#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 6.55 0.82 1.61 0.15 -1.26 -5.06 113.70 116.52 2dme s SER 2 Ca 0.00 -3.29 -0.12 0.00 0.70 0.00 0.00 55.95 53.24 2dme s SER 2 Cb 0.00 -2.08 0.09 0.00 -1.71 0.00 0.00 66.02 62.32 2dme s SER 2 CO 0.00 -0.35 1.15 -0.94 1.20 0.00 0.00 173.24 174.30 2dme s SER 3 N 1.07 3.72 0.00 5.45 1.04 -1.26 -4.85 113.70 118.88 2dme s SER 3 Ca 0.25 2.13 0.00 0.00 0.48 0.00 0.00 55.95 58.81 2dme s SER 3 Cb -0.11 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.45 2dme s SER 3 CO -0.09 -2.57 0.00 0.61 0.98 0.00 0.00 173.24 172.17 2dme n GLY 4 N -0.14 -1.75 2.84 7.32 0.00 -1.26 -5.08 105.19 107.13 2dme n GLY 4 Ca 0.11 -1.26 -0.14 0.00 0.00 0.00 0.00 46.02 44.74 2dme n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dme s SER 5 N -1.46 0.12 -0.69 1.61 0.01 -1.26 -5.08 113.70 106.96 2dme s SER 5 Ca 0.00 0.00 -0.25 0.00 1.31 0.00 0.00 55.95 57.01 2dme s SER 5 Cb 0.00 -0.05 -0.12 0.00 0.21 0.00 0.00 66.02 66.05 2dme s SER 5 CO 0.00 -0.05 2.42 -1.20 0.41 0.00 0.00 173.24 174.82 2dme n SER 6 N 3.55 1.81 -4.75 2.44 7.64 -1.26 -4.90 113.62 118.15 2dme n SER 6 Ca -0.19 -1.01 -0.41 0.00 1.01 0.00 0.00 58.87 58.28 2dme n SER 6 Cb 0.55 -1.56 -0.04 0.00 -1.01 0.00 0.00 64.21 62.16 2dme n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2dme s GLY 7 N 10.90 2.89 0.26 0.23 0.00 -1.26 -5.05 107.32 115.29 2dme s GLY 7 Ca 0.98 0.90 0.10 0.00 0.00 0.00 0.00 44.72 46.70 2dme s GLY 7 CO 0.19 1.66 -0.04 -0.56 0.00 0.00 0.00 173.10 174.34 2dme s SER 8 N -0.37 4.39 0.16 1.64 0.01 -1.26 -5.04 113.70 113.22 2dme s SER 8 Ca 0.48 -0.68 -0.13 0.00 1.31 0.00 0.00 55.95 56.93 2dme s SER 8 Cb -0.32 -0.76 0.05 0.00 0.21 0.00 0.00 66.02 65.20 2dme s SER 8 CO 0.38 0.02 1.73 0.00 0.41 0.00 0.00 173.24 175.78 2dme h ALA 9 N 2.07 0.69 -0.68 1.44 0.00 -1.96 -2.77 119.26 118.05 2dme h ALA 9 Ca -0.44 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.31 2dme h ALA 9 Cb 1.24 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.79 2dme h ALA 9 CO 0.60 0.27 0.34 0.22 0.00 0.00 0.00 179.25 180.68 2dme h ASP 10 N 0.71 0.88 -0.08 0.00 3.58 -1.99 -2.07 116.42 117.44 2dme h ASP 10 Ca 0.18 -0.12 0.02 0.00 0.42 0.00 0.00 57.03 57.53 2dme h ASP 10 Cb 0.16 -0.23 -0.00 0.00 1.72 0.00 0.00 39.33 40.98 2dme h ASP 10 CO -0.02 0.75 0.06 1.56 -2.88 0.00 0.00 179.24 178.72 2dme h GLN 11 N 0.94 0.00 0.00 0.28 7.50 -1.92 -2.24 115.11 119.68 2dme h GLN 11 Ca 0.24 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.39 2dme h GLN 11 Cb 0.09 