10 0.00 -0.61 0.00 0.00 39.78 38.26 2dme n ASN 32 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2dme s LEU 33 N -1.64 3.86 -0.04 3.41 1.43 -1.23 -4.97 118.68 119.50 2dme s LEU 33 Ca 0.45 0.09 0.16 0.00 -1.03 0.00 0.00 54.13 53.80 2dme s LEU 33 Cb 0.29 -1.98 0.50 0.00 0.03 0.00 0.00 46.19 45.04 2dme s LEU 33 CO -0.09 0.17 1.42 1.17 0.23 0.00 0.00 176.35 179.25 2dme n LYS 34 N 3.55 3.01 -1.63 1.70 3.00 -1.26 -4.68 118.16 121.84 2dme n LYS 34 Ca -0.16 -2.46 -0.38 0.00 -0.00 0.00 0.00 58.31 55.31 2dme n LYS 34 Cb 0.52 -1.53 0.05 0.00 0.00 0.00 0.00 35.03 34.08 2dme n LYS 34 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.40 178.73 2dme n VAL 35 N 0.85 3.74 -1.47 3.15 0.24 -1.26 -4.96 118.33 118.62 2dme n VAL 35 Ca 0.19 -0.50 -0.32 0.00 -2.04 0.00 0.00 64.34 61.67 2dme n VAL 35 Cb 0.62 -1.20 0.07 0.00 -1.47 0.00 0.00 33.84 31.86 2dme n VAL 35 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 2dme s PRO 36 N -2.78 2.49 0.59 7.34 0.04 -1.26 -4.92 135.00 136.50 2dme s PRO 36 Ca 0.75 1.26 0.36 0.00 0.04 0.00 0.00 61.00 63.41 2dme s PRO 36 Cb -0.42 -1.92 1.82 0.00 0.04 0.00 0.00 34.50 34.02 2dme s PRO 36 CO 0.47 -1.47 2.17 1.49 0.04 0.00 0.00 177.00 179.70 2dme h GLU 37 N -0.64 0.00 0.00 4.56 4.81 -2.03 -1.47 114.58 119.82 2dme h GLU 37 Ca -0.45 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 58.71 2dme h GLU 37 Cb 1.24 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.61 2dme h GLU 37 CO 0.53 0.04 -0.34 1.49 -0.73 0.00 0.00 179.01 179.99 2dme h GLU 38 N 0.00 0.00 0.45 1.92 4.81 -2.00 -3.24 114.58 116.53 2dme h GLU 38 Ca -0.00 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 2dme h GLU 38 Cb 0.24 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.60 2dme h GLU 38 CO 0.00 0.34 -0.44 -0.22 -0.73 0.00 0.00 179.01 177.96 2dme h LYS 39 N 0.00 -0.88 -0.02 1.92 1.63 -1.62 0.19 116.57 117.80 2dme h LYS 39 Ca -0.00 0.06 0.02 0.00 -0.85 0.00 0.00 60.65 59.88 2dme h LYS 39 Cb 0.96 0.20 -0.03 0.00 -0.60 0.00 0.00 32.23 32.76 2dme h LYS 39 CO 0.04 -0.58 -0.14 0.00 -3.45 0.00 0.00 179.45 175.32 2dme h ALA 40 N -0.63 -0.15 0.10 5.00 0.00 -1.70 -1.74 119.26 120.13 2dme h ALA 40 Ca -0.05 0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.90 2dme h ALA 40 Cb 0.80 0.25 -0.05 0.00 0.00 0.00 0.00 17.79 18.79 2dme h ALA 40 CO -0.06 -0.63 -0.39 0.00 0.00 0.00 0.00 179.25 178.18 2dme h ALA 41 N 0.74 -0.66 -0.69 0.00 0.00 -1.55 -0.45 119.26 116.65 2dme h ALA 41 Ca 0.05 -0.06 0.15 0.00 0.00 0.00 0.00 54.91 55.05 2dme h ALA 41 Cb 0.29 0.65 -0.11 0.00 0.00 0.00 0.00 17.79 18.62 2dme h ALA 41 CO -0.15 -0.94 0.08 0.87 0.00 0.00 0.00 179.25 179.11 2dme h LYS 42 N -0.61 0.18 0.67 0.00 1.57 -0.45 -1.35 116.57 116.59 2dme h LYS 42 Ca 0.03 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.77 2dme h LYS 42 Cb 0.64 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.92 2dme h LYS 42 CO -0.24 0.12 -0.35 0.28 -0.57 0.00 0.00 179.45 178.69 2dme h VAL 43 N 0.18 0.00 -0.91 0.50 2.07 -0.66 -2.55 116.25 114.87 2dme h VAL 43 Ca 