#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 6.50 -0.15 1.61 0.01 -1.26 -5.04 113.70 115.37 2dme s SER 2 Ca 0.00 0.32 0.01 0.00 1.31 0.00 0.00 55.95 57.59 2dme s SER 2 Cb 0.00 -2.35 0.02 0.00 0.21 0.00 0.00 66.02 63.90 2dme s SER 2 CO 0.00 -0.59 -0.16 -0.55 0.41 0.00 0.00 173.24 172.35 2dme s SER 3 N 1.74 2.79 0.07 2.44 0.15 -1.26 -5.09 113.70 114.54 2dme s SER 3 Ca 0.27 -0.53 -0.32 0.00 0.70 0.00 0.00 55.95 56.07 2dme s SER 3 Cb -0.14 -1.26 -0.11 0.00 -1.71 0.00 0.00 66.02 62.80 2dme s SER 3 CO 0.14 -0.03 1.82 0.61 1.20 0.00 0.00 173.24 176.98 2dme n GLY 4 N 4.64 1.56 3.96 9.45 0.00 -1.26 -4.98 105.19 118.56 2dme n GLY 4 Ca -0.18 0.75 -0.21 0.00 0.00 0.00 0.00 46.02 46.38 2dme n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dme s SER 5 N 2.90 6.21 -0.86 1.61 1.04 -1.26 -5.03 113.70 118.31 2dme s SER 5 Ca 0.84 0.01 -0.25 0.00 0.48 0.00 0.00 55.95 57.03 2dme s SER 5 Cb -0.56 -1.74 0.03 0.00 0.10 0.00 0.00 66.02 63.85 2dme s SER 5 CO 0.41 -0.12 1.40 -0.55 0.98 0.00 0.00 173.24 175.37 2dme s SER 6 N -4.00 6.22 -0.12 7.02 0.15 -1.26 -4.97 113.70 116.74 2dme s SER 6 Ca 0.35 -0.85 0.02 0.00 0.70 0.00 0.00 55.95 56.18 2dme s SER 6 Cb -0.09 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.66 2dme s SER 6 CO 0.29 -1.76 -0.21 -0.83 1.20 0.00 0.00 173.24 171.93 2dme s GLY 7 N 4.63 1.39 0.21 9.45 0.00 -1.26 -4.93 107.32 116.80 2dme s GLY 7 Ca 0.42 -1.01 -0.23 0.00 0.00 0.00 0.00 44.72 43.91 2dme s GLY 7 CO 0.04 -0.16 0.72 -0.56 0.00 0.00 0.00 173.10 173.14 2dme s SER 8 N 0.56 -0.35 0.35 1.64 0.01 -1.26 -5.02 113.70 109.62 2dme s SER 8 Ca -0.12 -0.36 0.17 0.00 1.31 0.00 0.00 55.95 56.94 2dme s SER 8 Cb -0.17 0.64 1.19 0.00 0.21 0.00 0.00 66.02 67.90 2dme s SER 8 CO 0.04 -1.14 1.52 0.00 0.41 0.00 0.00 173.24 174.07 2dme n ALA 9 N -0.42 0.90 0.03 1.44 0.00 -1.26 -0.18 120.51 121.02 2dme n ALA 9 Ca -0.08 0.99 -0.14 0.00 0.00 0.00 0.00 53.44 54.21 2dme n ALA 9 Cb 0.61 -0.94 -0.08 0.00 0.00 0.00 0.00 19.45 19.04 2dme n ALA 9 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 2dme h ASP 10 N 0.00 -1.47 0.01 0.00 3.04 -1.99 0.12 116.42 116.14 2dme h ASP 10 Ca 0.77 0.18 0.03 0.00 -3.24 0.00 0.00 57.03 54.77 2dme h ASP 10 Cb 1.98 0.57 -0.05 0.00 -1.04 0.00 0.00 39.33 40.80 2dme h ASP 10 CO -0.77 -0.48 -0.31 -0.61 -2.04 0.00 0.00 179.24 175.03 2dme h GLN 11 N -0.59 -0.45 0.04 4.15 4.15 -0.93 0.18 115.11 121.66 2dme h GLN 11 Ca 0.04 0.03 0.01 0.00 0.77 0.00 0.00 58.65 59.50 2dme h GLN 11 Cb 0.68 0.10 -0.03 0.00 0.21 0.00 0.00 27.48 28.44 2dme h GLN 11 CO -0.37 -0.30 -0.32 0.82 -1.93 0.00 0.00 178.83 176.74 2dme h ILE 12 N -0.47 0.00 -0.66 2.39 2.04 -1.17 0.17 117.51 119.81 2dme h ILE 12 Ca 0.06 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.05 2dme h ILE 12 Cb 0.55 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.53 2dme h ILE 12 CO -0.25 0.00 0.11 0.03 0.00 0.00 0.00 178.15 178.04 2dme h ARG 13 N -0.42 0.21 0.16 2.37 3.08 -0.64 -1.72 114.38 117.41 2dme h ARG 13 Ca 0.00 -0.01 0.01 0.00 0.07 0.00 0.00 59.98 60.05 2dme h ARG 13 Cb 0.44 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.41 2dme h ARG 13 CO -0.19 0.14 -0.28 0.37 -1.07 0.00 0.00 179.97 178.94 2dme h GLN 14 N 0.22 -0.50 -0.94 0.04 4.15 -0.06 -2.09 115.11 115.94 2dme h GLN 14 Ca 0.36 0.03 0.22 0.00 0.77 0.00 0.00 58.65 60.03 2dme h GLN 14 Cb 0.58 0.11 -0.12 0.00 0.21 0.00 0.00 27.48 28.26 2dme h GLN 14 CO -0.49 -0.33 0.48 1.03 -1.93 0.00 0.00 178.83 177.60 2dme h SER 15 N -0.52 0.51 -0.46 -0.69 0.87 0.18 0.09 113.55 113.53 2dme h SER 15 Ca 0.02 0.14 0.08 0.00 -1.23 0.00 0.00 61.79 60.80 2dme h SER 15 Cb 0.53 0.07 -0.07 0.00 -0.44 0.00 0.00 62.40 62.49 2dme h SER 15 CO -0.14 0.08 0.04 0.58 -0.53 0.00 0.00 176.83 176.87 2dme h VAL 16 N 0.51 0.70 0.00 2.23 2.07 -0.74 0.11 116.25 121.12 2dme h VAL 16 Ca 0.58 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 68.04 2dme h VAL 16 Cb 1.06 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 31.35 2dme h VAL 16 CO -0.48 0.03 0.00 0.54 0.02 0.00 