#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 0.34 -0.46 1.61 0.15 -1.26 -5.12 113.70 108.96 2dme s SER 2 Ca 0.00 -0.16 -0.16 0.00 0.70 0.00 0.00 55.95 56.32 2dme s SER 2 Cb 0.00 -0.01 0.05 0.00 -1.71 0.00 0.00 66.02 64.36 2dme s SER 2 CO 0.00 -0.04 0.44 -0.44 1.20 0.00 0.00 173.24 174.39 2dme s SER 3 N -0.43 6.17 0.00 5.45 0.01 -1.26 -4.97 113.70 118.67 2dme s SER 3 Ca -0.03 -1.07 0.00 0.00 1.31 0.00 0.00 55.95 56.16 2dme s SER 3 Cb -0.03 -2.21 0.00 0.00 0.21 0.00 0.00 66.02 63.99 2dme s SER 3 CO -0.00 -0.66 0.00 0.61 0.41 0.00 0.00 173.24 173.60 2dme n GLY 4 N 5.18 4.48 3.45 3.44 0.00 -1.26 -4.99 105.19 115.48 2dme n GLY 4 Ca -0.10 -0.45 -0.22 0.00 0.00 0.00 0.00 46.02 45.25 2dme n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dme n SER 5 N 0.00 -5.49 -4.47 1.61 7.64 -1.26 -5.01 113.62 106.65 2dme n SER 5 Ca 0.00 -0.52 -0.31 0.00 1.01 0.00 0.00 58.87 59.05 2dme n SER 5 Cb 0.00 -4.79 -0.13 0.00 -1.01 0.00 0.00 64.21 58.28 2dme n SER 5 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2dme s SER 6 N -3.46 3.90 0.92 6.43 1.04 -1.26 -5.05 113.70 116.21 2dme s SER 6 Ca 0.47 -0.34 0.00 0.00 0.48 0.00 0.00 55.95 56.55 2dme s SER 6 Cb -0.21 -0.70 0.00 0.00 0.10 0.00 0.00 66.02 65.21 2dme s SER 6 CO 0.69 0.28 0.00 0.61 0.98 0.00 0.00 173.24 175.80 2dme n GLY 7 N 1.78 -1.02 2.21 7.32 0.00 -1.26 -4.94 105.19 109.28 2dme n GLY 7 Ca -0.16 -1.03 -0.08 0.00 0.00 0.00 0.00 46.02 44.75 2dme n GLY 7 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dme n SER 8 N -2.69 -3.25 -0.00 1.61 2.88 -1.26 -4.96 113.62 105.95 2dme n SER 8 Ca 0.00 -0.11 -0.21 0.00 -1.33 0.00 0.00 58.87 57.21 2dme n SER 8 Cb 0.00 -2.13 -0.14 0.00 -0.75 0.00 0.00 64.21 61.20 2dme n SER 8 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dme h ALA 9 N 0.37 0.22 -0.69 -1.46 0.00 -2.01 -3.33 119.26 112.36 2dme h ALA 9 Ca -0.20 -1.15 0.06 0.00 0.00 0.00 0.00 54.91 53.62 2dme h ALA 9 Cb 1.13 0.54 -0.05 0.00 0.00 0.00 0.00 17.79 19.41 2dme h ALA 9 CO 0.21 0.90 0.39 -0.44 0.00 0.00 0.00 179.25 180.31 2dme h ASP 10 N -0.30 0.59 -0.09 0.00 5.19 -2.00 -2.58 116.42 117.23 2dme h ASP 10 Ca -0.33 0.03 0.04 0.00 -0.62 0.00 0.00 57.03 56.15 2dme h ASP 10 Cb 1.77 -0.09 -0.05 0.00 0.18 0.00 0.00 39.33 41.14 2dme h ASP 10 CO 0.04 0.38 -0.18 1.56 -3.12 0.00 0.00 179.24 177.93 2dme h GLN 11 N 0.73 -0.23 -0.28 3.56 1.08 -1.99 0.21 115.11 118.18 2dme h GLN 11 Ca 0.31 0.02 0.05 0.00 -1.45 0.00 0.00 58.65 57.58 2dme h GLN 11 Cb 0.18 0.05 -0.08 0.00 -0.05 0.00 0.00 27.48 27.58 2dme h GLN 11 CO -0.18 -0.15 -0.46 0.82 -0.95 0.00 0.00 178.83 177.91 2dme h ILE 12 N -0.24 0.09 0.40 2.54 2.04 -1.57 0.15 117.51 120.91 2dme h ILE 12 Ca 0.09 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.93 2dme h ILE 12 Cb 0.36 0.09 0.00 0.00 -0.74 0.00 0.00 36.82 36.53 2dme h ILE 12 CO -0.24 0.00 -0.20 0.03 0.00 0.00 0.00 178.15 177.74 2dme h ARG 13 N -0.43 -0.53 -0.73 2.37 3.08 -1.30 -2.69 114.38 114.15 2dme h ARG 13 Ca 0.09 0.04 0.16 0.00 0.07 0.00 0.00 59.98 60.34 2dme h ARG 13 Cb 0.62 0.12 -0.13 0.00 0.08 0.00 0.00 29.97 30.65 2dme h ARG 13 CO -0.50 -0.35 -0.07 0.37 -1.07 0.00 0.00 179.97 178.35 2dme h GLN 14 N -0.55 0.06 -0.46 0.04 5.75 -0.14 0.75 115.11 120.57 2dme h GLN 14 Ca -0.05 -0.00 0.07 0.00 -0.15 0.00 0.00 58.65 58.51 2dme h GLN 14 Cb 0.43 -0.01 -0.06 0.00 1.07 0.00 0.00 27.48 28.91 2dme h GLN 14 CO 0.08 0.04 0.12 1.03 -2.65 0.00 0.00 178.83 177.45 2dme h SER 15 N 0.06 0.06 -0.86 -0.69 0.87 -0.51 -1.99 113.55 110.50 2dme h SER 15 Ca 0.38 0.07 0.22 0.00 -1.23 0.00 0.00 61.79 61.23 2dme h SER 15 Cb 0.64 0.08 -0.15 0.00 -0.44 0.00 0.00 62.40 62.54 2dme h SER 15 CO -0.69 0.07 0.10 0.58 -0.53 0.00 0.00 176.83 176.35 2dme h VAL 16 N 0.26 0.25 -0.41 2.23 2.07 -0.52 -0.62 116.25 119.52 2dme h VAL 16 Ca 0.22 -0.04 0.06 0.00 0.82 0.00 0.00 66.70 67.76 2dme h VAL 16 Cb 0.27 0.12 -0.09 0.00 -1.52 0.00 0.00 31.29 30.07 2dme h VAL 16 CO -0.27 0.02 -0.49 0.03 0.02 0.00 0.00 177.57 176.89 2dme h ARG 17 N 0.12 -0.35 0.32 1.57 3.08 -1.23 -1.50 114.38 116.39 2dme h ARG 17 Ca 