0.38 0.00 0.18 0.00 0.82 0.00 0.00 66.70 68.08 2dme h VAL 43 Cb 0.64 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 30.24 2dme h VAL 43 CO -0.54 0.00 -0.22 0.00 0.02 0.00 0.00 177.57 176.83 2dme h ALA 44 N -1.50 0.61 -0.85 1.67 0.00 -0.67 0.95 119.26 119.47 2dme h ALA 44 Ca -0.09 0.35 0.13 0.00 0.00 0.00 0.00 54.91 55.30 2dme h ALA 44 Cb 0.72 0.69 -0.06 0.00 0.00 0.00 0.00 17.79 19.14 2dme h ALA 44 CO 0.13 -0.39 0.55 1.15 0.00 0.00 0.00 179.25 180.69 2dme h THR 45 N 0.00 0.88 0.00 0.00 2.02 -1.14 0.36 112.91 115.02 2dme h THR 45 Ca 0.44 -0.24 0.00 0.00 0.77 0.00 0.00 66.41 67.38 2dme h THR 45 Cb 0.68 0.12 0.00 0.00 -1.74 0.00 0.00 68.15 67.20 2dme h THR 45 CO -0.93 0.13 0.00 0.29 0.37 0.00 0.00 175.52 175.37 2dme n LYS 46 N -4.54 0.23 -0.01 6.66 5.02 0.32 -2.44 118.16 123.40 2dme n LYS 46 Ca 0.16 0.31 -0.10 0.00 -2.02 0.00 0.00 58.31 56.66 2dme n LYS 46 Cb 0.42 -1.84 -0.08 0.00 -0.02 0.00 0.00 35.03 33.51 2dme n LYS 46 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 2dme h ILE 47 N 0.00 1.09 -0.06 -0.18 1.08 0.71 -3.21 117.51 116.93 2dme h ILE 47 Ca 0.00 -1.52 -0.01 0.00 -0.39 0.00 0.00 64.86 62.94 2dme h ILE 47 Cb 0.56 1.94 -0.00 0.00 -3.07 0.00 0.00 36.82 36.24 2dme h ILE 47 CO 0.00 0.32 -0.01 -0.33 -0.69 0.00 0.00 178.15 177.45 2dme h GLU 48 N -0.89 0.11 -1.26 2.37 3.07 -1.55 0.17 114.58 116.60 2dme h GLU 48 Ca -0.01 -0.04 0.36 0.00 -0.50 0.00 0.00 59.36 59.18 2dme h GLU 48 Cb 0.60 -0.01 -0.07 0.00 -0.84 0.00 0.00 28.75 28.43 2dme h GLU 48 CO 0.02 0.41 0.88 1.57 -1.40 0.00 0.00 179.01 180.49 2dme h LYS 49 N -0.20 0.08 0.07 2.33 2.10 -1.63 0.15 116.57 119.48 2dme h LYS 49 Ca 0.02 -0.01 -0.35 0.00 -2.00 0.00 0.00 60.65 58.31 2dme h LYS 49 Cb 0.37 -0.02 -0.03 0.00 -0.90 0.00 0.00 32.23 31.64 2dme h LYS 49 CO 0.00 0.06 -1.95 -1.91 -2.00 0.00 0.00 179.45 173.65 2dme n GLU 50 N -4.29 0.69 0.31 0.07 4.07 -1.09 -3.94 120.64 116.45 2dme n GLU 50 Ca 0.29 0.31 -0.16 0.00 -0.06 0.00 0.00 57.16 57.54 2dme n GLU 50 Cb 1.28 -1.67 -0.09 0.00 -0.06 0.00 0.00 31.44 30.90 2dme n GLU 50 CO 0.00 0.00 0.00 1.25 -0.06 0.00 0.00 177.13 178.32 2dme h LEU 51 N -0.25 -1.16 -1.87 4.31 5.85 0.11 0.17 115.31 122.46 2dme h LEU 51 Ca -0.45 0.08 0.29 0.00 0.84 0.00 0.00 57.88 58.64 2dme h LEU 51 Cb 1.82 0.36 -0.05 0.00 0.37 0.00 0.00 40.66 43.17 2dme h LEU 51 CO -0.04 -0.62 0.73 0.15 -0.34 0.00 0.00 178.44 178.32 2dme h PHE 52 N -0.96 0.14 0.17 1.25 3.57 -1.01 -1.21 116.94 118.89 2dme h PHE 52 Ca -0.07 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.42 2dme h PHE 52 Cb 0.80 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 39.50 2dme h PHE 52 CO -0.16 0.02 -0.08 1.03 -2.23 0.00 0.00 178.31 176.88 2dme h SER 53 N 0.09 -0.19 -0.73 0.41 0.87 -1.47 0.61 113.55 113.13 2dme h SER 53 Ca 0.51 0.01 0.12 0.00 -1.23 0.00 0.00 61.79 61.20 2dme h SER 53 Cb 1.88 0.05 -0.13 0.00 -0.44 0.00 0.00 62.40 63.76 2dme h SER 53 CO -0.06 0.09 -0.35 0.15 -0.53 0.00 0.00 176.83 176.12 2dme h PHE 54 N -0.68 -0.98 -0.04 2.24 3.57 -0.16 -0.56 116.94 120.34 