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.62 2dme h GLN 11 CO -0.03 0.00 0.00 -0.89 -1.50 0.00 0.00 178.83 176.41 2dme n ILE 12 N -4.35 0.00 -0.36 2.54 5.41 -0.78 -0.70 119.36 121.12 2dme n ILE 12 Ca -0.01 1.13 0.32 0.00 1.00 0.00 0.00 62.75 65.19 2dme n ILE 12 Cb 0.17 -2.06 0.66 0.00 -0.71 0.00 0.00 39.64 37.70 2dme n ILE 12 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 176.55 176.63 2dme h ARG 13 N 0.00 0.14 0.28 0.38 0.11 -1.54 -1.35 114.38 112.41 2dme h ARG 13 Ca 0.00 -0.01 -0.01 0.00 0.10 0.00 0.00 59.98 60.06 2dme h ARG 13 Cb 0.00 -0.03 0.00 0.00 1.11 0.00 0.00 29.97 31.05 2dme h ARG 13 CO 0.00 0.09 -0.14 0.37 0.10 0.00 0.00 179.97 180.40 2dme h GLN 14 N 0.14 -0.37 -1.17 0.08 4.15 -1.36 -3.18 115.11 113.40 2dme h GLN 14 Ca 0.63 0.03 0.34 0.00 0.77 0.00 0.00 58.65 60.41 2dme h GLN 14 Cb 2.13 0.08 -0.10 0.00 0.21 0.00 0.00 27.48 29.81 2dme h GLN 14 CO -0.16 -0.25 0.77 1.03 -1.93 0.00 0.00 178.83 178.29 2dme h SER 15 N -0.55 0.31 -0.02 -0.69 0.87 -0.12 -1.11 113.55 112.25 2dme h SER 15 Ca -0.04 0.09 0.02 0.00 -1.23 0.00 0.00 61.79 60.63 2dme h SER 15 Cb 0.29 0.05 -0.06 0.00 -0.44 0.00 0.00 62.40 62.24 2dme h SER 15 CO 0.06 -0.01 -0.54 0.58 -0.53 0.00 0.00 176.83 176.39 2dme h VAL 16 N 0.24 0.00 -0.39 2.23 2.07 -1.26 -2.80 116.25 116.33 2dme h VAL 16 Ca 0.67 0.00 0.04 0.00 0.82 0.00 0.00 66.70 68.22 2dme h VAL 16 Cb 1.99 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 31.72 2dme h VAL 16 CO -0.29 0.00 -0.23 0.54 0.02 0.00 0.00 177.57 177.61 2dme n ARG 17 N -5.46 -0.17 -0.36 1.57 1.74 -0.42 0.05 116.66 113.62 2dme n ARG 17 Ca -0.07 1.01 -0.00 0.00 -0.77 0.00 0.00 57.85 58.02 2dme n ARG 17 Cb 0.40 -1.50 0.05 0.00 -1.02 0.00 0.00 32.46 30.38 2dme n ARG 17 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 2dme n HIS 18 N -3.88 0.06 0.04 -1.55 8.25 -1.07 -1.43 115.22 115.65 2dme n HIS 18 Ca 0.01 1.15 -0.04 0.00 -0.26 0.00 0.00 57.72 58.57 2dme n HIS 18 Cb 0.10 -0.87 -0.03 0.00 1.12 0.00 0.00 29.99 30.32 2dme n HIS 18 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2dme h SER 19 N 0.00 -0.41 -0.94 0.41 0.87 -0.24 0.11 113.55 113.36 2dme h SER 19 Ca 0.34 0.04 0.28 0.00 -1.23 0.00 0.00 61.79 61.22 2dme h SER 19 Cb 0.57 0.14 -0.17 0.00 -0.44 0.00 0.00 62.40 62.50 2dme h SER 19 CO -0.93 -0.16 0.11 0.18 -0.53 0.00 0.00 176.83 175.50 2dme n LEU 20 N -3.20 -0.03 -0.16 2.23 4.77 -0.52 0.20 117.00 120.29 2dme n LEU 20 Ca -0.03 1.58 -0.08 0.00 -0.03 0.00 0.00 56.01 57.46 2dme n LEU 20 Cb 0.11 -0.61 0.07 0.00 -2.33 0.00 0.00 43.42 40.66 2dme n LEU 20 CO 