0.51 0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.58 2dme h ARG 17 Cb 0.99 0.08 -0.02 0.00 0.08 0.00 0.00 29.97 31.10 2dme h ARG 17 CO -0.72 -0.23 -0.39 1.25 -1.07 0.00 0.00 179.97 178.81 2dme h HIS 18 N -0.36 -1.09 -0.82 3.04 2.76 -1.20 -1.67 115.15 115.82 2dme h HIS 18 Ca 0.11 0.01 0.13 0.00 -2.20 0.00 0.00 60.37 58.42 2dme h HIS 18 Cb 0.59 0.43 -0.13 0.00 1.55 0.00 0.00 27.41 29.86 2dme h HIS 18 CO -0.67 -0.50 -0.32 0.43 -1.30 0.00 0.00 177.93 175.57 2dme n SER 19 N -4.73 -0.54 0.28 3.26 7.64 -0.97 -0.43 113.62 118.12 2dme n SER 19 Ca -0.09 1.43 -0.13 0.00 1.01 0.00 0.00 58.87 61.09 2dme n SER 19 Cb 0.34 -0.32 -0.07 0.00 -1.01 0.00 0.00 64.21 63.15 2dme n SER 19 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 2dme h LEU 20 N 0.00 -0.89 -1.49 -3.43 3.38 -0.99 -2.28 115.31 109.61 2dme h LEU 20 Ca 0.28 0.06 0.39 0.00 0.09 0.00 0.00 57.88 58.70 2dme h LEU 20 Cb 0.49 0.27 -0.11 0.00 0.09 0.00 0.00 40.66 41.40 2dme h LEU 20 CO -0.81 -0.51 0.84 0.50 0.09 0.00 0.00 178.44 178.55 2dme h LYS 21 N -0.80 0.15 0.32 1.13 3.64 -0.04 0.16 116.57 121.12 2dme h LYS 21 Ca -0.07 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.30 2dme h LYS 21 Cb 0.65 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.43 2dme h LYS 21 CO 0.04 0.10 -0.24 0.22 -2.27 0.00 0.00 179.45 177.30 2dme h ASP 22 N 0.15 -0.63 0.35 4.20 1.82 -0.16 0.23 116.42 122.38 2dme h ASP 22 Ca 0.74 0.05 -0.02 0.00 -0.39 0.00 0.00 57.03 57.42 2dme h ASP 22 Cb 2.34 0.20 0.00 0.00 0.68 0.00 0.00 39.33 42.56 2dme h ASP 22 CO -0.32 -0.37 -0.19 0.40 -1.61 0.00 0.00 179.24 177.15 2dme h ILE 23 N -0.57 0.00 -1.09 2.25 2.04 -0.50 -2.76 117.51 116.89 2dme h ILE 23 Ca -0.02 0.00 0.30 0.00 1.00 0.00 0.00 64.86 66.13 2dme h ILE 23 Cb 0.49 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 36.48 2dme h ILE 23 CO -0.01 0.00 0.71 -0.07 0.00 0.00 0.00 178.15 178.79 2dme h LEU 24 N -0.49 0.36 -1.53 1.44 3.38 -1.50 0.66 115.31 117.62 2dme h LEU 24 Ca -0.05 0.08 0.05 0.00 0.09 0.00 0.00 57.88 58.05 2dme h LEU 24 Cb 0.38 0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.13 2dme h LEU 24 CO 0.07 0.04 0.38 0.24 0.09 0.00 0.00 178.44 179.26 2dme h MET 25 N 0.30 0.58 0.00 1.13 2.86 -0.27 0.35 114.93 119.87 2dme h MET 25 Ca 0.61 -0.03 -0.27 0.00 -2.06 0.00 0.00 59.70 57.95 2dme h MET 25 Cb 1.73 -0.13 -0.05 0.00 0.06 0.00 0.00 31.60 33.21 2dme h MET 25 CO -0.27 0.38 -1.75 1.17 1.06 0.00 0.00 176.91 177.50 2dme n LYS 26 N -4.47 0.64 0.23 1.72 0.00 0.20 -2.85 118.16 113.63 2dme n LYS 26 Ca 0.08 0.23 0.13 0.00 0.00 0.00 0.00 58.31 58.74 2dme n LYS 26 Cb 0.20 -1.75 0.35 0.00 0.00 0.00 0.00 35.03 33.83 2dme n LYS 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2dme h ARG 27 N 0.00 0.00 0.05 1.64 2.47 -0.16 -2.67 114.38 115.72 2dme h ARG 27 Ca -0.29 0.00 -0.36 0.00 -1.26 0.00 0.00 59.98 58.07 2dme h ARG 27 Cb 1.94 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 30.21 2dme h ARG 27 CO 0.06 0.05 -2.13 1.47 0.56 0.00 0.00 179.97 179.98 2dme n LEU 28 N -3.13 2.09 0.15 3.04 -0.00 0.12 -3.14 117.00 116.13 2dme n LEU 28 Ca 0.02 0.12 0.01 0.00 -0.00 0.00 0.00 56.01 56.16 2dme n LEU 28 Cb 0.46 -0.63 0.30 0.00 -0.00 0.00 0.00 43.42 43.55 2dme n LEU 28 CO 0.32 0.75 0.68 0.00 -0.00 0.00 0.00 177.39 179.14 2dme h THR 29 N 0.03 1.30 0.15 1.47 1.03 -1.56 -3.08 112.91 112.25 2dme h THR 29 Ca -0.46 -1.42 -0.32 0.00 -0.01 0.00 0.00 66.41 64.20 2dme h THR 29 Cb 2.02 1.72 0.00 0.00 -1.07 0.00 0.00 68.15 70.82 2dme h THR 29 CO 0.03 0.41 -1.53 -2.24 -0.01 0.00 0.00 175.52 172.18 2dme h ASP 30 N 0.07 0.51 -4.41 0.00 3.04 -1.65 -3.47 116.42 110.52 2dme h ASP 30 Ca 0.01 -0.66 -0.46 0.00 -3.24 0.00 0.00 57.03 52.67 2dme h ASP 30 Cb 0.74 -0.17 0.12 0.00 -1.04 0.00 0.00 39.33 38.98 2dme h ASP 30 CO 0.06 1.55 0.36 -0.55 -2.04 0.00 0.00 179.24 178.61 2dme s SER 31 N -7.16 3.94 -0.26 4.15 0.15 -1.16 -4.93 113.70 108.42 2dme s SER 31 Ca -0.10 0.81 -0.05 0.00 0.70 0.00 0.00 55.95 57.32 2dme s SER 31 Cb 0.06 -1.30 -0.07 0.00 -1.71 0.00 0.00 66.02 63.00 2dme s SER 31 CO 0.87 -2.27 3.11 0.59 