2dme h PHE 54 Ca -0.02 0.08 -0.24 0.00 3.53 0.00 0.00 57.97 61.32 2dme h PHE 54 Cb 0.17 0.54 0.01 0.00 2.79 0.00 0.00 35.95 39.46 2dme h PHE 54 CO 0.02 -0.39 -0.94 0.74 -2.23 0.00 0.00 178.31 175.52 2dme h PHE 55 N -0.11 0.93 -0.99 0.41 -1.00 -1.38 -3.48 116.94 111.33 2dme h PHE 55 Ca 0.27 -0.47 -0.19 0.00 2.81 0.00 0.00 57.97 60.38 2dme h PHE 55 Cb 0.57 -0.12 -0.04 0.00 3.61 0.00 0.00 35.95 39.97 2dme h PHE 55 CO -0.72 1.30 -0.22 -2.13 -1.61 0.00 0.00 178.31 174.94 2dme n ARG 56 N -3.85 -0.72 -3.62 1.51 0.63 0.21 -4.98 116.66 105.84 2dme n ARG 56 Ca -0.09 0.62 -0.05 0.00 -0.92 0.00 0.00 57.85 57.41 2dme n ARG 56 Cb 0.83 -4.60 -0.02 0.00 0.45 0.00 0.00 32.46 29.13 2dme n ARG 56 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 2dme s ASP 57 N -2.71 -0.23 -0.51 6.15 -1.08 -1.19 -5.01 116.67 112.09 2dme s ASP 57 Ca 0.00 -0.16 0.06 0.00 -0.52 0.00 0.00 52.55 51.93 2dme s ASP 57 Cb 0.00 0.37 0.37 0.00 -1.46 0.00 0.00 42.92 42.20 2dme s ASP 57 CO 0.00 -0.64 0.99 0.35 0.52 0.00 0.00 175.17 176.39 2dme n THR 58 N -0.34 2.51 -3.89 1.71 -2.24 -1.26 -4.59 114.28 106.17 2dme n THR 58 Ca -0.07 -5.18 -0.11 0.00 -2.27 0.00 0.00 64.05 56.41 2dme n THR 58 Cb 0.61 -1.18 -0.01 0.00 -2.10 0.00 0.00 70.33 67.66 2dme n THR 58 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2dme n ASP 59 N -0.28 2.02 -0.29 3.42 5.75 -1.26 -4.82 116.55 121.08 2dme n ASP 59 Ca 0.32 -1.81 0.02 0.00 -0.01 0.00 0.00 54.79 53.32 2dme n ASP 59 Cb 0.52 0.04 0.08 0.00 -1.03 0.00 0.00 41.12 40.73 2dme n ASP 59 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2dme n ALA 60 N -2.47 0.06 -0.34 2.12 0.00 -1.26 0.24 120.51 118.87 2dme n ALA 60 Ca -0.08 0.84 0.06 0.00 0.00 0.00 0.00 53.44 54.27 2dme n ALA 60 Cb 0.25 -0.45 0.25 0.00 0.00 0.00 0.00 19.45 19.50 2dme n ALA 60 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 2dme h LYS 61 N 0.00 0.96 0.14 0.00 2.10 -1.96 0.32 116.57 118.14 2dme h LYS 61 Ca 0.34 -0.06 -0.01 0.00 -2.00 0.00 0.00 60.65 58.92 2dme h LYS 61 Cb 0.53 -0.22 0.00 0.00 -0.90 0.00 0.00 32.23 31.65 2dme h LYS 61 CO -0.81 0.64 -0.07 -0.92 -2.00 0.00 0.00 179.45 176.29 2dme h TYR 62 N 0.99 -0.18 -0.47 0.07 3.20 0.29 -2.99 116.97 117.88 2dme h TYR 62 Ca 0.45 -0.00 0.09 0.00 3.14 0.00 0.00 58.73 62.41 2dme h TYR 62 Cb 0.39 0.06 -0.08 0.00 1.54 0.00 0.00 36.73 38.64 2dme h TYR 62 CO -0.00 -0.11 -0.02 0.87 -1.64 0.00 0.00 178.16 177.26 2dme h LYS 63 N -0.24 0.09 -0.96 1.82 1.57 -1.25 -1.74 116.57 115.87 2dme h LYS 63 Ca -0.02 -0.01 0.18 0.00 -1.87 0.00 0.00 60.65 58.94 2dme h LYS 63 Cb 0.15 -0.02 -0.18 0.00 0.08 0.00 0.00 32.23 32.26 2dme h LYS 63 CO 0.03 0.06 -0.28 -0.91 -0.57 0.00 0.00 179.45 177.79 2dme h ASN 64 N 0.09 -1.02 -0.42 0.86 4.21 -0.43 0.54 115.58 119.41 2dme h ASN 64 Ca 0.24 0.29 -0.06 0.00 1.21 0.00 0.00 56.30 57.98 2dme h ASN 64 Cb 0.36 0.63 -0.02 0.00 -1.12 0.00 0.00 38.32 38.17 2dme h ASN 64 CO -0.41 -0.31 0.01 0.50 -1.29 0.00 0.00 177.43 175.93 2dme h LYS 65 N -0.01 0.73 0.68 0.81 1.63 -1.18 -2.21 116.57 117.02 2dme h LYS 65 Ca 