0.00 177.57 177.68 2dme n ARG 17 N -5.16 0.00 -0.12 1.57 1.74 0.00 -1.83 116.66 112.86 2dme n ARG 17 Ca 0.04 0.54 -0.13 0.00 -0.77 0.00 0.00 57.85 57.53 2dme n ARG 17 Cb 0.23 -1.44 -0.09 0.00 -1.02 0.00 0.00 32.46 30.14 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 -1.62 -0.90 -1.55 2.76 -1.47 -1.50 115.15 110.88 2dme h HIS 18 Ca 0.00 0.08 0.09 0.00 -2.20 0.00 0.00 60.37 58.33 2dme h HIS 18 Cb 0.00 0.76 -0.11 0.00 1.55 0.00 0.00 27.41 29.61 2dme h HIS 18 CO 0.01 -0.49 -0.51 0.43 -1.30 0.00 0.00 177.93 176.07 2dme n SER 19 N -5.39 -0.92 0.11 3.26 7.64 0.37 0.68 113.62 119.37 2dme n SER 19 Ca -0.03 1.59 -0.08 0.00 1.01 0.00 0.00 58.87 61.36 2dme n SER 19 Cb 0.35 -0.22 -0.04 0.00 -1.01 0.00 0.00 64.21 63.29 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 -0.61 -1.83 -3.43 3.38 -0.59 -1.38 115.31 110.85 2dme h LEU 20 Ca 0.16 0.05 0.30 0.00 0.09 0.00 0.00 57.88 58.48 2dme h LEU 20 Cb 0.38 0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.29 2dme h LEU 20 CO -0.85 -0.28 0.88 0.50 0.09 0.00 0.00 178.44 178.78 2dme h LYS 21 N -0.41 0.00 0.20 1.13 3.64 -0.31 0.13 116.57 120.94 2dme h LYS 21 Ca -0.02 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 2dme h LYS 21 Cb 0.37 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.19 2dme h LYS 21 CO -0.04 0.00 -0.10 0.22 -2.27 0.00 0.00 179.45 177.26 2dme h ASP 22 N 0.00 -0.23 0.37 4.20 3.58 0.14 0.49 116.42 124.97 2dme h ASP 22 Ca 0.50 -0.09 -0.02 0.00 0.42 0.00 0.00 57.03 57.84 2dme h ASP 22 Cb 2.24 0.06 0.00 0.00 1.72 0.00 0.00 39.33 43.36 2dme h ASP 22 CO -0.01 -0.05 -0.18 0.40 -2.88 0.00 0.00 179.24 176.53 2dme h ILE 23 N -0.39 0.64 0.00 2.25 2.04 -0.42 -2.35 117.51 119.27 2dme h ILE 23 Ca -0.03 -0.37 0.00 0.00 1.00 0.00 0.00 64.86 65.47 2dme h ILE 23 Cb 0.30 0.82 0.00 0.00 -0.74 0.00 0.00 36.82 37.20 2dme h ILE 23 CO 0.05 0.07 0.00 -0.07 0.00 0.00 0.00 178.15 178.20 2dme h LEU 24 N -0.70 0.00 0.08 1.44 3.38 -1.46 0.31 115.31 118.36 2dme h LEU 24 Ca -0.05 0.00 -0.26 0.00 0.09 0.00 0.00 57.88 57.66 2dme h LEU 24 Cb 0.49 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 2dme h LEU 24 CO 0.08 0.00 -1.26 0.24 0.09 0.00 0.00 178.44 177.59 2dme h MET 25 N 0.00 0.17 0.00 1.13 2.86 -0.45 -2.75 114.93 115.89 2dme h MET 25 Ca 0.00 -0.29 0.00 0.00 -2.06 0.00 0.00 59.70 57.35 2dme h MET 25 Cb 0.00 0.11 0.00 0.00 0.06 0.00 0.00 31.60 31.77 2dme h MET 25 CO 0.00 1.09 -1.32 1.17 1.06 0.00 0.00 176.91 178.90 2dme n LYS 26 N -3.43 0.58 0.13 1.72 0.00 -0.20 -3.24 118.16 113.72 2dme n LYS 26 Ca -0.08 0.00 0.10 0.00 0.00 0.00 0.00 58.31 58.33 2dme n LYS 26 Cb 1.00 -1.70 0.04 0.00 0.00 0.00 0.00 35.03 34.38 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 0.03 1.64 2.47 -0.57 -3.21 114.38 114.74 2dme h ARG 27 Ca 0.00 0.00 -0.32 0.00 -1.26 0.00 0.00 59.98 58.40 2dme h ARG 27 Cb 0.96 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 29.24 2dme h ARG 27 CO 0.00 0.07 -1.89 1.47 0.56 0.00 0.00 179.97 180.18 2dme n LEU 28 N -2.87 1.36 0.07 3.04 -0.00 -1.04 -3.47 117.00 114.09 2dme n LEU 28 Ca 0.00 0.29 -0.04 0.00 -0.00 0.00 0.00 56.01 56.27 2dme n LEU 28 Cb 0.59 -0.20 0.18 0.00 -0.00 0.00 0.00 43.42 43.99 2dme n LEU 28 CO 0.39 0.55 0.61 0.00 -0.00 0.00 0.00 177.39 178.94 2dme h THR 29 N 0.02 1.32 -0.06 1.47 1.03 -1.67 -3.10 112.91 111.91 2dme h THR 29 Ca -0.36 -1.59 -0.23 0.00 -0.01 0.00 0.00 66.41 64.22 2dme h THR 29 Cb 2.04 1.69 0.01 0.00 -1.07 0.00 0.00 68.15 70.82 2dme h THR 29 CO 0.07 0.48 -0.90 -0.78 -0.01 0.00 0.00 175.52 174.38 2dme h ASP 30 N 0.27 0.80 -4.47 0.00 3.58 -1.71 -3.46 116.42 111.43 2dme h ASP 30 Ca 0.02 -0.59 -0.47 0.00 0.42 0.00 0.00 57.03 56.41 2dme h ASP 30 Cb 0.87 -0.24 0.09 0.00 1.72 0.00 0.00 39.33 41.77 2dme h ASP 30 CO 0.07 1.38 0.38 -0.44 -2.88 0.00 0.00 179.24 177.75 2dme s SER 31 N -7.15 4.77 0.00 2.28 0.01 -1.17 -4.92 113.70 107.51 2dme s SER 31 Ca -0.09 0.82 -0.06 0.00 1.31 0.00 0.00 55.95 57.94 2dme s SER 31 Cb 0.08 -1.41 -0.25 0.00 0.21 0.00 0.00 66.02 64.66 2dme s SER 31 CO 0.90 -1.73 