1.20 0.00 0.00 173.24 176.75 2dme n ASN 32 N -3.56 5.96 -0.04 5.45 4.13 -1.26 -4.41 115.26 121.53 2dme n ASN 32 Ca 0.08 -2.90 -0.03 0.00 1.68 0.00 0.00 54.58 53.41 2dme n ASN 32 Cb 0.60 -1.31 -0.01 0.00 -1.54 0.00 0.00 39.78 37.52 2dme n ASN 32 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 2dme n LEU 33 N 1.54 0.93 -1.98 3.41 4.77 -1.26 -5.03 117.00 119.38 2dme n LEU 33 Ca 0.46 0.31 -0.10 0.00 -0.03 0.00 0.00 56.01 56.65 2dme n LEU 33 Cb 0.70 -0.65 0.04 0.00 -2.33 0.00 0.00 43.42 41.18 2dme n LEU 33 CO 0.24 -0.44 0.10 1.17 -1.33 0.00 0.00 177.39 177.13 2dme n LYS 34 N -3.45 -3.58 -3.43 3.23 3.00 -1.26 -5.03 118.16 107.64 2dme n LYS 34 Ca -0.05 0.39 -0.30 0.00 -0.00 0.00 0.00 58.31 58.34 2dme n LYS 34 Cb 0.19 -4.07 -0.04 0.00 0.00 0.00 0.00 35.03 31.11 2dme n LYS 34 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.40 177.54 2dme s VAL 35 N -3.15 5.02 0.32 3.15 -7.23 -1.26 -5.06 120.40 112.18 2dme s VAL 35 Ca 0.21 0.19 -0.29 0.00 -1.81 0.00 0.00 61.98 60.29 2dme s VAL 35 Cb -0.09 -3.67 -0.10 0.00 0.56 0.00 0.00 36.38 33.07 2dme s VAL 35 CO 0.34 -0.17 1.22 -2.16 -0.31 0.00 0.00 175.10 174.02 2dme s PRO 36 N -3.14 4.44 0.51 4.82 0.04 -1.26 -4.88 135.00 135.52 2dme s PRO 36 Ca 0.45 2.04 0.40 0.00 0.04 0.00 0.00 61.00 63.93 2dme s PRO 36 Cb -0.11 -3.09 1.58 0.00 0.04 0.00 0.00 34.50 32.92 2dme s PRO 36 CO 0.26 -0.05 1.63 1.49 0.04 0.00 0.00 177.00 180.37 2dme h GLU 37 N 3.48 0.04 -0.75 4.56 4.81 -2.02 0.70 114.58 125.41 2dme h GLU 37 Ca -0.48 -0.00 0.10 0.00 -0.13 0.00 0.00 59.36 58.84 2dme h GLU 37 Cb 1.22 -0.01 -0.07 0.00 0.63 0.00 0.00 28.75 30.52 2dme h GLU 37 CO 0.66 0.02 0.39 1.49 -0.73 0.00 0.00 179.01 180.84 2dme h GLU 38 N 0.04 0.64 -0.01 1.92 4.57 -1.99 -2.44 114.58 117.30 2dme h GLU 38 Ca 0.83 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.97 2dme h GLU 38 Cb 3.03 -0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 31.47 2dme h GLU 38 CO -0.17 0.42 -0.04 -0.22 -1.18 0.00 0.00 179.01 177.82 2dme h LYS 39 N 0.66 -0.04 -0.31 1.92 1.63 0.08 0.27 116.57 120.77 2dme h LYS 39 Ca 0.37 0.00 0.04 0.00 -0.85 0.00 0.00 60.65 60.21 2dme h LYS 39 Cb 0.38 0.01 -0.07 0.00 -0.60 0.00 0.00 32.23 31.94 2dme h LYS 39 CO -0.27 -0.03 -0.55 0.00 -3.45 0.00 0.00 179.45 175.16 2dme h ALA 40 N -1.31 -0.82 -0.18 5.00 0.00 -1.65 -1.25 119.26 119.04 2dme h ALA 40 Ca 0.00 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.91 2dme h ALA 40 Cb 0.05 1.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.89 2dme h ALA 40 CO -0.04 -1.06 -0.25 0.00 0.00 0.00 0.00 179.25 177.90 2dme h ALA 41 N -0.16 -0.51 -0.93 0.00 0.00 -1.24 0.99 119.26 117.42 2dme h ALA 41 Ca 0.06 -0.00 0.15 0.00 0.00 0.00 0.00 54.91 55.11 2dme h ALA 41 Cb 0.62 0.90 -0.15 0.00 0.00 0.00 0.00 17.79 19.15 2dme h ALA 41 CO -0.53 -0.63 -0.38 0.87 0.00 0.00 0.00 179.25 178.58 2dme h LYS 42 N -0.18 -0.03 0.38 0.00 1.57 -0.15 0.67 116.57 118.84 2dme h LYS 42 Ca 0.03 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.81 2dme h LYS 42 Cb 0.26 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.55 2dme h LYS 42 CO -0.26 -0.02 -0.44 0.28 -0.57 0.00 0.00 179.45 178.44 2dme h VAL 43 N -0.03 0.12 -0.72 0.50 2.07 -0.32 -2.26 116.25 115.62 2dme h VAL 43 Ca 0.33 0.00 0.16 0.00 0.82 0.00 0.00 66.70 68.01 2dme h VAL 43 Cb 0.59 0.12 -0.12 0.00 -1.52 0.00 0.00 31.29 30.36 2dme h VAL 43 CO -0.94 0.00 -0.00 0.00 0.02 0.00 0.00 177.57 176.65 2dme h ALA 44 N -0.54 0.72 -0.05 1.67 0.00 0.84 0.79 119.26 122.68 2dme h ALA 44 Ca -0.03 0.23 0.01 0.00 0.00 0.00 0.00 54.91 55.12 2dme h ALA 44 Cb 0.77 0.40 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 2dme h ALA 44 CO -0.10 -0.41 0.07 1.15 0.00 0.00 0.00 179.25 179.95 2dme h THR 45 N 0.10 0.43 0.00 0.00 2.02 -0.54 0.18 112.91 115.12 2dme h THR 45 Ca 0.39 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.57 2dme h THR 45 Cb 0.66 0.94 0.00 0.00 -1.74 0.00 0.00 68.15 68.02 2dme h THR 45 CO -0.63 0.00 -0.61 0.29 0.37 0.00 0.00 175.52 174.94 2dme n LYS 46 N -3.72 0.07 -0.03 6.66 5.02 0.26 -3.40 118.16 123.02 2dme