0.43 -0.23 -0.03 0.00 -0.85 0.00 0.00 60.65 59.97 2dme h LYS 65 Cb 0.68 -0.07 0.00 0.00 -0.60 0.00 0.00 32.23 32.24 2dme h LYS 65 CO -0.98 0.80 -0.37 -0.92 -3.45 0.00 0.00 179.45 174.53 2dme h TYR 66 N 0.57 -0.99 -0.02 1.91 3.20 0.45 0.18 116.97 122.26 2dme h TYR 66 Ca 0.12 -0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.98 2dme h TYR 66 Cb 0.46 0.34 -0.00 0.00 1.54 0.00 0.00 36.73 39.07 2dme h TYR 66 CO 0.04 -0.58 0.25 0.07 -1.64 0.00 0.00 178.16 176.30 2dme h ARG 67 N -0.97 0.00 0.00 1.82 0.11 -0.41 -2.57 114.38 112.37 2dme h ARG 67 Ca -0.09 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.99 2dme h ARG 67 Cb 0.76 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.84 2dme h ARG 67 CO 0.12 0.00 -0.05 1.03 0.10 0.00 0.00 179.97 181.17 2dme h SER 68 N 0.00 0.00 -1.26 0.08 0.87 -0.71 -1.05 113.55 111.48 2dme h SER 68 Ca 0.01 0.00 0.43 0.00 -1.23 0.00 0.00 61.79 61.00 2dme h SER 68 Cb 0.51 0.00 -0.14 0.00 -0.44 0.00 0.00 62.40 62.33 2dme h SER 68 CO -0.00 0.43 0.79 -0.07 -0.53 0.00 0.00 176.83 177.45 2dme h LEU 69 N -0.81 0.27 0.05 2.23 3.38 -0.28 1.00 115.31 121.14 2dme h LEU 69 Ca 0.00 0.16 -0.29 0.00 0.09 0.00 0.00 57.88 57.84 2dme h LEU 69 Cb 0.05 0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 2dme h LEU 69 CO 0.00 -0.23 -1.59 0.00 0.09 0.00 0.00 178.44 176.71 2dme h MET 70 N 0.08 0.10 -1.15 1.13 -0.00 -1.62 -3.34 114.93 110.12 2dme h MET 70 Ca 0.83 -0.17 0.44 0.00 -0.00 0.00 0.00 59.70 60.80 2dme h MET 70 Cb 2.50 0.06 -0.15 0.00 -0.00 0.00 0.00 31.60 34.01 2dme h MET 70 CO -0.50 0.82 0.69 0.34 -0.00 0.00 0.00 176.91 178.27 2dme n PHE 71 N -3.25 0.90 0.06 -0.10 7.35 0.34 0.17 117.46 122.93 2dme n PHE 71 Ca -0.16 0.91 -0.16 0.00 -0.76 0.00 0.00 57.45 57.28 2dme n PHE 71 Cb 1.03 -1.33 -0.14 0.00 0.35 0.00 0.00 39.48 39.39 2dme n PHE 71 CO 0.00 0.00 0.00 -0.91 -0.76 0.00 0.00 176.76 175.09 2dme h ASN 72 N 0.00 0.35 -0.29 -2.13 2.35 -1.68 -3.27 115.58 110.91 2dme h ASN 72 Ca 0.84 -0.50 0.03 0.00 -0.55 0.00 0.00 56.30 56.12 2dme h ASN 72 Cb 2.47 -0.12 -0.03 0.00 0.05 0.00 0.00 38.32 40.69 2dme h ASN 72 CO -0.60 1.42 0.11 -0.07 -1.65 0.00 0.00 177.43 176.64 2dme h LEU 73 N 0.06 0.13 -0.85 1.61 3.38 0.16 -0.46 115.31 119.34 2dme h LEU 73 Ca -0.24 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.76 2dme h LEU 73 Cb 2.01 0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.77 2dme h LEU 73 CO 0.15 0.11 0.00 0.07 0.09 0.00 0.00 178.44 178.86 2dme h LYS 74 N 0.24 0.00 -6.89 1.13 2.10 -1.16 -3.45 116.57 108.54 2dme h LYS 74 Ca 0.13 0.00 -0.53 0.00 -2.00 0.00 0.00 60.65 58.25 2dme h LYS 74 Cb 0.09 0.00 0.09 0.00 -0.90 0.00 0.00 32.23 31.51 2dme h LYS 74 CO -0.13 0.00 0.76 0.34 -2.00 0.00 0.00 179.45 178.42 2dme s ASP 75 N -4.33 6.48 0.53 7.07 -1.08 -0.18 -4.90 116.67 120.26 2dme s ASP 75 Ca 0.03 2.92 0.31 0.00 -0.52 0.00 0.00 52.55 55.29 2dme s ASP 75 Cb 0.09 -2.66 1.30 0.00 -1.46 0.00 0.00 42.92 40.20 2dme s ASP 75 CO 0.38 -0.78 1.97 1.55 0.52 0.00 0.00 175.17 178.80 2dme h PRO 76 N 3.51 0.00 0.14 