3.47 0.59 0.41 0.00 0.00 173.24 176.87 2dme n ASN 32 N -3.19 5.08 -4.65 2.44 4.13 -1.26 -4.86 115.26 112.95 2dme n ASN 32 Ca 0.08 -2.45 -0.35 0.00 1.68 0.00 0.00 54.58 53.54 2dme n ASN 32 Cb 0.60 -1.36 -0.10 0.00 -1.54 0.00 0.00 39.78 37.38 2dme n ASN 32 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2dme s LEU 33 N 0.00 3.90 -0.34 3.41 1.43 -1.25 -4.98 118.68 120.85 2dme s LEU 33 Ca 0.62 0.10 0.08 0.00 -1.03 0.00 0.00 54.13 53.90 2dme s LEU 33 Cb 0.30 -2.00 0.57 0.00 0.03 0.00 0.00 46.19 45.09 2dme s LEU 33 CO 0.00 0.15 1.62 0.29 0.23 0.00 0.00 176.35 178.64 2dme n LYS 34 N 3.68 2.07 -2.40 1.70 5.02 -1.26 -4.81 118.16 122.15 2dme n LYS 34 Ca -0.16 -3.12 -0.36 0.00 -2.02 0.00 0.00 58.31 52.64 2dme n LYS 34 Cb 0.52 -1.94 -0.02 0.00 -0.02 0.00 0.00 35.03 33.56 2dme n LYS 34 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 2dme s VAL 35 N -3.25 3.44 0.44 -0.18 -7.23 -1.26 -5.01 120.40 107.35 2dme s VAL 35 Ca 0.49 1.04 -0.24 0.00 -1.81 0.00 0.00 61.98 61.46 2dme s VAL 35 Cb 0.43 -3.51 -0.08 0.00 0.56 0.00 0.00 36.38 33.79 2dme s VAL 35 CO 0.04 -0.05 1.18 -2.16 -0.31 0.00 0.00 175.10 173.79 2dme s PRO 36 N -2.76 3.87 0.44 4.82 0.04 -1.26 -4.90 135.00 135.24 2dme s PRO 36 Ca 0.63 1.82 0.26 0.00 0.04 0.00 0.00 61.00 63.74 2dme s PRO 36 Cb -0.24 -2.52 1.29 0.00 0.04 0.00 0.00 34.50 33.07 2dme s PRO 36 CO 0.29 -0.47 1.74 1.49 0.04 0.00 0.00 177.00 180.09 2dme h GLU 37 N 2.28 0.23 -0.59 4.56 4.81 -2.03 0.30 114.58 124.13 2dme h GLU 37 Ca -0.49 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 58.75 2dme h GLU 37 Cb 1.24 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 30.54 2dme h GLU 37 CO 0.61 0.15 0.37 1.49 -0.73 0.00 0.00 179.01 180.90 2dme h GLU 38 N 0.23 0.71 -0.12 1.92 4.57 -2.00 -3.12 114.58 116.78 2dme h GLU 38 Ca 0.64 -0.04 0.01 0.00 -1.18 0.00 0.00 59.36 58.79 2dme h GLU 38 Cb 1.95 -0.16 -0.01 0.00 -0.16 0.00 0.00 28.75 30.36 2dme h GLU 38 CO -0.25 0.47 -0.07 1.17 -1.18 0.00 0.00 179.01 179.15 2dme n LYS 39 N -4.73 -0.05 -0.20 1.92 3.00 0.10 0.07 118.16 118.27 2dme n LYS 39 Ca 0.05 1.05 -0.08 0.00 -0.00 0.00 0.00 58.31 59.34 2dme n LYS 39 Cb 0.07 -1.57 -0.03 0.00 0.00 0.00 0.00 35.03 33.50 2dme n LYS 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2dme h ALA 40 N -0.82 -0.27 0.02 3.14 0.00 -1.66 -1.94 119.26 117.73 2dme h ALA 40 Ca 0.02 0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.05 2dme h ALA 40 Cb 0.05 0.92 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 2dme h ALA 40 CO -0.11 -0.80 -0.17 0.00 0.00 0.00 0.00 179.25 178.17 2dme h ALA 41 N 0.70 -0.67 -0.80 0.00 0.00 -1.13 -1.89 119.26 115.46 2dme h ALA 41 Ca 0.19 -0.03 0.15 0.00 0.00 0.00 0.00 54.91 55.21 2dme h ALA 41 Cb 0.56 0.62 -0.14 0.00 0.00 0.00 0.00 17.79 18.83 2dme h ALA 41 CO -0.69 -0.72 -0.25 1.63 0.00 0.00 0.00 179.25 179.23 2dme n LYS 42 N -3.44 -0.12 0.10 0.00 5.02 0.11 0.33 118.16 120.15 2dme n LYS 42 Ca -0.03 1.24 -0.13 0.00 -2.02 0.00 0.00 58.31 57.38 2dme n LYS 42 Cb 0.13 -1.85 -0.06 0.00 -0.02 0.00 0.00 35.03 33.23 2dme n LYS 42 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2dme h VAL 43 N 0.00 0.31 -0.01 -0.18 2.07 -0.82 -1.81 116.25 115.80 2dme h VAL 43 Ca 0.34 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.89 2dme h VAL 43 Cb 0.54 0.31 -0.05 0.00 -1.52 0.00 0.00 31.29 30.56 2dme h VAL 43 CO -0.81 0.00 -0.38 0.00 0.02 0.00 0.00 177.57 176.39 2dme h ALA 44 N 0.14 -0.59 -1.00 1.67 0.00 0.65 0.53 119.26 120.67 2dme h ALA 44 Ca 0.04 -0.03 0.29 0.00 0.00 0.00 0.00 54.91 55.21 2dme h ALA 44 Cb 0.58 0.68 -0.04 0.00 0.00 0.00 0.00 17.79 19.00 2dme h ALA 44 CO -0.21 -0.91 0.72 1.15 0.00 0.00 0.00 179.25 180.00 2dme h THR 45 N -0.53 0.50 0.07 0.00 2.02 -0.92 0.53 112.91 114.57 2dme h THR 45 Ca 0.06 -0.00 -0.16 0.00 0.77 0.00 0.00 66.41 67.08 2dme h THR 45 Cb 0.62 0.50 0.02 0.00 -1.74 0.00 0.00 68.15 67.54 2dme h THR 45 CO -0.30 0.00 -0.65 0.11 0.37 0.00 0.00 175.52 175.04 2dme h LYS 46 N 0.00 0.33 -0.85 6.66 1.79 -0.11 -2.68 116.57 121.71 2dme h LYS 