0.05 -1.64 0.81 0.50 -1.33 0.00 0.00 177.39 175.78 2dme h LYS 21 N 0.00 0.95 -0.30 3.23 3.64 -0.65 -2.40 116.57 121.04 2dme h LYS 21 Ca 0.61 -0.31 0.06 0.00 -1.27 0.00 0.00 60.65 59.74 2dme h LYS 21 Cb 1.34 -0.08 -0.05 0.00 -0.41 0.00 0.00 32.23 33.03 2dme h LYS 21 CO -0.85 0.97 -0.06 0.22 -2.27 0.00 0.00 179.45 177.46 2dme h ASP 22 N 0.86 -0.25 0.73 4.20 3.58 0.50 0.53 116.42 126.57 2dme h ASP 22 Ca 0.15 0.09 -0.04 0.00 0.42 0.00 0.00 57.03 57.65 2dme h ASP 22 Cb 0.58 0.17 0.01 0.00 1.72 0.00 0.00 39.33 41.81 2dme h ASP 22 CO 0.04 -0.09 -0.35 0.40 -2.88 0.00 0.00 179.24 176.36 2dme h ILE 23 N 0.01 0.00 -0.57 2.25 2.04 -1.30 -2.67 117.51 117.28 2dme h ILE 23 Ca 0.14 -0.20 0.16 0.00 1.00 0.00 0.00 64.86 65.97 2dme h ILE 23 Cb 0.21 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 36.27 2dme h ILE 23 CO -0.29 0.00 0.45 -0.07 0.00 0.00 0.00 178.15 178.23 2dme h LEU 24 N -1.18 0.00 -1.05 1.44 3.38 -1.35 0.40 115.31 116.95 2dme h LEU 24 Ca -0.10 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.77 2dme h LEU 24 Cb 0.76 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 2dme h LEU 24 CO 0.17 0.00 -0.40 0.24 0.09 0.00 0.00 178.44 178.53 2dme h MET 25 N 0.00 0.14 0.04 1.13 2.86 0.24 -1.17 114.93 118.16 2dme h MET 25 Ca 0.27 -0.06 -0.33 0.00 -2.06 0.00 0.00 59.70 57.52 2dme h MET 25 Cb 1.16 -0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.77 2dme h MET 25 CO -0.00 0.52 -1.92 1.17 1.06 0.00 0.00 176.91 177.74 2dme n LYS 26 N -4.04 0.68 0.22 1.72 0.00 0.10 -2.89 118.16 113.95 2dme n LYS 26 Ca -0.02 0.24 0.09 0.00 0.00 0.00 0.00 58.31 58.63 2dme n LYS 26 Cb 0.46 -1.72 0.44 0.00 0.00 0.00 0.00 35.03 34.21 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 0.02 0.00 0.03 1.64 2.47 -0.46 -1.52 114.38 116.56 2dme h ARG 27 Ca -0.38 0.00 -0.32 0.00 -1.26 0.00 0.00 59.98 58.03 2dme h ARG 27 Cb 2.04 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 30.32 2dme h ARG 27 CO 0.07 0.26 -1.84 1.47 0.56 0.00 0.00 179.97 180.49 2dme n LEU 28 N -3.46 1.33 0.15 3.04 -0.00 -0.45 -3.03 117.00 114.58 2dme n LEU 28 Ca -0.00 0.33 0.02 0.00 -0.00 0.00 0.00 56.01 56.36 2dme n LEU 28 Cb 0.44 -0.17 0.18 0.00 -0.00 0.00 0.00 43.42 43.86 2dme n LEU 28 CO 0.34 0.53 0.54 0.00 -0.00 0.00 0.00 177.39 178.79 2dme h THR 29 N 0.02 1.04 0.13 1.47 1.03 -1.45 -3.23 112.91 111.92 2dme h THR 29 Ca -0.34 -2.01 -0.31 0.00 -0.01 0.00 0.00 66.41 63.74 2dme h THR 29 Cb 2.03 2.20 -0.00 0.00 -1.07 0.00 0.00 68.15 71.31 2dme h THR 29 CO 0.08 0.50 -1.55 -0.78 -0.01 0.00 0.00 175.52 173.76 