4.34 0.13 -1.86 -3.13 132.00 135.13 2dme h PRO 76 Ca -0.49 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.43 2dme h PRO 76 Cb 1.23 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.38 2dme h PRO 76 CO 0.68 0.07 -0.93 0.87 -0.23 0.00 0.00 178.00 178.45 2dme h LYS 77 N 0.00 0.29 -5.52 0.86 1.57 -1.90 -3.41 116.57 108.46 2dme h LYS 77 Ca -0.00 -0.49 -0.28 0.00 -1.87 0.00 0.00 60.65 58.01 2dme h LYS 77 Cb 0.54 0.18 -0.04 0.00 0.08 0.00 0.00 32.23 32.99 2dme h LYS 77 CO 0.01 1.24 0.82 -0.80 -0.57 0.00 0.00 179.45 180.14 2dme s ASN 78 N -6.99 4.88 0.00 0.86 0.02 -1.18 -4.57 114.94 107.95 2dme s ASN 78 Ca -0.15 -1.18 0.16 0.00 -1.02 0.00 0.00 52.86 50.67 2dme s ASN 78 Cb 0.02 -2.58 -0.03 0.00 0.02 0.00 0.00 41.25 38.68 2dme s ASN 78 CO 0.82 -3.15 0.83 -0.46 0.02 0.00 0.00 177.10 175.16 2dme n ASN 79 N 14.91 1.51 -0.12 -1.22 0.23 -1.26 -4.46 115.26 124.84 2dme n ASN 79 Ca 0.43 -1.25 -0.20 0.00 -0.53 0.00 0.00 54.58 53.03 2dme n ASN 79 Cb 0.47 0.54 -0.11 0.00 -2.08 0.00 0.00 39.78 38.60 2dme n ASN 79 CO 0.00 0.00 0.00 -0.38 -0.93 0.00 0.00 177.26 175.95 2dme n ILE 80 N -0.29 1.40 0.11 1.53 5.41 -1.26 -4.38 119.36 121.89 2dme n ILE 80 Ca 0.06 -0.49 -0.14 0.00 1.00 0.00 0.00 62.75 63.18 2dme n ILE 80 Cb 0.33 -1.48 -0.08 0.00 -0.71 0.00 0.00 39.64 37.70 2dme n ILE 80 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 176.55 176.80 2dme h LEU 81 N -0.22 -1.31 -1.49 1.39 5.85 -1.93 0.32 115.31 117.91 2dme h LEU 81 Ca -0.57 0.13 0.01 0.00 0.84 0.00 0.00 57.88 58.29 2dme h LEU 81 Cb 1.78 0.48 -0.00 0.00 0.37 0.00 0.00 40.66 43.28 2dme h LEU 81 CO -0.16 -0.47 0.52 2.19 -0.34 0.00 0.00 178.44 180.17 2dme h PHE 82 N -0.65 0.00 0.04 1.25 -5.15 -1.82 0.67 116.94 111.28 2dme h PHE 82 Ca -0.01 0.00 -0.32 0.00 -0.20 0.00 0.00 57.97 57.44 2dme h PHE 82 Cb 0.64 0.00 -0.04 0.00 0.22 0.00 0.00 35.95 36.77 2dme h PHE 82 CO -0.40 0.00 -1.80 1.63 -2.00 0.00 0.00 178.31 175.73 2dme n LYS 83 N -2.84 0.67 -0.05 6.09 5.02 0.43 -3.36 118.16 124.11 2dme n LYS 83 Ca -0.01 0.29 -0.11 0.00 -2.02 0.00 0.00 58.31 56.46 2dme n LYS 83 Cb 0.56 -1.77 0.03 0.00 -0.02 0.00 0.00 35.03 33.84 2dme n LYS 83 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 2dme h LYS 84 N 0.02 0.73 -0.34 1.97 1.57 0.38 -0.36 116.57 120.55 2dme h LYS 84 Ca -0.33 -0.41 -0.16 0.00 -1.87 0.00 0.00 60.65 57.88 2dme h LYS 84 Cb 2.02 0.03 -0.00 0.00 0.08 0.00 0.00 32.23 34.35 2dme h LYS 84 CO 0.08 1.03 -0.41 0.28 -0.57 0.00 0.00 179.45 179.87 2dme h VAL 85 N 0.59 1.28 0.29 0.50 2.07 -1.35 0.13 116.25 119.76 2dme h VAL 85 Ca 0.04 -1.58 -0.01 0.00 0.82 0.00 0.00 66.70 65.96 2dme h VAL 85 Cb 1.01 1.49 0.00 0.00 -1.52 0.00 0.00 31.29 32.27 2dme h VAL 85 CO 0.10 0.52 -0.14 -0.07 0.02 0.00 0.00 177.57 178.00 2dme h LEU 86 N 0.67 -0.33 -0.24 2.57 4.07 -1.55 -3.31 115.31 117.18 2dme h LEU 86 Ca 0.05 -0.19 0.04 0.00 0.08 0.00 0.00 57.88 57.85 2dme h LEU 86 Cb 1.00 0.09 -0.04 0.00 1.08 0.00 0.00 40.66 42.79 2dme h LEU 86 CO 0.10 0.14 -0.00 0.50 -1.08 0.00 0.00 178.44 178.09 2dme h LYS 87 