46 Ca 0.48 -0.44 0.11 0.00 -2.18 0.00 0.00 60.65 58.62 2dme h LYS 46 Cb 1.91 0.15 -0.13 0.00 -1.58 0.00 0.00 32.23 32.57 2dme h LYS 46 CO -0.01 1.15 -0.46 0.82 -1.08 0.00 0.00 179.45 179.88 2dme h ILE 47 N -0.29 0.03 0.18 1.86 1.08 0.10 -1.18 117.51 119.30 2dme h ILE 47 Ca -0.10 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.36 2dme h ILE 47 Cb 1.43 0.03 0.00 0.00 -3.07 0.00 0.00 36.82 35.21 2dme h ILE 47 CO 0.12 0.00 -0.09 -0.33 -0.69 0.00 0.00 178.15 177.17 2dme h GLU 48 N -0.08 -0.23 -0.79 2.37 3.07 -1.66 -1.03 114.58 116.22 2dme h GLU 48 Ca 0.24 0.02 0.33 0.00 -0.50 0.00 0.00 59.36 59.44 2dme h GLU 48 Cb 0.54 0.05 -0.13 0.00 -0.84 0.00 0.00 28.75 28.36 2dme h GLU 48 CO -0.87 0.17 0.44 1.17 -1.40 0.00 0.00 179.01 178.51 2dme n LYS 49 N -4.99 -0.04 0.01 2.33 4.81 -0.77 0.16 118.16 119.67 2dme n LYS 49 Ca -0.09 1.04 -0.18 0.00 -0.87 0.00 0.00 58.31 58.22 2dme n LYS 49 Cb 0.26 -1.89 -0.14 0.00 0.02 0.00 0.00 35.03 33.27 2dme n LYS 49 CO 0.00 0.00 0.00 1.49 1.17 0.00 0.00 177.40 180.06 2dme h GLU 50 N 0.00 0.21 0.80 1.64 4.57 -1.22 -3.30 114.58 117.28 2dme h GLU 50 Ca 0.65 -0.36 -0.04 0.00 -1.18 0.00 0.00 59.36 58.43 2dme h GLU 50 Cb 1.77 0.14 0.01 0.00 -0.16 0.00 0.00 28.75 30.50 2dme h GLU 50 CO -0.56 1.05 -0.38 1.25 -1.18 0.00 0.00 179.01 179.18 2dme h LEU 51 N 0.06 -0.91 -0.98 1.64 5.85 0.29 0.36 115.31 121.61 2dme h LEU 51 Ca -0.38 0.02 0.19 0.00 0.84 0.00 0.00 57.88 58.55 2dme h LEU 51 Cb 2.03 0.24 -0.11 0.00 0.37 0.00 0.00 40.66 43.19 2dme h LEU 51 CO 0.10 -0.59 0.58 0.15 -0.34 0.00 0.00 178.44 178.33 2dme h PHE 52 N -1.19 1.01 -0.21 1.25 3.57 -0.25 0.28 116.94 121.41 2dme h PHE 52 Ca -0.11 0.03 -0.20 0.00 3.53 0.00 0.00 57.97 61.22 2dme h PHE 52 Cb 0.84 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 39.28 2dme h PHE 52 CO -0.00 0.20 -0.66 1.03 -2.23 0.00 0.00 178.31 176.64 2dme h SER 53 N 0.71 0.90 0.81 0.41 0.87 -1.60 0.64 113.55 116.29 2dme h SER 53 Ca 0.57 -0.54 -0.04 0.00 -1.23 0.00 0.00 61.79 60.56 2dme h SER 53 Cb 0.91 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 62.61 2dme h SER 53 CO -0.40 1.33 -0.44 0.15 -0.53 0.00 0.00 176.83 176.94 2dme h PHE 54 N 0.57 -1.16 -0.01 2.24 3.57 0.17 -3.18 116.94 119.14 2dme h PHE 54 Ca -0.02 -0.02 -0.19 0.00 3.53 0.00 0.00 57.97 61.27 2dme h PHE 54 Cb 1.27 0.40 -0.01 0.00 2.79 0.00 0.00 35.95 40.40 2dme h PHE 54 CO 0.07 -0.68 -0.84 0.74 -2.23 0.00 0.00 178.31 175.37 2dme h PHE 55 N -1.15 0.34 -1.93 0.41 0.04 -1.29 -3.47 116.94 109.89 2dme h PHE 55 Ca -0.11 -0.18 -0.28 0.00 2.80 0.00 0.00 57.97 60.20 2dme h PHE 55 Cb 0.90 -0.04 -0.02 0.00 2.20 0.00 0.00 35.95 38.99 2dme h PHE 55 CO -0.03 0.97 -0.36 -2.13 -0.60 0.00 0.00 178.31 176.16 2dme n ARG 56 N -3.71 -1.12 -3.61 1.51 0.63 0.22 -4.96 116.66 105.63 2dme n ARG 56 Ca -0.04 0.70 -0.02 0.00 -0.92 0.00 0.00 57.85 57.57 2dme n ARG 56 Cb 0.78 -4.98 -0.01 0.00 0.45 0.00 0.00 32.46 28.70 2dme n ARG 56 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 2dme s ASP 57 N -2.39 -0.12 -0.55 6.15 1.01 -1.23 -5.03 116.67 114.50 2dme s ASP 57 Ca 0.00 -0.06 0.03 0.00 0.71 0.00 0.00 52.55 53.22 2dme s ASP 57 Cb 0.00 0.17 0.41 0.00 1.01 0.00 0.00 42.92 44.51 2dme s ASP 57 CO 0.00 -0.30 1.43 0.35 0.21 0.00 0.00 175.17 176.86 2dme n THR 58 N -0.26 2.80 -1.78 -1.27 -2.24 -1.26 -4.60 114.28 105.68 2dme n THR 58 Ca -0.03 -4.57 -0.22 0.00 -2.27 0.00 0.00 64.05 56.96 2dme n THR 58 Cb 0.60 -1.24 0.15 0.00 -2.10 0.00 0.00 70.33 67.74 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 -0.55 0.17 0.26 3.42 9.92 -1.26 -4.79 116.55 123.72 2dme n ASP 59 Ca 0.45 -1.42 0.18 0.00 -0.53 0.00 0.00 54.79 53.48 2dme n ASP 59 Cb 0.57 -0.75 0.89 0.00 -0.64 0.00 0.00 41.12 41.20 2dme n ASP 59 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2dme h ALA 60 N -1.72 1.53 0.09 2.24 0.00 -1.99 -2.62 119.26 116.79 2dme h ALA 60 Ca -0.32 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.58 2dme h ALA 60 Cb 0.90 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.70 2dme h ALA 60 CO 