n LYS 46 Ca -0.02 0.01 -0.16 0.00 -2.02 0.00 0.00 58.31 56.13 2dme n LYS 46 Cb 0.16 -1.53 -0.08 0.00 -0.02 0.00 0.00 35.03 33.55 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 1.37 0.02 -0.18 1.08 0.82 -3.25 117.51 117.37 2dme h ILE 47 Ca 0.00 -1.80 -0.00 0.00 -0.39 0.00 0.00 64.86 62.67 2dme h ILE 47 Cb 0.56 2.19 0.00 0.00 -3.07 0.00 0.00 36.82 36.50 2dme h ILE 47 CO 0.00 0.54 -0.01 -0.33 -0.69 0.00 0.00 178.15 177.66 2dme h GLU 48 N 0.09 -0.03 -1.04 2.37 3.07 -1.69 -2.36 114.58 114.99 2dme h GLU 48 Ca -0.03 0.00 0.39 0.00 -0.50 0.00 0.00 59.36 59.23 2dme h GLU 48 Cb 1.11 0.01 -0.14 0.00 -0.84 0.00 0.00 28.75 28.89 2dme h GLU 48 CO 0.10 0.68 0.62 0.36 -1.40 0.00 0.00 179.01 179.37 2dme n LYS 49 N -4.70 -0.04 -0.02 2.33 2.85 -1.22 0.23 118.16 117.59 2dme n LYS 49 Ca -0.08 1.15 -0.09 0.00 -1.05 0.00 0.00 58.31 58.25 2dme n LYS 49 Cb 0.35 -2.17 -0.14 0.00 -0.65 0.00 0.00 35.03 32.42 2dme n LYS 49 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 177.40 178.84 2dme h GLU 50 N 0.00 0.01 0.69 -1.58 4.57 -1.64 -3.29 114.58 113.33 2dme h GLU 50 Ca 0.76 -0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 58.89 2dme h GLU 50 Cb 2.22 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 30.82 2dme h GLU 50 CO -0.54 0.52 -0.33 1.25 -1.18 0.00 0.00 179.01 178.72 2dme h LEU 51 N 0.00 -0.79 -1.39 1.64 5.85 0.35 0.47 115.31 121.43 2dme h LEU 51 Ca -0.28 0.03 0.16 0.00 0.84 0.00 0.00 57.88 58.63 2dme h LEU 51 Cb 2.01 0.20 -0.07 0.00 0.37 0.00 0.00 40.66 43.18 2dme h LEU 51 CO 0.08 -0.46 0.57 0.15 -0.34 0.00 0.00 178.44 178.43 2dme h PHE 52 N -1.14 0.69 -0.01 1.25 3.57 -1.01 0.11 116.94 120.40 2dme h PHE 52 Ca -0.10 0.02 -0.23 0.00 3.53 0.00 0.00 57.97 61.20 2dme h PHE 52 Cb 0.71 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 39.24 2dme h PHE 52 CO 0.02 0.23 -0.93 1.03 -2.23 0.00 0.00 178.31 176.43 2dme h SER 53 N 0.56 0.56 0.58 0.41 0.87 -1.61 0.43 113.55 115.36 2dme h SER 53 Ca 0.44 -0.44 -0.03 0.00 -1.23 0.00 0.00 61.79 60.53 2dme h SER 53 Cb 0.87 -0.17 0.01 0.00 -0.44 0.00 0.00 62.40 62.66 2dme h SER 53 CO -0.19 1.24 -0.28 0.15 -0.53 0.00 0.00 176.83 177.22 2dme h PHE 54 N 0.25 -0.73 0.12 2.24 3.57 0.18 -3.28 116.94 119.29 2dme h PHE 54 Ca -0.08 -0.02 -0.29 0.00 3.53 0.00 0.00 57.97 61.11 2dme h PHE 54 Cb 1.57 0.24 0.02 0.00 2.79 0.00 0.00 35.95 40.57 2dme h PHE 54 CO 0.06 -0.40 -1.23 0.74 -2.23 0.00 0.00 178.31 175.25 2dme h PHE 55 N -0.93 0.89 -0.96 0.41 0.04 -1.32 -3.48 116.94 111.58 2dme h PHE 55 Ca -0.08 -0.57 -0.14 0.00 2.80 0.00 0.00 57.97 59.99 2dme h PHE 55 Cb 0.65 -0.07 -0.01 0.00 2.20 0.00 0.00 35.95 38.73 2dme h PHE 55 CO -0.01 1.42 -0.17 -2.13 -0.60 0.00 0.00 178.31 176.81 2dme n ARG 56 N -3.74 -0.54 -3.62 1.51 0.63 0.15 -5.01 116.66 106.04 2dme n ARG 56 Ca -0.12 0.33 -0.06 0.00 -0.92 0.00 0.00 57.85 57.08 2dme n ARG 56 Cb 0.98 -4.21 -0.05 0.00 0.45 0.00 0.00 32.46 29.63 2dme n ARG 56 CO 0.00 0.00 0.00 0.16 -2.51 0.00 0.00 177.63 175.28 2dme s ASP 57 N -2.70 -0.21 -0.96 6.15 1.47 -1.24 -5.04 116.67 114.14 2dme s ASP 57 Ca 0.00 0.30 -0.01 0.00 1.18 0.00 0.00 52.55 54.02 2dme s ASP 57 Cb 0.00 0.27 0.33 0.00 -0.34 0.00 0.00 42.92 43.18 2dme s ASP 57 CO 0.00 -0.15 1.85 0.35 0.68 0.00 0.00 175.17 177.90 2dme n THR 58 N 1.06 5.29 -3.54 2.11 -2.24 -1.26 -4.53 114.28 111.17 2dme n THR 58 Ca -0.07 -5.49 -0.24 0.00 -2.27 0.00 0.00 64.05 55.98 2dme n THR 58 Cb 0.58 -1.46 0.03 0.00 -2.10 0.00 0.00 70.33 67.38 2dme n THR 58 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2dme n ASP 59 N -0.21 2.52 -0.10 3.42 9.92 -1.26 -4.94 116.55 125.91 2dme n ASP 59 Ca 0.48 -2.78 -0.03 0.00 -0.53 0.00 0.00 54.79 51.94 2dme n ASP 59 Cb 0.26 -0.20 -0.02 0.00 -0.64 0.00 0.00 41.12 40.51 2dme n ASP 59 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2dme n ALA 60 N -2.04 -0.15 -0.28 2.24 0.00 -1.26 -0.69 120.51 118.32 2dme n ALA 60 Ca -0.16 0.20 -0.07 0.00 0.00 0.00 0.00 53.44 53.41 2dme n ALA 60 Cb 0.63 0.21 -0.07 0.00 0.00 0.00 0.00 19.45 20.22 2dme n ALA 60 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2dme