N -0.94 0.07 0.00 1.13 1.63 -1.16 -3.47 116.57 113.84 2dme h LYS 87 Ca -0.04 -0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.76 2dme h LYS 87 Cb 0.50 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.12 2dme h LYS 87 CO 0.07 0.05 0.00 0.41 -3.45 0.00 0.00 179.45 176.52 2dme n GLY 88 N -1.20 1.24 0.35 5.01 0.00 -0.34 -4.99 105.19 105.26 2dme n GLY 88 Ca -0.01 0.00 0.31 0.00 0.00 0.00 0.00 46.02 46.31 2dme n GLY 88 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2dme n GLU 89 N 0.00 -0.03 -4.34 1.61 1.02 -0.08 -3.82 120.64 114.99 2dme n GLU 89 Ca 0.00 1.04 -0.28 0.00 -0.02 0.00 0.00 57.16 57.90 2dme n GLU 89 Cb 0.00 -2.00 -0.17 0.00 -0.02 0.00 0.00 31.44 29.25 2dme n GLU 89 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2dme s VAL 90 N -5.01 1.35 0.48 2.62 1.01 0.26 -4.97 120.40 116.15 2dme s VAL 90 Ca -0.06 -0.55 -0.20 0.00 0.00 0.00 0.00 61.98 61.17 2dme s VAL 90 Cb 0.26 -1.26 -0.09 0.00 0.00 0.00 0.00 36.38 35.29 2dme s VAL 90 CO 0.66 0.41 1.02 0.42 0.00 0.00 0.00 175.10 177.61 2dme s THR 91 N 1.11 3.93 0.32 3.92 -4.23 -1.25 -4.00 115.64 115.44 2dme s THR 91 Ca -0.05 1.17 0.12 0.00 -1.18 0.00 0.00 61.69 61.75 2dme s THR 91 Cb -0.14 -3.48 0.04 0.00 1.34 0.00 0.00 72.50 70.25 2dme s THR 91 CO -0.03 -0.28 1.72 1.55 -0.54 0.00 0.00 174.62 177.04 2dme h PRO 92 N 1.54 0.00 0.00 3.99 0.13 -1.89 -0.66 132.00 135.11 2dme h PRO 92 Ca -0.49 -0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.58 2dme h PRO 92 Cb 1.21 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 2dme h PRO 92 CO 0.59 0.49 -0.28 0.38 -0.23 0.00 0.00 178.00 178.95 2dme h ASP 93 N 0.00 0.00 0.43 1.44 3.04 -1.92 -3.27 116.42 116.15 2dme h ASP 93 Ca -0.00 0.00 -0.30 0.00 -3.24 0.00 0.00 57.03 53.48 2dme h ASP 93 Cb 0.87 0.00 -0.04 0.00 -1.04 0.00 0.00 39.33 39.11 2dme h ASP 93 CO 0.06 0.28 -1.76 1.57 -2.04 0.00 0.00 179.24 177.36 2dme n HIS 94 N -3.19 1.05 0.26 4.15 -0.00 -1.08 -3.99 115.22 112.42 2dme n HIS 94 Ca 0.03 0.35 0.11 0.00 0.46 0.00 0.00 57.72 58.66 2dme n HIS 94 Cb 0.62 -1.18 0.45 0.00 -0.12 0.00 0.00 29.99 29.76 2dme n HIS 94 CO 0.00 0.00 0.00 1.25 0.46 0.00 0.00 176.34 178.05 2dme h LEU 95 N 0.01 0.00 0.07 0.27 5.85 -1.17 1.14 115.31 121.48 2dme h LEU 95 Ca -0.31 0.00 -0.30 0.00 0.84 0.00 0.00 57.88 58.11 2dme h LEU 95 Cb 2.02 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 43.02 2dme h LEU 95 CO 0.08 0.00 -1.64 0.40 -0.34 0.00 0.00 178.44 176.94 2dme h ILE 96 N 0.00 0.98 0.00 4.05 2.04 -1.74 -3.33 117.51 119.52 2dme h ILE 96 Ca 0.06 -2.72 -0.04 0.00 1.00 0.00 0.00 64.86 63.16 2dme h ILE 96 Cb 1.45 2.59 -0.01 0.00 -0.74 0.00 0.00 36.82 40.12 2dme h ILE 96 CO -0.00 0.73 -0.17 0.03 0.00 0.00 0.00 178.15 178.73 2dme h ARG 97 N 0.04 0.00 -7.16 2.37 3.08 0.11 -3.46 114.38 109.36 2dme h ARG 97 Ca -0.27 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.25 2dme h ARG 97 Cb 2.00 0.00 0.20 0.00 0.08 0.00 0.00 29.97 32.25 2dme h ARG 97 CO 0.12 0.17 0.10 -1.33 -1.07 0.00 0.00 179.97 177.96 2dme n MET 98 N -3.22 -0.28 -3.02 