0.23 -0.30 -0.04 0.87 0.00 0.00 0.00 179.25 180.01 2dme h LYS 61 N 0.00 -0.12 -0.96 0.00 1.57 -1.96 -1.53 116.57 113.57 2dme h LYS 61 Ca 0.05 0.01 0.30 0.00 -1.87 0.00 0.00 60.65 59.14 2dme h LYS 61 Cb 0.53 0.03 -0.17 0.00 0.08 0.00 0.00 32.23 32.70 2dme h LYS 61 CO -0.00 -0.08 0.24 -0.92 -0.57 0.00 0.00 179.45 178.12 2dme h TYR 62 N -0.50 0.33 -0.15 -1.35 5.03 -1.75 0.41 116.97 118.99 2dme h TYR 62 Ca -0.01 0.06 -0.08 0.00 2.58 0.00 0.00 58.73 61.27 2dme h TYR 62 Cb 0.09 0.02 -0.00 0.00 1.55 0.00 0.00 36.73 38.39 2dme h TYR 62 CO 0.02 -0.37 -0.22 0.87 -1.32 0.00 0.00 178.16 177.15 2dme h LYS 63 N 0.08 0.42 -0.89 1.82 1.57 -1.59 -2.71 116.57 115.25 2dme h LYS 63 Ca 0.65 -0.24 0.17 0.00 -1.87 0.00 0.00 60.65 59.36 2dme h LYS 63 Cb 1.47 0.02 -0.07 0.00 0.08 0.00 0.00 32.23 33.73 2dme h LYS 63 CO -0.80 0.83 0.58 -0.91 -0.57 0.00 0.00 179.45 178.58 2dme h ASN 64 N 0.04 0.55 0.05 0.86 4.21 0.83 -1.24 115.58 120.87 2dme h ASN 64 Ca 0.02 0.05 -0.00 0.00 1.21 0.00 0.00 56.30 57.57 2dme h ASN 64 Cb 0.78 -0.06 0.00 0.00 -1.12 0.00 0.00 38.32 37.92 2dme h ASN 64 CO 0.05 0.25 -0.02 0.50 -1.29 0.00 0.00 177.43 176.91 2dme h LYS 65 N 0.56 -0.07 0.18 0.81 1.63 -1.01 -2.57 116.57 116.10 2dme h LYS 65 Ca 0.46 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.27 2dme h LYS 65 Cb 0.93 0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 32.55 2dme h LYS 65 CO -0.21 0.44 -0.32 -0.92 -3.45 0.00 0.00 179.45 174.99 2dme h TYR 66 N -0.61 -0.92 -0.79 1.91 3.20 -1.02 0.53 116.97 119.27 2dme h TYR 66 Ca -0.01 0.02 0.23 0.00 3.14 0.00 0.00 58.73 62.11 2dme h TYR 66 Cb 0.54 0.38 -0.03 0.00 1.54 0.00 0.00 36.73 39.15 2dme h TYR 66 CO 0.10 -0.39 0.59 0.07 -1.64 0.00 0.00 178.16 176.89 2dme h ARG 67 N -0.54 0.00 0.00 1.82 0.11 -1.39 0.63 114.38 115.02 2dme h ARG 67 Ca -0.02 0.00 -0.13 0.00 0.10 0.00 0.00 59.98 59.94 2dme h ARG 67 Cb 0.50 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.57 2dme h ARG 67 CO -0.12 0.00 -0.65 1.03 0.10 0.00 0.00 179.97 180.33 2dme h SER 68 N 0.00 0.00 0.47 0.08 0.87 -0.76 -0.89 113.55 113.31 2dme h SER 68 Ca 0.38 0.00 -0.26 0.00 -1.23 0.00 0.00 61.79 60.67 2dme h SER 68 Cb 1.56 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 63.53 2dme h SER 68 CO -0.00 0.58 -1.15 -0.07 -0.53 0.00 0.00 176.83 175.65 2dme h LEU 69 N 0.00 0.52 0.00 2.23 3.38 0.53 -3.29 115.31 118.69 2dme h LEU 69 Ca -0.02 -0.50 0.00 0.00 0.09 0.00 0.00 57.88 57.45 2dme h LEU 69 Cb 1.46 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 42.04 2dme h LEU 69 CO 0.07 1.35 -0.94 0.00 0.09 0.00 0.00 178.44 179.02 2dme h MET 70 N 0.15 0.00 -0.33 1.13 -0.00 -1.23 -3.34 114.93 111.30 2dme h MET 70 Ca -0.13 0.00 0.04 0.00 -0.00 0.00 0.00 59.70 59.62 2dme h MET 70 Cb 1.84 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 33.42 2dme h MET 70 CO 0.20 0.00 0.23 0.35 -0.00 0.00 0.00 176.91 177.68 2dme h PHE 71 N 0.00 0.26 0.02 -0.10 3.04 -1.22 -2.61 116.94 116.33 2dme h PHE 71 Ca 0.00 0.01 -0.00 0.00 3.98 0.00 0.00 57.97 61.96 2dme h PHE 71 Cb 1.00 -0.09 0.00 0.00 2.56 0.00 0.00 35.95 39.42 2dme h PHE 71 CO 0.00 0.15 -0.01 -0.91 -2.02 0.00 0.00 178.31 175.52 2dme h ASN 72 N 0.26 -0.02 -0.84 0.41 2.35 -1.69 -3.11 115.58 112.94 2dme h ASN 72 Ca 0.14 -0.65 0.12 0.00 -0.55 0.00 0.00 56.30 55.36 2dme h ASN 72 Cb 0.24 0.01 -0.13 0.00 0.05 0.00 0.00 38.32 38.48 2dme h ASN 72 CO -0.03 0.78 -0.42 -0.07 -1.65 0.00 0.00 177.43 176.04 2dme h LEU 73 N -0.97 -1.52 -1.15 1.61 3.38 -1.64 0.54 115.31 115.56 2dme h LEU 73 Ca -0.00 0.29 0.04 0.00 0.09 0.00 0.00 57.88 58.29 2dme h LEU 73 Cb 0.67 0.74 -0.05 0.00 0.09 0.00 0.00 40.66 42.11 2dme h LEU 73 CO 0.00 -0.29 0.58 0.07 0.09 0.00 0.00 178.44 178.89 2dme h LYS 74 N -0.08 1.06 -5.73 1.13 2.10 -1.62 -3.44 116.57 110.00 2dme h LYS 74 Ca 0.26 -0.06 -0.79 0.00 -2.00 0.00 0.00 60.65 58.06 2dme h LYS 74 Cb 0.55 -0.24 0.03 0.00 -0.90 0.00 0.00 32.23 31.68 2dme h LYS 74 CO -0.86 0.70 0.30 -3.47 -2.00 0.00 0.00 179.45 174.12 2dme n ASP 75 N -4.45 0.46 0.26 7.07 2.03 0.19 -4.81 116.55 117.30 2dme n ASP 75 Ca 0.12 1.12 0.14 0.00 0.52 0.00 0.00 54.79 56.69 2dme n ASP 75 Cb 0.12 -0.86 0.62 0.00 -0.72 0.00 0.00 41.12 40.28 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 3.64 0.00 0.03 -0.67 0.13 -1.84 -2.90 132.00 130.38 2dme h PRO 76 Ca -0.46 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.45 2dme h PRO 76 Cb 1.34 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.46 2dme h PRO 76 CO 0.75 0.11 -0.97 0.87 -0.23 0.00 0.00 178.00 178.52 2dme h LYS 77 N 0.00 0.19 -4.49 0.86 1.79 -1.91 -3.39 116.57 109.62 2dme h LYS 77 Ca -0.00 -0.25 -0.74 0.00 -2.18 0.00 0.00 60.65 57.49 2dme h LYS 77 Cb 0.57 0.08 -0.21 0.00 -1.58 0.00 0.00 32.23 31.08 2dme h LYS 77 CO 0.01 1.02 0.54 -0.80 -1.08 0.00 0.00 179.45 179.15 2dme s ASN 78 N -6.95 6.72 -0.48 0.86 -0.87 -1.10 -4.84 114.94 108.29 2dme s ASN 78 Ca -0.03 -2.39 0.03 0.00 -1.57 0.00 0.00 52.86 48.90 2dme s ASN 78 Cb 0.09 -2.32 0.50 0.00 -0.02 0.00 0.00 41.25 39.51 2dme s ASN 78 CO 0.84 -0.83 1.73 -0.46 -2.57 0.00 0.00 177.10 175.81 2dme n ASN 79 N 5.35 5.39 0.04 -1.22 0.23 -1.26 -4.54 115.26 119.24 2dme n ASN 79 Ca 0.20 -3.75 0.00 0.00 -0.53 0.00 0.00 54.58 50.50 2dme n ASN 79 Cb 0.48 -0.75 0.00 0.00 -2.08 0.00 0.00 39.78 37.42 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 -0.96 0.32 -0.25 1.53 5.41 -1.26 -4.79 119.36 119.36 2dme n ILE 80 Ca 0.53 0.10 -0.07 0.00 1.00 0.00 0.00 62.75 64.32 2dme n ILE 80 Cb 0.98 -1.10 -0.06 0.00 -0.71 0.00 0.00 39.64 38.76 2dme n ILE 80 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 176.55 176.44 2dme n LEU 81 N -3.10 -0.63 -0.34 1.39 7.94 -1.26 0.19 117.00 121.19 2dme n LEU 81 Ca 0.00 1.43 0.14 0.00 -1.11 0.00 0.00 56.01 56.47 2dme n LEU 81 Cb 0.16 -0.33 0.28 0.00 0.53 0.00 0.00 43.42 44.07 2dme n LEU 81 CO 0.00 -1.05 0.77 2.22 -1.11 0.00 0.00 177.39 178.22 2dme n PHE 82 N -4.34 0.61 0.04 1.96 -1.74 -1.26 -0.79 117.46 111.95 2dme n PHE 82 Ca 0.01 1.17 -0.02 0.00 -0.56 0.00 0.00 57.45 58.05 2dme n PHE 82 Cb 0.15 -1.23 -0.01 0.00 1.52 0.00 0.00 39.48 39.92 2dme n PHE 82 CO 0.00 0.00 0.00 -0.22 -0.56 0.00 0.00 176.76 175.98 2dme h LYS 83 N 0.00 -0.11 -0.79 3.97 3.64 -0.56 -2.28 116.57 120.43 2dme h LYS 83 Ca 0.59 0.01 0.31 0.00 -1.27 0.00 0.00 60.65 60.29 2dme h LYS 83 Cb 1.21 0.03 -0.12 0.00 -0.41 0.00 0.00 32.23 32.93 2dme h LYS 83 CO -0.91 -0.07 0.46 1.63 -2.27 0.00 0.00 179.45 178.28 2dme n LYS 84 N -2.54 -0.04 0.01 1.90 5.02 0.53 0.15 118.16 123.19 2dme n LYS 84 Ca -0.01 0.97 -0.13 0.00 -2.02 0.00 0.00 58.31 57.12 2dme n LYS 84 Cb 0.05 -1.78 -0.10 0.00 -0.02 0.00 0.00 35.03 33.18 2dme n LYS 84 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2dme h VAL 85 N 0.00 1.25 0.15 -0.18 2.07 -0.99 0.69 116.25 119.23 2dme h VAL 85 Ca 0.62 -1.22 -0.01 0.00 0.82 0.00 0.00 66.70 66.91 2dme h VAL 85 Cb 1.73 2.02 0.00 0.00 -1.52 0.00 0.00 31.29 33.52 2dme h VAL 85 CO -0.49 0.29 -0.07 -0.07 0.02 0.00 0.00 177.57 177.25 2dme h LEU 86 N -0.65 -0.17 -0.98 2.57 4.07 0.21 -2.85 115.31 117.51 2dme h LEU 86 Ca -0.01 -0.05 0.04 0.00 0.08 0.00 0.00 57.88 57.94 2dme h LEU 86 Cb 0.55 0.04 -0.06 0.00 1.08 0.00 0.00 40.66 42.27 2dme h LEU 86 CO 0.01 -0.05 0.64 0.50 -1.08 0.00 0.00 178.44 178.46 2dme h LYS 87 N -0.26 1.19 0.00 1.13 1.63 -0.54 -3.47 116.57 116.25 2dme h LYS 87 Ca -0.02 -0.07 0.00 0.00 -0.85 0.00 0.00 60.65 59.71 2dme h LYS 87 Cb 0.21 -0.27 0.00 0.00 -0.60 0.00 0.00 32.23 31.57 2dme h LYS 87 CO 0.03 0.78 0.00 0.41 -3.45 0.00 0.00 179.45 177.23 2dme n GLY 88 N -1.36 1.29 0.30 5.01 0.00 -0.55 -4.99 105.19 104.88 2dme n GLY 88 Ca 0.14 0.00 0.28 0.00 0.00 0.00 0.00 46.02 46.43 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 -4.75 1.61 1.02 0.21 -3.98 120.64 114.69 2dme n GLU 89 Ca 0.00 1.29 -0.31 0.00 -0.02 0.00 0.00 57.16 58.12 2dme n GLU 89 Cb 0.00 -2.28 -0.17 0.00 -0.02 0.00 0.00 31.44 28.97 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 -5.46 1.82 0.45 2.62 1.01 0.75 -4.94 120.40 116.64 2dme s VAL 90 Ca -0.09 -0.85 -0.17 0.00 0.00 0.00 