2dme h ASP 30 N 0.00 0.44 -3.06 0.00 3.58 -1.42 -3.47 116.42 112.49 2dme h ASP 30 Ca -0.01 -0.60 -0.27 0.00 0.42 0.00 0.00 57.03 56.57 2dme h ASP 30 Cb 1.16 -0.14 0.12 0.00 1.72 0.00 0.00 39.33 42.18 2dme h ASP 30 CO 0.07 1.50 0.22 -1.54 -2.88 0.00 0.00 179.24 176.61 2dme n SER 31 N -3.48 -0.38 -1.90 2.28 3.41 -1.17 -4.92 113.62 107.45 2dme n SER 31 Ca -0.17 -1.21 -0.16 0.00 -0.26 0.00 0.00 58.87 57.07 2dme n SER 31 Cb 1.05 -0.65 0.03 0.00 -0.26 0.00 0.00 64.21 64.38 2dme n SER 31 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2dme n ASN 32 N -3.71 6.37 -4.70 4.04 4.13 -1.26 -4.89 115.26 115.23 2dme n ASN 32 Ca 0.10 -3.02 -0.35 0.00 1.68 0.00 0.00 54.58 53.00 2dme n ASN 32 Cb 0.37 -1.08 -0.08 0.00 -1.54 0.00 0.00 39.78 37.45 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 -1.68 4.10 -0.20 3.41 1.43 -1.25 -4.97 118.68 119.52 2dme s LEU 33 Ca 0.31 0.19 0.16 0.00 -1.03 0.00 0.00 54.13 53.75 2dme s LEU 33 Cb 0.23 -2.06 0.64 0.00 0.03 0.00 0.00 46.19 45.04 2dme s LEU 33 CO -0.02 0.18 1.55 0.29 0.23 0.00 0.00 176.35 178.58 2dme n LYS 34 N 3.53 3.64 -1.97 1.70 4.01 -1.26 -4.73 118.16 123.07 2dme n LYS 34 Ca -0.16 -2.97 -0.37 0.00 -0.51 0.00 0.00 58.31 54.30 2dme n LYS 34 Cb 0.52 -2.01 0.03 0.00 -0.51 0.00 0.00 35.03 33.07 2dme n LYS 34 CO 0.00 0.00 0.00 0.14 -1.11 0.00 0.00 177.40 176.43 2dme s VAL 35 N -2.82 2.52 0.93 -0.18 -7.23 -1.26 -5.01 120.40 107.35 2dme s VAL 35 Ca 0.47 0.34 -0.12 0.00 -1.81 0.00 0.00 61.98 60.87 2dme s VAL 35 Cb 0.37 -3.15 0.15 0.00 0.56 0.00 0.00 36.38 34.31 2dme s VAL 35 CO 0.11 -0.05 1.09 -2.16 -0.31 0.00 0.00 175.10 173.78 2dme s PRO 36 N -3.19 1.00 0.46 4.82 0.04 -1.26 -4.94 135.00 131.92 2dme s PRO 36 Ca 0.76 0.72 0.25 0.00 0.04 0.00 0.00 61.00 62.76 2dme s PRO 36 Cb -0.33 -1.79 1.03 0.00 0.04 0.00 0.00 34.50 33.45 2dme s PRO 36 CO 0.36 -2.40 1.88 1.49 0.04 0.00 0.00 177.00 178.37 2dme h GLU 37 N -1.66 0.00 -0.15 4.56 4.81 -2.03 -2.84 114.58 117.28 2dme h GLU 37 Ca -0.51 0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 58.60 2dme h GLU 37 Cb 1.30 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.67 2dme h GLU 37 CO 0.56 0.21 -0.42 1.49 -0.73 0.00 0.00 179.01 180.11 2dme h GLU 38 N 0.00 0.34 0.03 1.92 4.57 -2.00 -3.18 114.58 116.26 2dme h GLU 38 Ca -0.00 -0.17 0.00 0.00 -1.18 0.00 0.00 59.36 58.01 2dme h GLU 38 Cb 0.67 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.25 2dme h GLU 38 CO 0.03 0.71 -0.06 -0.22 -1.18 0.00 0.00 179.01 178.28 2dme h LYS 39 N 0.28 -0.10 -0.75 1.92 1.63 -1.87 0.21 116.57 