0.04 2.81 -0.44 -4.99 117.12 108.02 2dme n MET 98 Ca 0.02 -0.01 -0.32 0.00 -1.81 0.00 0.00 57.70 55.57 2dme n MET 98 Cb 0.48 -2.30 -0.05 0.00 -0.71 0.00 0.00 33.22 30.64 2dme n MET 98 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 2dme s SER 99 N -2.40 6.73 0.34 7.83 0.01 -1.26 -4.97 113.70 119.99 2dme s SER 99 Ca 0.67 1.30 0.26 0.00 1.31 0.00 0.00 55.95 59.49 2dme s SER 99 Cb -0.24 -2.38 1.10 0.00 0.21 0.00 0.00 66.02 64.70 2dme s SER 99 CO 0.58 -0.28 1.79 1.55 0.41 0.00 0.00 173.24 177.29 2dme h PRO 100 N 1.96 0.00 0.00 12.44 0.13 -1.96 -2.37 132.00 142.20 2dme h PRO 100 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2dme h PRO 100 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2dme h PRO 100 CO 0.64 0.00 -0.93 -1.91 -0.23 0.00 0.00 178.00 175.57 2dme n GLU 101 N -2.47 0.09 -0.01 0.86 2.13 -1.26 -4.15 120.64 115.82 2dme n GLU 101 Ca 0.02 -0.01 -0.07 0.00 0.66 0.00 0.00 57.16 57.76 2dme n GLU 101 Cb 0.24 -1.52 -0.13 0.00 0.27 0.00 0.00 31.44 30.31 2dme n GLU 101 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 2dme n GLU 102 N -1.62 0.63 0.32 5.31 1.02 -0.91 -3.90 120.64 121.49 2dme n GLU 102 Ca 0.04 0.28 0.21 0.00 -0.02 0.00 0.00 57.16 57.66 2dme n GLU 102 Cb 0.36 -1.80 1.10 0.00 -0.02 0.00 0.00 31.44 31.09 2dme n GLU 102 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 2dme h LEU 103 N 0.00 0.00 0.08 -4.62 3.38 -1.68 -1.16 115.31 111.31 2dme h LEU 103 Ca -0.26 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.38 2dme h LEU 103 Cb 1.93 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.65 2dme h LEU 103 CO 0.07 0.00 -1.85 0.00 0.09 0.00 0.00 178.44 176.75 2dme h ALA 104 N 1.88 0.55 -1.82 1.53 0.00 -1.79 -3.48 119.26 116.13 2dme h ALA 104 Ca 0.00 -1.40 -0.62 0.00 0.00 0.00 0.00 54.91 52.89 2dme h ALA 104 Cb 0.11 0.59 0.13 0.00 0.00 0.00 0.00 17.79 18.62 2dme h ALA 104 CO 0.00 1.41 -0.29 0.45 0.00 0.00 0.00 179.25 180.82 2dme n SER 105 N -3.31 -0.37 -2.69 0.00 2.88 -0.44 -4.91 113.62 104.77 2dme n SER 105 Ca -0.25 1.02 -0.29 0.00 -1.33 0.00 0.00 58.87 58.02 2dme n SER 105 Cb 1.05 -1.13 -0.00 0.00 -0.75 0.00 0.00 64.21 63.38 2dme n SER 105 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2dme n LYS 106 N 0.72 3.40 -4.44 -1.46 4.81 -1.26 -4.99 118.16 114.93 2dme n LYS 106 Ca 0.12 -4.47 -0.33 0.00 -0.87 0.00 0.00 58.31 52.76 2dme n LYS 106 Cb 0.35 -2.26 -0.10 0.00 0.02 0.00 0.00 35.03 33.04 2dme n LYS 106 CO 0.00 0.00 0.00 -1.83 1.17 0.00 0.00 177.40 176.74 2dme s GLU 107 N -3.63 2.70 0.00 1.64 -1.05 -1.26 -4.99 118.70 112.11 2dme s GLU 107 Ca 0.48 -0.62 0.00 0.00 -0.15 0.00 0.00 54.97 54.68 2dme s GLU 107 Cb 0.37 -2.59 0.00 0.00 -0.44 0.00 0.00 34.13 31.46 2dme s GLU 107 CO -0.21 0.63 0.00 1.47 0.95 0.00 0.00 175.26 178.11 2dme n LEU 108 N 1.72 0.00 0.09 1.83 -0.00 -1.26 -4.67 117.00 114.71 2dme n LEU 108 Ca -0.16 -0.31 0.13 0.00 -0.00 0.00 0.00 56.01 55.67 2dme n LEU 108 Cb 0.53 0.00 0.35 0.00 -0.00 0.00 0.00 43.42 44.29 2dme n LEU 108 CO 0.30 0.00 0.74 0.00 -0.00 0.00 0.00 177.39 