0.00 61.98 60.87 2dme s VAL 90 Cb 0.31 -1.61 -0.09 0.00 0.00 0.00 0.00 36.38 34.99 2dme s VAL 90 CO 0.72 0.50 0.92 0.42 0.00 0.00 0.00 175.10 177.66 2dme s THR 91 N 0.72 4.53 -0.02 3.92 -4.23 -1.26 -4.15 115.64 115.16 2dme s THR 91 Ca -0.11 1.21 -0.26 0.00 -1.18 0.00 0.00 61.69 61.35 2dme s THR 91 Cb -0.16 -3.67 -0.20 0.00 1.34 0.00 0.00 72.50 69.81 2dme s THR 91 CO 0.02 -0.48 1.25 1.55 -0.54 0.00 0.00 174.62 176.42 2dme h PRO 92 N 1.46 -0.02 -0.02 3.99 0.13 -1.91 -0.67 132.00 134.96 2dme h PRO 92 Ca -0.48 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.66 2dme h PRO 92 Cb 1.18 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 2dme h PRO 92 CO 0.62 0.46 0.12 0.38 -0.23 0.00 0.00 178.00 179.35 2dme h ASP 93 N -0.51 0.00 0.23 1.44 3.04 -1.91 -1.08 116.42 117.63 2dme h ASP 93 Ca -0.00 0.00 -0.34 0.00 -3.24 0.00 0.00 57.03 53.45 2dme h ASP 93 Cb 0.49 0.00 -0.04 0.00 -1.04 0.00 0.00 39.33 38.74 2dme h ASP 93 CO 0.00 0.00 -2.01 1.57 -2.04 0.00 0.00 179.24 176.76 2dme n HIS 94 N -3.15 0.81 -0.38 4.15 -0.00 -1.15 -4.15 115.22 111.35 2dme n HIS 94 Ca -0.02 0.23 0.38 0.00 0.46 0.00 0.00 57.72 58.76 2dme n HIS 94 Cb 0.18 -1.13 0.66 0.00 -0.12 0.00 0.00 29.99 29.59 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 0.02 0.00 0.00 0.27 5.85 0.25 0.44 115.31 122.15 2dme h LEU 95 Ca -0.41 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.31 2dme h LEU 95 Cb 2.04 0.00 0.00 0.00 0.37 0.00 0.00 40.66 43.07 2dme h LEU 95 CO 0.05 0.00 -0.00 0.40 -0.34 0.00 0.00 178.44 178.55 2dme h ILE 96 N 0.00 1.68 -0.25 4.05 2.04 -1.72 -3.29 117.51 120.03 2dme h ILE 96 Ca 0.63 -2.21 0.07 0.00 1.00 0.00 0.00 64.86 64.35 2dme h ILE 96 Cb 2.94 3.15 -0.01 0.00 -0.74 0.00 0.00 36.82 42.16 2dme h ILE 96 CO -0.01 0.56 0.24 0.03 0.00 0.00 0.00 178.15 178.98 2dme h ARG 97 N -0.98 0.00 -6.93 2.37 3.08 -0.35 -3.43 114.38 108.15 2dme h ARG 97 Ca -0.00 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.49 2dme h ARG 97 Cb 0.92 0.00 0.15 0.00 0.08 0.00 0.00 29.97 31.12 2dme h ARG 97 CO 0.00 0.00 0.41 -1.33 -1.07 0.00 0.00 179.97 177.98 2dme n MET 98 N -3.92 1.43 -2.38 0.04 2.81 -0.50 -4.98 117.12 109.62 2dme n MET 98 Ca 0.03 0.53 -0.31 0.00 -1.81 0.00 0.00 57.70 56.14 2dme n MET 98 Cb 0.39 -2.39 -0.02 0.00 -0.71 0.00 0.00 33.22 30.48 2dme n MET 98 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 2dme s SER 99 N -0.98 6.51 0.00 7.83 1.04 -1.26 -4.93 113.70 121.90 2dme s SER 99 Ca 0.72 1.43 0.12 0.00 0.48 0.00 0.00 55.95 58.70 2dme s SER 99 Cb -0.44 -2.46 0.70 0.00 0.10 0.00 0.00 66.02 63.93 2dme s SER 99 CO 0.50 -0.61 1.13 -0.81 0.98 0.00 0.00 173.24 174.43 2dme n PRO 100 N -1.80 0.49 -0.10 4.02 -0.04 -1.26 -2.56 135.00 133.74 2dme n PRO 100 Ca 0.05 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.38 2dme n PRO 100 Cb 0.54 -1.38 -0.11 0.00 -0.04 0.00 0.00 33.50 32.51 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 -0.88 0.74 0.06 0.54 2.13 -1.26 -4.52 120.64 117.45 2dme n GLU 101 Ca 0.09 0.09 -0.10 0.00 0.66 0.00 0.00 57.16 57.89 2dme n GLU 101 Cb 0.04 -1.43 0.02 0.00 0.27 0.00 0.00 31.44 30.33 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 0.39 -0.99 5.31 5.08 -1.89 -3.14 114.58 119.34 2dme h GLU 102 Ca -0.48 -0.34 0.28 0.00 -1.00 0.00 0.00 59.36 57.83 2dme h GLU 102 Cb 1.83 0.08 -0.05 0.00 0.50 0.00 0.00 28.75 31.11 2dme h GLU 102 CO -0.05 0.99 0.70 -0.07 -1.00 0.00 0.00 179.01 179.58 2dme h LEU 103 N 0.26 0.07 0.00 1.33 3.38 -1.74 0.73 115.31 119.33 2dme h LEU 103 Ca -0.04 0.01 -0.14 0.00 0.09 0.00 0.00 57.88 57.80 2dme h LEU 103 Cb 1.35 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.08 2dme h LEU 103 CO 0.13 0.02 -0.66 0.00 0.09 0.00 0.00 178.44 178.02 2dme h ALA 104 N 1.52 0.58 -0.97 1.53 0.00 -1.79 -3.47 119.26 116.66 2dme h ALA 104 Ca 0.48 -0.60 -0.70 0.00 0.00 0.00 0.00 54.91 54.10 2dme h ALA 104 Cb 1.82 -0.10 0.08 0.00 0.00 0.00 0.00 17.79 19.59 2dme h ALA 104 CO -0.04 0.81 -0.28 0.45 0.00 0.00 0.00 179.25 180.20 2dme n SER 105 N -3.26 -0.71 -2.20 0.00 2.88 