n LYS 61 N -3.44 -0.30 -0.31 0.00 5.02 -1.26 0.34 118.16 118.22 2dme n LYS 61 Ca 0.00 1.24 0.02 0.00 -2.02 0.00 0.00 58.31 57.55 2dme n LYS 61 Cb 0.06 -1.82 0.07 0.00 -0.02 0.00 0.00 35.03 33.32 2dme n LYS 61 CO 0.00 0.00 0.00 0.98 -0.52 0.00 0.00 177.40 177.86 2dme n TYR 62 N -4.56 0.15 0.12 2.13 9.36 0.13 0.23 117.16 124.72 2dme n TYR 62 Ca 0.01 1.01 -0.02 0.00 3.32 0.00 0.00 57.90 62.23 2dme n TYR 62 Cb 0.17 -0.89 0.12 0.00 -0.63 0.00 0.00 39.34 38.12 2dme n TYR 62 CO 0.00 0.00 0.00 0.87 0.22 0.00 0.00 176.86 177.95 2dme h LYS 63 N 0.00 0.00 0.00 2.98 6.56 -0.20 -2.90 116.57 123.01 2dme h LYS 63 Ca 0.34 0.00 -0.03 0.00 -1.06 0.00 0.00 60.65 59.89 2dme h LYS 63 Cb 0.54 0.00 -0.00 0.00 -0.57 0.00 0.00 32.23 32.20 2dme h LYS 63 CO -0.83 0.68 -0.16 -0.97 -2.06 0.00 0.00 179.45 176.11 2dme h ASN 64 N 0.00 0.00 0.23 0.86 -0.73 0.77 -1.59 115.58 115.13 2dme h ASN 64 Ca -0.01 0.00 -0.35 0.00 1.87 0.00 0.00 56.30 57.82 2dme h ASN 64 Cb 1.22 0.00 0.02 0.00 0.27 0.00 0.00 38.32 39.83 2dme h ASN 64 CO 0.09 0.16 -1.64 0.50 -0.37 0.00 0.00 177.43 176.16 2dme h LYS 65 N 0.00 0.45 0.77 6.67 1.63 -0.69 -3.24 116.57 122.16 2dme h LYS 65 Ca -0.00 -0.76 -0.04 0.00 -0.85 0.00 0.00 60.65 59.00 2dme h LYS 65 Cb 0.31 0.28 0.01 0.00 -0.60 0.00 0.00 32.23 32.23 2dme h LYS 65 CO 0.02 1.36 -0.37 -0.92 -3.45 0.00 0.00 179.45 176.09 2dme h TYR 66 N 0.12 -0.96 -0.83 1.91 3.20 -1.29 0.55 116.97 119.67 2dme h TYR 66 Ca -0.31 -0.02 0.24 0.00 3.14 0.00 0.00 58.73 61.78 2dme h TYR 66 Cb 2.13 0.32 -0.03 0.00 1.54 0.00 0.00 36.73 40.68 2dme h TYR 66 CO 0.11 -0.60 0.66 0.07 -1.64 0.00 0.00 178.16 176.77 2dme h ARG 67 N -1.16 0.00 0.02 1.82 0.11 -1.48 -0.69 114.38 112.99 2dme h ARG 67 Ca -0.11 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 59.97 2dme h ARG 67 Cb 0.79 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.87 2dme h ARG 67 CO 0.17 0.00 -0.01 1.03 0.10 0.00 0.00 179.97 181.26 2dme h SER 68 N 0.00 -0.02 -0.97 0.08 0.87 -1.51 0.12 113.55 112.11 2dme h SER 68 Ca 0.39 -0.75 0.17 0.00 -1.23 0.00 0.00 61.79 60.38 2dme h SER 68 Cb 1.72 0.01 -0.09 0.00 -0.44 0.00 0.00 62.40 63.59 2dme h SER 68 CO -0.00 0.80 0.61 -0.07 -0.53 0.00 0.00 176.83 177.63 2dme h LEU 69 N -0.90 0.72 0.16 2.23 3.38 0.56 -1.59 115.31 119.87 2dme h LEU 69 Ca -0.00 0.07 -0.33 0.00 0.09 0.00 0.00 57.88 57.71 2dme h LEU 69 Cb 0.77 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.46 2dme h LEU 69 CO 0.00 0.30 -1.63 0.00 0.09 0.00 0.00 178.44 177.21 2dme h MET 70 N 0.72 0.34 -1.25 1.13 -0.00 -1.39 -3.25 114.93 111.23 2dme h MET 70 Ca 0.52 -0.58 0.37 0.00 -0.00 0.00 0.00 59.70 60.02 2dme h MET 70 Cb 0.86 0.22 -0.10 0.00 -0.00 0.00 0.00 31.60 32.57 2dme h MET 70 CO -0.29 1.23 0.83 0.35 -0.00 0.00 0.00 176.91 179.03 2dme h PHE 71 N 0.09 0.44 0.00 -0.10 3.04 0.25 1.10 116.94 121.77 2dme h PHE 71 Ca -0.29 0.02 -0.16 0.00 3.98 0.00 0.00 57.97 61.52 2dme h PHE 71 Cb 2.07 -0.12 -0.03 0.00 2.56 0.00 0.00 35.95 40.43 2dme h PHE 71 CO 0.09 -0.06 -1.17 -0.91 -2.02 0.00 0.00 178.31 174.23 2dme h ASN 72 N 0.17 0.00 0.05 0.41 2.35 -1.60 -2.93 115.58 114.04 2dme h ASN 72 Ca 0.71 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 56.45 2dme h ASN 72 Cb 2.23 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.61 2dme h ASN 72 CO -0.28 0.60 -0.03 -0.07 -1.65 0.00 0.00 177.43 176.01 2dme h LEU 73 N 0.00 -0.06 -0.36 1.61 3.38 0.11 -3.10 115.31 116.89 2dme h LEU 73 Ca -0.12 -0.38 0.00 0.00 0.09 0.00 0.00 57.88 57.47 2dme h LEU 73 Cb 1.56 0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.33 2dme h LEU 73 CO 0.06 0.36 0.00 0.07 0.09 0.00 0.00 178.44 179.02 2dme h LYS 74 N -0.50 0.00 -6.34 1.13 2.10 -1.18 -3.45 116.57 108.34 2dme h LYS 74 Ca -0.01 0.00 -0.65 0.00 -2.00 0.00 0.00 60.65 57.99 2dme h LYS 74 Cb 0.44 0.00 0.05 0.00 -0.90 0.00 0.00 32.23 31.82 2dme h LYS 74 CO 0.01 0.00 0.62 -3.47 -2.00 0.00 0.00 179.45 174.61 2dme n ASP 75 N -2.65 2.22 0.20 7.07 2.03 -1.10 -4.86 116.55 119.45 2dme n ASP 75 Ca 0.04 1.10 0.06 0.00 0.52 0.00 0.00 54.79 56.51 2dme n ASP 75 Cb 