178.43 2dme n ALA 109 N -0.73 2.48 0.04 1.47 0.00 -1.26 -3.59 120.51 118.91 2dme n ALA 109 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.35 2dme n ALA 109 Cb 0.00 -1.38 0.31 0.00 0.00 0.00 0.00 19.45 18.37 2dme n ALA 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dme h ALA 110 N 2.54 1.36 -3.04 0.00 0.00 -1.88 -3.44 119.26 114.79 2dme h ALA 110 Ca 0.00 -0.23 -0.55 0.00 0.00 0.00 0.00 54.91 54.13 2dme h ALA 110 Cb 0.73 -0.13 0.14 0.00 0.00 0.00 0.00 17.79 18.54 2dme h ALA 110 CO 0.00 0.44 0.55 -1.58 0.00 0.00 0.00 179.25 178.66 2dme s TRP 111 N -4.81 2.19 0.13 0.00 0.23 -1.24 -4.87 118.94 110.58 2dme s TRP 111 Ca -0.07 1.44 -0.19 0.00 -2.03 0.00 0.00 56.10 55.25 2dme s TRP 111 Cb 0.15 -3.72 0.02 0.00 0.03 0.00 0.00 33.47 29.95 2dme s TRP 111 CO 0.76 -2.85 1.12 -2.13 0.96 0.00 0.00 176.95 174.81 2dme n ARG 112 N -1.53 -0.27 -1.17 4.98 0.63 -1.26 -4.49 116.66 113.54 2dme n ARG 112 Ca 0.14 1.10 -0.44 0.00 -0.92 0.00 0.00 57.85 57.73 2dme n ARG 112 Cb 0.47 -1.62 -0.05 0.00 0.45 0.00 0.00 32.46 31.71 2dme n ARG 112 CO 0.00 0.00 0.00 -2.13 -2.51 0.00 0.00 177.63 172.99 2dme n ARG 113 N -4.95 0.00 -4.27 -0.14 3.00 -1.26 -4.92 116.66 104.12 2dme n ARG 113 Ca 0.03 0.00 -0.34 0.00 -0.00 0.00 0.00 57.85 57.54 2dme n ARG 113 Cb 0.22 -1.04 -0.13 0.00 0.00 0.00 0.00 32.46 31.51 2dme n ARG 113 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.63 178.13 2dme s ARG 114 N -0.33 3.61 -1.44 -0.14 3.52 -1.26 -4.61 118.95 118.30 2dme s ARG 114 Ca 0.64 -0.54 -0.02 0.00 -0.13 0.00 0.00 55.73 55.69 2dme s ARG 114 Cb -0.91 -2.96 0.01 0.00 -1.56 0.00 0.00 34.95 29.53 2dme s ARG 114 CO 0.46 0.12 0.43 0.45 -0.81 0.00 0.00 175.30 175.95 2dme n SER 115 N 3.89 -0.50 0.00 -2.12 2.88 -1.26 -4.91 113.62 111.60 2dme n SER 115 Ca -0.17 -1.02 0.00 0.00 -1.33 0.00 0.00 58.87 56.35 2dme n SER 115 Cb 0.52 -2.97 0.00 0.00 -0.75 0.00 0.00 64.21 61.02 2dme n SER 115 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dme n GLY 116 N -1.97 -0.25 0.15 0.46 0.00 -1.26 -4.73 105.19 97.59 2dme n GLY 116 Ca -0.28 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.86 2dme n GLY 116 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dme h PRO 117 N 0.00 0.00 -0.80 1.61 0.13 -1.91 -3.31 132.00 127.73 2dme h PRO 117 Ca 0.00 0.00 0.12 0.00 -0.87 0.00 0.00 66.00 65.25 2dme h PRO 117 Cb 0.00 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 31.00 2dme h PRO 117 CO 0.00 0.00 -0.31 0.45 -0.23 0.00 0.00 178.00 177.91 2dme n SER 118 N -2.34 -0.51 -4.58 1.44 2.88 -1.26 -4.07 113.62 105.18 2dme n SER 118 Ca 0.02 1.39 -0.44 0.00 -1.33 0.00 0.00 58.87 58.51 2dme n SER 118 Cb 0.23 -0.32 -0.04 0.00 -0.75 0.00 0.00 64.21 63.34 2dme n SER 118 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2dme n SER 119 N -5.18 3.11 0.00 -3.46 2.88 -1.25 -5.12 113.62 104.60 2dme n SER 119 Ca 0.08 0.24 0.00 0.00 -1.33 0.00 0.00 58.87 57.86 2dme n SER 119 Cb 0.32 -1.51 0.00 0.00 -0.75 0.00 0.00 64.21 62.27 2dme n SER 119 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42