0.26 -4.89 113.62 105.70 2dme n SER 105 Ca 0.01 1.11 -0.10 0.00 -1.33 0.00 0.00 58.87 58.57 2dme n SER 105 Cb 0.80 -0.91 0.05 0.00 -0.75 0.00 0.00 64.21 63.39 2dme n SER 105 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2dme n LYS 106 N 1.18 2.41 -4.48 -1.46 5.02 -1.26 -4.90 118.16 114.67 2dme n LYS 106 Ca 0.18 -3.67 -0.23 0.00 -2.02 0.00 0.00 58.31 52.57 2dme n LYS 106 Cb 0.17 -1.78 -0.10 0.00 -0.02 0.00 0.00 35.03 33.30 2dme n LYS 106 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 2dme s GLU 107 N -3.39 1.67 -0.21 1.97 1.03 -1.26 -5.09 118.70 113.43 2dme s GLU 107 Ca 0.39 -1.85 -0.16 0.00 0.03 0.00 0.00 54.97 53.38 2dme s GLU 107 Cb 0.37 -1.43 -0.08 0.00 -0.80 0.00 0.00 34.13 32.19 2dme s GLU 107 CO -0.02 0.10 -0.33 1.28 -1.33 0.00 0.00 175.26 174.96 2dme n LEU 108 N -0.68 1.94 0.31 1.83 7.99 -1.26 -4.35 117.00 122.78 2dme n LEU 108 Ca -0.05 0.35 0.10 0.00 -0.01 0.00 0.00 56.01 56.40 2dme n LEU 108 Cb 0.63 -0.78 0.49 0.00 -0.11 0.00 0.00 43.42 43.65 2dme n LEU 108 CO 0.41 0.03 1.08 0.00 -1.51 0.00 0.00 177.39 177.41 2dme h ALA 109 N -0.99 1.66 -0.76 -1.18 0.00 -2.05 -0.47 119.26 115.48 2dme h ALA 109 Ca -0.26 -0.00 0.15 0.00 0.00 0.00 0.00 54.91 54.81 2dme h ALA 109 Cb 1.20 0.00 -0.10 0.00 0.00 0.00 0.00 17.79 18.89 2dme h ALA 109 CO -0.16 -0.64 0.28 0.00 0.00 0.00 0.00 179.25 178.73 2dme h ALA 110 N 0.80 1.07 -2.75 0.00 0.00 -2.01 -3.42 119.26 112.95 2dme h ALA 110 Ca 0.02 0.13 -0.55 0.00 0.00 0.00 0.00 54.91 54.52 2dme h ALA 110 Cb 1.26 0.13 0.18 0.00 0.00 0.00 0.00 17.79 19.36 2dme h ALA 110 CO -0.00 -0.26 0.34 0.91 0.00 0.00 0.00 179.25 180.24 2dme n TRP 111 N -5.05 1.34 -3.32 0.00 5.03 -0.19 -4.97 117.44 110.29 2dme n TRP 111 Ca 0.15 0.41 -0.39 0.00 3.03 0.00 0.00 57.50 60.70 2dme n TRP 111 Cb 0.45 -2.14 -0.08 0.00 -1.03 0.00 0.00 31.31 28.51 2dme n TRP 111 CO 0.00 0.00 0.00 1.03 -0.03 0.00 0.00 177.69 178.69 2dme s ARG 112 N -3.81 4.09 1.11 -0.99 1.81 -1.26 -5.06 118.95 114.84 2dme s ARG 112 Ca 0.76 0.23 -0.13 0.00 -1.72 0.00 0.00 55.73 54.87 2dme s ARG 112 Cb -0.32 -3.62 0.23 0.00 -0.45 0.00 0.00 34.95 30.80 2dme s ARG 112 CO 0.48 -0.23 0.94 0.54 -0.68 0.00 0.00 175.30 176.34 2dme n ARG 113 N 5.15 -1.88 -3.50 3.54 5.12 -1.26 -3.75 116.66 120.08 2dme n ARG 113 Ca -0.06 -0.51 -0.21 0.00 -1.93 0.00 0.00 57.85 55.14 2dme n ARG 113 Cb 0.50 -2.16 0.08 0.00 -1.16 0.00 0.00 32.46 29.72 2dme n ARG 113 CO 0.00 0.00 0.00 -2.13 -1.93 0.00 0.00 177.63 173.57 2dme n ARG 114 N -4.45 -7.27 -3.47 5.56 3.00 -1.26 -5.00 116.66 103.78 2dme n ARG 114 Ca 0.05 0.81 -0.03 0.00 -0.00 0.00 0.00 57.85 58.68 2dme n ARG 114 Cb 0.54 -5.77 -0.06 0.00 0.00 0.00 0.00 32.46 27.17 2dme n ARG 114 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 2dme s SER 115 N -3.67 -0.70 0.00 6.15 0.01 -1.25 -5.04 113.70 109.20 2dme s SER 115 Ca 0.37 0.99 0.00 0.00 1.31 0.00 0.00 55.95 58.61 2dme s SER 115 Cb -0.16 1.79 0.00 0.00 0.21 0.00 0.00 66.02 67.85 2dme s SER 115 CO 0.71 -0.25 0.00 0.61 0.41 0.00 0.00 173.24 174.72 2dme n GLY 116 N 5.41 -0.85 3.77 3.44 0.00 -1.26 -4.98 105.19 110.71 2dme n GLY 116 Ca -0.07 -0.33 -0.39 0.00 0.00 0.00 0.00 46.02 45.23 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 -0.64 4.15 -0.24 1.61 0.04 -1.26 -4.98 135.00 133.69 2dme s PRO 117 Ca 0.00 1.93 -0.11 0.00 0.04 0.00 0.00 61.00 62.87 2dme s PRO 117 Cb 0.00 -2.80 -0.16 0.00 0.04 0.00 0.00 34.50 31.57 2dme s PRO 117 CO 0.00 -0.26 -0.12 -1.13 0.04 0.00 0.00 177.00 175.52 2dme n SER 118 N 0.31 1.97 -4.28 6.66 3.41 -1.26 -4.74 113.62 115.70 2dme n SER 118 Ca 0.03 0.22 -0.44 0.00 -0.26 0.00 0.00 58.87 58.42 2dme n SER 118 Cb 0.45 -0.76 -0.03 0.00 -0.26 0.00 0.00 64.21 63.62 2dme n SER 118 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2dme s SER 119 N -7.08 6.63 0.00 4.04 1.04 -1.26 -5.25 113.70 111.82 2dme s SER 119 Ca -0.34 -3.10 0.00 0.00 0.48 0.00 0.00 55.95 52.99 2dme s SER 119 Cb 0.11 -2.13 0.00 0.00 0.10 0.00 0.00 66.02 64.10 2dme s SER 119 CO 0.57 -0.42 0.00 0.61 0.98 0.00 0.00 173.24 174.98