0.41 -1.27 0.41 0.00 -0.72 0.00 0.00 41.12 39.95 2dme n ASP 75 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2dme h PRO 76 N 5.34 0.00 0.02 -0.67 0.13 -1.88 -2.95 132.00 131.98 2dme h PRO 76 Ca -0.47 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.45 2dme h PRO 76 Cb 1.31 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.42 2dme h PRO 76 CO 0.83 0.33 -0.96 0.87 -0.23 0.00 0.00 178.00 178.84 2dme h LYS 77 N 0.00 0.10 -4.73 0.86 1.57 -1.93 -3.42 116.57 109.01 2dme h LYS 77 Ca -0.00 -0.13 -0.68 0.00 -1.87 0.00 0.00 60.65 57.97 2dme h LYS 77 Cb 0.74 0.04 -0.19 0.00 0.08 0.00 0.00 32.23 32.91 2dme h LYS 77 CO 0.04 0.98 -0.46 1.21 -0.57 0.00 0.00 179.45 180.66 2dme s ASN 78 N -6.86 6.08 -0.35 0.86 3.84 -1.12 -4.95 114.94 112.44 2dme s ASN 78 Ca -0.01 -0.42 0.14 0.00 0.21 0.00 0.00 52.86 52.78 2dme s ASN 78 Cb 0.10 -2.15 0.45 0.00 -0.55 0.00 0.00 41.25 39.10 2dme s ASN 78 CO 0.83 -0.25 1.03 0.59 -2.79 0.00 0.00 177.10 176.50 2dme n ASN 79 N 5.14 2.67 0.08 -4.21 3.02 -1.26 -4.57 115.26 116.13 2dme n ASN 79 Ca -0.12 -3.02 0.00 0.00 -0.03 0.00 0.00 54.58 51.40 2dme n ASN 79 Cb 0.50 -0.49 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 2dme n ASN 79 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 2dme n ILE 80 N -0.27 0.44 -0.15 2.41 2.08 -1.26 -4.81 119.36 117.79 2dme n ILE 80 Ca 0.20 0.15 -0.08 0.00 0.56 0.00 0.00 62.75 63.58 2dme n ILE 80 Cb 0.77 -0.98 -0.06 0.00 -0.75 0.00 0.00 39.64 38.62 2dme n ILE 80 CO 0.00 0.00 0.00 0.25 0.56 0.00 0.00 176.55 177.36 2dme h LEU 81 N 0.00 -1.20 -1.46 1.39 5.85 -1.87 0.87 115.31 118.90 2dme h LEU 81 Ca 0.00 0.17 0.36 0.00 0.84 0.00 0.00 57.88 59.24 2dme h LEU 81 Cb 0.09 0.51 -0.05 0.00 0.37 0.00 0.00 40.66 41.58 2dme h LEU 81 CO 0.00 -0.20 1.17 2.19 -0.34 0.00 0.00 178.44 181.26 2dme h PHE 82 N -0.15 0.00 0.03 1.25 -5.15 -1.90 1.56 116.94 112.58 2dme h PHE 82 Ca 0.06 0.00 -0.34 0.00 -0.20 0.00 0.00 57.97 57.50 2dme h PHE 82 Cb 0.32 0.00 -0.05 0.00 0.22 0.00 0.00 35.95 36.44 2dme h PHE 82 CO -0.80 0.00 -2.00 1.17 -2.00 0.00 0.00 178.31 174.69 2dme n LYS 83 N -3.53 0.68 -0.12 6.09 4.81 0.25 -3.32 118.16 123.02 2dme n LYS 83 Ca 0.27 0.22 -0.11 0.00 -0.87 0.00 0.00 58.31 57.82 2dme n LYS 83 Cb 1.55 -1.69 0.02 0.00 0.02 0.00 0.00 35.03 34.93 2dme n LYS 83 CO 0.00 0.00 0.00 0.87 1.17 0.00 0.00 177.40 179.44 2dme h LYS 84 N 0.02 0.90 -0.13 1.64 1.57 0.74 0.10 116.57 121.41 2dme h LYS 84 Ca -0.40 -0.41 -0.21 0.00 -1.87 0.00 0.00 60.65 57.75 2dme h LYS 84 Cb 2.05 -0.02 0.01 0.00 0.08 0.00 0.00 32.23 34.35 2dme h LYS 84 CO 0.05 1.06 -0.77 0.28 -0.57 0.00 0.00 179.45 179.51 2dme h VAL 85 N 0.76 1.31 0.17 0.50 2.07 -0.77 0.21 116.25 120.50 2dme h VAL 85 Ca 0.09 -2.02 -0.01 0.00 0.82 0.00 0.00 66.70 65.58 2dme h VAL 85 Cb 0.85 2.02 0.00 0.00 -1.52 0.00 0.00 31.29 32.64 2dme h VAL 85 CO 0.07 0.63 -0.08 -0.07 0.02 0.00 0.00 177.57 178.14 2dme h LEU 86 N 0.47 -0.19 -0.64 2.57 4.07 -1.54 -3.29 115.31 116.75 2dme h LEU 86 Ca -0.05 -0.34 0.04 0.00 0.08 0.00 0.00 57.88 57.62 2dme h LEU 86 Cb 1.38 0.05 -0.05 0.00 1.08 0.00 0.00 40.66 43.12 2dme h LEU 86 CO 0.15 0.33 0.37 0.50 -1.08 0.00 0.00 178.44 178.71 2dme h LYS 87 N -0.81 0.69 0.00 1.13 1.63 -0.90 -3.47 116.57 114.84 2dme h LYS 87 Ca -0.02 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.74 2dme h LYS 87 Cb 0.52 -0.16 0.00 0.00 -0.60 0.00 0.00 32.23 32.00 2dme h LYS 87 CO 0.04 0.46 0.00 0.41 -3.45 0.00 0.00 179.45 176.91 2dme n GLY 88 N -1.28 1.31 0.26 5.01 0.00 -0.69 -5.00 105.19 104.80 2dme n GLY 88 Ca 0.07 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.17 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 -0.06 -4.53 1.61 -0.58 0.14 -4.22 120.64 113.01 2dme n GLU 89 Ca 0.00 1.11 -0.31 0.00 -0.42 0.00 0.00 57.16 57.55 2dme n GLU 89 Cb 0.00 -1.71 -0.12 0.00 -0.57 0.00 0.00 31.44 29.04 2dme n GLU 89 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2dme s VAL 90 N -5.78 3.02 0.27 2.62 1.01 0.52 -4.97 120.40 117.09 2dme s VAL 90 Ca -0.10 -1.16 -0.03 0.00 0.00 0.00 0.00 61.98 60.69 2dme s VAL 90 Cb 0.21 -2.31 -0.05 0.00 0.00 0.00 0.00 36.38 34.22 2dme s VAL 90 CO 0.57 0.29 0.51 0.42 0.00 0.00 0.00 175.10 176.89 2dme s THR 91 N -1.00 5.08 0.19 3.92 -4.23 -1.26 -4.17 115.64 114.17 2dme s THR 91 Ca 0.16 -0.09 0.27 0.00 -1.18 0.00 0.00 61.69 60.85 2dme s THR 91 Cb -0.11 -3.74 0.28 0.00 1.34 0.00 0.00 72.50 70.27 2dme s THR 91 CO 0.07 -0.30 1.91 1.55 -0.54 0.00 0.00 174.62 177.31 2dme h PRO 92 N 1.69 0.00 0.17 3.99 0.13 -1.89 -0.22 132.00 135.87 2dme h PRO 92 Ca -0.48 0.00 -0.29 0.00 -0.87 0.00 0.00 66.00 64.37 2dme h PRO 92 Cb 1.19 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.34 2dme h PRO 92 CO 0.66 0.16 -1.36 0.38 -0.23 0.00 0.00 178.00 177.62 2dme h ASP 93 N 0.00 0.57 0.30 1.44 3.04 -1.92 -3.36 116.42 116.50 2dme h ASP 93 Ca -0.00 -0.91 -0.20 0.00 -3.24 0.00 0.00 57.03 52.67 2dme h ASP 93 Cb 0.61 -0.19 -0.00 0.00 -1.04 0.00 0.00 39.33 38.72 2dme h ASP 93 CO 0.02 1.63 -0.83 -0.74 -2.04 0.00 0.00 179.24 177.28 2dme h HIS 94 N -0.12 0.57 -0.49 4.15 2.76 -1.94 -3.16 115.15 116.91 2dme h HIS 94 Ca -0.26 -0.28 0.14 0.00 -2.20 0.00 0.00 60.37 57.77 2dme h HIS 94 Cb 1.91 -0.08 -0.02 0.00 1.55 0.00 0.00 27.41 30.77 2dme h HIS 94 CO 0.14 1.07 0.87 1.25 -1.30 0.00 0.00 177.93 179.95 2dme h LEU 95 N 0.25 0.00 0.08 0.26 5.85 -1.17 1.49 115.31 122.07 2dme h LEU 95 Ca -0.05 0.00 -0.29 0.00 0.84 0.00 0.00 57.88 58.38 2dme h LEU 95 Cb 1.43 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.44 2dme h LEU 95 CO 0.14 0.00 -1.48 0.40 -0.34 0.00 0.00 178.44 177.17 2dme h ILE 96 N 0.00 1.19 -0.87 4.05 2.04 -1.73 -3.33 117.51 118.86 2dme h ILE 96 Ca 0.23 -2.88 -0.53 0.00 1.00 0.00 0.00 64.86 62.68 2dme h ILE 96 Cb 1.97 2.72 -0.28 0.00 -0.74 0.00 0.00 36.82 40.49 2dme h ILE 96 CO -0.00 0.80 0.49 -2.11 0.00 0.00 0.00 178.15 177.32 2dme n ARG 97 N -3.37 2.48 -3.72 2.37 1.85 0.50 -4.97 116.66 111.78 2dme n ARG 97 Ca -0.14 -3.25 -0.37 0.00 -1.00 0.00 0.00 57.85 53.08 2dme n ARG 97 Cb 1.03 -2.17 -0.06 0.00 -1.05 0.00 0.00 32.46 30.20 2dme n ARG 97 CO 0.00 0.00 0.00 -1.64 -0.01 0.00 0.00 177.63 175.98 2dme s MET 98 N -3.52 3.63 0.39 2.89 -1.94 -0.57 -5.02 119.30 115.16 2dme s MET 98 Ca 0.58 0.08 -0.24 0.00 -1.71 0.00 0.00 55.69 54.40 2dme s MET 98 Cb 0.47 -3.19 -0.13 0.00 2.01 0.00 0.00 34.83 33.99 2dme s MET 98 CO 0.04 0.74 0.64 0.43 -0.01 0.00 0.00 175.02 176.86 2dme n SER 99 N 1.85 -0.45 0.00 3.03 7.64 -1.26 -4.82 113.62 119.61 2dme n SER 99 Ca -0.17 0.97 0.07 0.00 1.01 0.00 0.00 58.87 60.75 2dme n SER 99 Cb 0.54 -1.15 0.33 0.00 -1.01 0.00 0.00 64.21 62.92 2dme n SER 99 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2dme n PRO 100 N 0.58 0.08 -0.00 1.43 -0.04 -1.26 -2.03 135.00 133.76 2dme n PRO 100 Ca 0.12 0.21 0.09 0.00 -0.04 0.00 0.00 63.50 63.88 2dme n PRO 100 Cb 0.38 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.22 2dme n PRO 100 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2dme n GLU 101 N -1.41 0.91 0.04 0.54 2.13 -1.26 -4.37 120.64 117.21 2dme n GLU 101 Ca 0.05 -0.06 -0.11 0.00 0.66 0.00 0.00 57.16 57.70 2dme n GLU 101 Cb 0.15 -1.38 -0.13 0.00 0.27 0.00 0.00 31.44 30.35 2dme n GLU 101 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 2dme h GLU 102 N 0.00 0.09 -0.99 5.31 5.08 -1.75 -2.72 114.58 119.60 2dme h GLU 102 Ca 0.00 -0.16 0.19 0.00 -1.00 0.00 0.00 59.36 58.39 2dme h GLU 102 Cb 0.57 0.06 -0.10 0.00 0.50 0.00 0.00 28.75 29.78 2dme h GLU 102 CO 0.00 0.91 0.61 -0.07 -1.00 0.00 0.00 179.01 179.46 2dme h LEU 103 N 0.03 0.72 0.12 1.33 3.38 -1.74 -2.35 115.31 116.79 2dme h LEU 103 Ca -0.17 0.08 -0.36 0.00 0.09 0.00 0.00 57.88 57.52 2dme h LEU 103 Cb 1.93 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 42.61 2dme h LEU 103 CO 0.13 0.27 -2.01 0.00 0.09 0.00 0.00 178.44 176.92 2dme n ALA 104 N -2.37 0.93 -1.10 1.53 0.00 -1.25 -4.60 120.51 113.65 2dme n ALA 104 Ca 0.22 -0.61 -0.37 0.00 0.00 0.00 0.00 53.44 52.68 2dme n ALA 104 Cb 0.59 -0.67 -0.01 0.00 0.00 0.00 0.00 19.45 19.36 2dme n ALA 104 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2dme n SER 105 N -3.46 -1.67 -2.30 0.00 2.88 -0.89 -4.89 113.62 103.29 2dme n SER 105 Ca -0.32 0.79 -0.21 0.00 -1.33 0.00 0.00 58.87 57.80 2dme n SER 105 Cb 1.05 -0.75 0.02 0.00 -0.75 0.00 0.00 64.21 63.78 2dme n SER 105 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 2dme n LYS 106 N 0.95 3.17 -3.42 -1.46 2.85 -1.26 -4.79 118.16 114.20 2dme n LYS 106 Ca 0.12 -4.13 -0.39 0.00 -1.05 0.00 0.00 58.31 52.86 2dme n LYS 106 Cb 0.26 -2.12 -0.09 0.00 -0.65 0.00 0.00 35.03 32.43 2dme n LYS 106 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 177.40 175.35 2dme s GLU 107 N -3.58 3.89 0.00 -1.58 2.56 -1.26 -4.92 118.70 113.81 2dme s GLU 107 Ca 0.46 -0.13 0.12 0.00 0.00 0.00 0.00 54.97 55.42 2dme s GLU 107 Cb 0.40 -3.70 0.22 0.00 2.00 0.00 0.00 34.13 33.06 2dme s GLU 107 CO -0.04 -0.33 1.10 1.47 -0.56 0.00 0.00 175.26 176.90 2dme n LEU 108 N 5.31 2.55 0.01 2.70 -0.00 -1.26 -4.39 117.00 121.92 2dme n LEU 108 Ca -0.09 -1.52 0.11 0.00 -0.00 0.00 0.00 56.01 54.50 2dme n LEU 108 Cb 0.51 -0.13 -0.12 0.00 -0.00 0.00 0.00 43.42 43.68 2dme n LEU 108 CO 0.37 0.58 -0.40 0.00 -0.00 0.00 0.00 177.39 177.94 2dme n ALA 109 N 0.66 3.41 -0.01 1.47 0.00 -1.26 -4.37 120.51 120.41 2dme n ALA 109 Ca 0.10 -0.51 -0.17 0.00 0.00 0.00 0.00 53.44 52.87 2dme n ALA 109 Cb 0.38 -0.81 -0.11 0.00 0.00 0.00 0.00 19.45 18.91 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 2.35 0.06 -1.44 0.00 0.00 -2.00 -3.45 119.26 114.78 2dme h ALA 110 Ca 0.00 -0.54 -0.71 0.00 0.00 0.00 0.00 54.91 53.66 2dme h ALA 110 Cb 0.82 0.03 0.06 0.00 0.00 0.00 0.00 17.79 18.70 2dme h ALA 110 CO 0.00 0.27 0.28 0.91 0.00 0.00 0.00 179.25 180.71 2dme n TRP 111 N -4.31 1.15 -0.92 0.00 5.03 -1.26 -4.94 117.44 112.20 2dme n TRP 111 Ca -0.10 0.79 -0.24 0.00 3.03 0.00 0.00 57.50 60.99 2dme n TRP 111 Cb 0.62 -2.24 0.20 0.00 -1.03 0.00 0.00 31.31 28.86 2dme n TRP 111 CO 0.00 0.00 0.00 0.54 -0.03 0.00 0.00 177.69 178.20 2dme n ARG 112 N 2.07 -2.72 -3.93 -0.99 1.74 -1.26 -5.09 116.66 106.48 2dme n ARG 112 Ca 0.19 -1.37 -0.24 0.00 -0.77 0.00 0.00 57.85 55.66 2dme n ARG 112 Cb 0.16 -1.29 -0.05 0.00 -1.02 0.00 0.00 32.46 30.26 2dme n ARG 112 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00 2dme n ARG 113 N -4.15 1.06 -3.75 5.56 0.00 -1.26 -5.14 116.66 108.98 2dme n ARG 113 Ca 0.12 -2.75 -0.07 0.00 -0.00 0.00 0.00 57.85 55.15 2dme n ARG 113 Cb 0.46 0.70 -0.02 0.00 -0.00 0.00 0.00 32.46 33.60 2dme n ARG 113 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.63 176.65 2dme s ARG 114 N -3.40 1.53 0.43 2.89 3.03 -1.26 -5.18 118.95 117.00 2dme s ARG 114 Ca 0.02 -0.80 0.03 0.00 2.03 0.00 0.00 55.73 57.02 2dme s ARG 114 Cb -0.00 0.55 0.00 0.00 -1.03 0.00 0.00 34.95 34.47 2dme s ARG 114 CO 0.01 -0.70 0.62 -1.12 -1.13 0.00 0.00 175.30 172.99 2dme s SER 115 N -2.87 5.73 0.35 -2.89 0.01 -1.26 -5.03 113.70 107.74 2dme s SER 115 Ca 0.09 0.00 -0.23 0.00 1.31 0.00 0.00 55.95 57.13 2dme s SER 115 Cb -0.04 -1.20 -0.16 0.00 0.21 0.00 0.00 66.02 64.83 2dme s SER 115 CO 0.02 -0.72 0.19 0.61 0.41 0.00 0.00 173.24 173.74 2dme n GLY 116 N -1.98 -2.50 3.67 3.44 0.00 -1.26 -4.81 105.19 101.76 2dme n GLY 116 Ca 0.03 0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 2dme n GLY 116 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dme s PRO 117 N -0.99 4.23 -0.38 1.61 0.04 -1.26 -4.90 135.00 133.35 2dme s PRO 117 Ca 0.60 2.02 -0.34 0.00 0.04 0.00 0.00 61.00 63.32 2dme s PRO 117 Cb -0.70 -3.74 -0.11 0.00 0.04 0.00 0.00 34.50 29.99 2dme s PRO 117 CO 0.61 -0.70 2.22 0.45 0.04 0.00 0.00 177.00 179.62 2dme n SER 118 N 6.16 2.11 -4.74 6.66 2.88 -1.26 -4.90 113.62 120.53 2dme n SER 118 Ca 0.15 0.34 -0.32 0.00 -1.33 0.00 0.00 58.87 57.71 2dme n SER 118 Cb 0.43 -1.28 0.10 0.00 -0.75 0.00 0.00 64.21 62.71 2dme n SER 118 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2dme s SER 119 N 7.70 4.23 0.00 -3.46 0.15 -1.26 -5.31 113.70 115.75 2dme s SER 119 Ca 1.10 2.07 0.00 0.00 0.70 0.00 0.00 55.95 59.82 2dme s SER 119 Cb -0.82 -2.55 0.00 0.00 -1.71 0.00 0.00 66.02 60.94 2dme s SER 119 CO 0.47 -2.22 0.00 0.61 1.20 0.00 0.00 173.24 173.30