117.90 2dme h LYS 39 Ca 0.02 0.01 0.14 0.00 -0.85 0.00 0.00 60.65 59.97 2dme h LYS 39 Cb 0.86 0.02 -0.14 0.00 -0.60 0.00 0.00 32.23 32.38 2dme h LYS 39 CO 0.07 -0.07 -0.23 0.00 -3.45 0.00 0.00 179.45 175.77 2dme h ALA 40 N -1.51 0.37 0.20 5.00 0.00 -1.70 -2.14 119.26 119.49 2dme h ALA 40 Ca -0.00 0.27 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 2dme h ALA 40 Cb 0.10 0.65 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 2dme h ALA 40 CO -0.03 -0.48 -0.20 0.00 0.00 0.00 0.00 179.25 178.54 2dme h ALA 41 N 1.58 -0.91 -0.76 0.00 0.00 -1.48 -0.81 119.26 116.88 2dme h ALA 41 Ca 0.34 -0.08 0.15 0.00 0.00 0.00 0.00 54.91 55.32 2dme h ALA 41 Cb 0.56 0.45 -0.14 0.00 0.00 0.00 0.00 17.79 18.66 2dme h ALA 41 CO -0.78 -0.93 -0.20 1.63 0.00 0.00 0.00 179.25 178.97 2dme n LYS 42 N -3.57 -0.08 0.46 0.00 5.02 0.73 -0.20 118.16 120.53 2dme n LYS 42 Ca -0.05 1.19 -0.19 0.00 -2.02 0.00 0.00 58.31 57.24 2dme n LYS 42 Cb 0.19 -1.78 -0.09 0.00 -0.02 0.00 0.00 35.03 33.33 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 0.07 -0.87 -0.18 2.07 -1.12 -2.47 116.25 113.75 2dme h VAL 43 Ca 0.36 -0.08 0.22 0.00 0.82 0.00 0.00 66.70 68.02 2dme h VAL 43 Cb 0.55 0.08 -0.13 0.00 -1.52 0.00 0.00 31.29 30.26 2dme h VAL 43 CO -0.78 0.00 0.30 0.00 0.02 0.00 0.00 177.57 177.11 2dme h ALA 44 N -1.19 1.32 0.00 1.67 0.00 0.91 0.89 119.26 122.86 2dme h ALA 44 Ca -0.12 0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 2dme h ALA 44 Cb 0.91 0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.93 2dme h ALA 44 CO 0.20 -0.40 -0.09 1.15 0.00 0.00 0.00 179.25 180.10 2dme h THR 45 N 0.30 0.74 0.06 0.00 2.02 -0.56 -2.89 112.91 112.58 2dme h THR 45 Ca 0.54 -0.37 -0.12 0.00 0.77 0.00 0.00 66.41 67.24 2dme h THR 45 Cb 1.06 1.22 0.00 0.00 -1.74 0.00 0.00 68.15 68.69 2dme h THR 45 CO -0.58 0.09 -0.55 0.11 0.37 0.00 0.00 175.52 174.96 2dme h LYS 46 N 0.00 0.13 -0.08 6.66 1.79 0.12 -3.32 116.57 121.86 2dme h LYS 46 Ca -0.00 -0.22 0.01 0.00 -2.18 0.00 0.00 60.65 58.26 2dme h LYS 46 Cb 0.21 0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 30.93 2dme h LYS 46 CO 0.01 1.11 -0.05 -0.89 -1.08 0.00 0.00 179.45 178.55 2dme n ILE 47 N -4.35 -0.06 -0.34 1.86 2.08 -0.05 0.81 119.36 119.31 2dme n ILE 47 Ca -0.15 1.35 0.18 0.00 0.56 0.00 0.00 62.75 64.69 2dme n ILE 47 Cb 0.66 -1.77 0.40 0.00 -0.75 0.00 0.00 39.64 38.17 2dme n ILE 47 CO 0.00 0.00 0.00 -0.33 0.56 0.00 0.00 176.55 176.78 2dme h GLU 48 N 0.00 0.49 -0.87 0.38 3.07 -1.75 0.53 114.58 116.43 2dme h GLU 48 Ca 0.01 -0.03 0.08 0.00 -0.50 0.00 0.00 59.36 58.93 2dme h GLU 48 Cb 0.03 -0.11 -0.06 0.00 -0.84 0.00 0.00 28.75 27.77 2dme h GLU 48 CO -0.08 0.33 0.57 -0.22 -1.40 0.00 0.00 179.01 178.20 2dme h LYS 49 N 0.51 0.89 0.18 2.33 3.64 0.30 0.47 116.57 124.89 2dme h LYS 49 Ca 0.66 -0.05 -0.30 0.00 -1.27 0.00 0.00 60.65 59.68 2dme h LYS 49 Cb 1.30 -0.20 0.02 0.00 -0.41 0.00 0.00 32.23 32.94 2dme h LYS 49 CO -0.51 0.59 -1.44 0.93 -2.27 0.00 0.00 179.45 176.75 2dme h GLU 50 N 0.92 0.38 0.71 1.90 4.39 0.14 -2.93 114.58 120.08 2dme h GLU 50 Ca 0.39 -0.65 -0.03 0.00 0.34 0.00 0.00 59.36 59.40 2dme h GLU 50 Cb 0.32 0.24 0.01 0.00 -0.10 0.00 0.00 28.75 29.22 2dme h GLU 50 CO -0.16 1.31 -0.34 1.25 -1.16 0.00 0.00 179.01 179.92 2dme h LEU 51 N -0.07 -0.81 -1.74 1.33 5.85 -0.22 0.22 115.31 119.87 2dme h LEU 51 Ca -0.28 0.03 0.09 0.00 0.84 0.00 0.00 57.88 58.56 2dme h LEU 51 Cb 1.96 0.21 -0.03 0.00 0.37 0.00 0.00 40.66 43.17 2dme h LEU 51 CO 0.17 -0.48 0.33 0.15 -0.34 0.00 0.00 178.44 178.28 2dme h PHE 52 N -1.15 0.31 0.00 1.25 3.57 -0.27 0.14 116.94 120.79 2dme h PHE 52 Ca -0.10 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.36 2dme h PHE 52 Cb 0.73 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.36 2dme h PHE 52 CO 0.02 0.15 -0.25 1.03 -2.23 0.00 0.00 178.31 177.04 2dme h SER 53 N 0.30 0.00 0.11 0.41 0.87 -1.42 0.40 113.55 114.22 2dme h SER 53 Ca 0.22 0.00 -0.16 0.00 -1.23 0.00 0.00 61.79 60.62 2dme h SER 53 Cb 0.50 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.47 2dme h SER 53 CO -0.05 0.25 -0.73 0.15 -0.53 0.00 0.00 176.83 175.91 2dme h PHE 54 N 0.00 0.41 0.00 2.24 3.57 0.20 -3.34 116.94 120.02 2dme h PHE 54 Ca -0.00 -0.30 0.00 0.00 3.53 0.00 0.00 57.97 61.20 2dme h PHE 54 Cb 1.11 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.84 2dme h PHE 54 CO 0.00 1.28 -0.90 0.74 -2.23 0.00 0.00 178.31 177.20 2dme h PHE 55 N -0.51 0.00 -2.82 0.41 0.04 -1.19 -3.48 116.94 109.40 2dme h PHE 55 Ca -0.14 0.00 -0.31 0.00 2.80 0.00 0.00 57.97 60.32 2dme h PHE 55 Cb 1.52 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 39.62 2dme h PHE 55 CO 0.20 0.00 -0.36 -2.13 -0.60 0.00 0.00 178.31 175.42 2dme n ARG 56 N -2.67 -1.81 -3.63 1.51 0.63 0.14 -4.89 116.66 105.93 2dme n ARG 56 Ca 0.01 0.80 -0.06 0.00 -0.92 0.00 0.00 57.85 57.67 2dme n ARG 56 Cb 0.54 -5.31 -0.06 0.00 0.45 0.00 0.00 32.46 28.07 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 -2.12 -0.24 -0.92 6.15 -1.08 -1.24 -5.04 116.67 112.18 2dme s ASP 57 Ca 0.00 0.41 -0.04 0.00 -0.52 0.00 0.00 52.55 52.40 2dme s ASP 57 Cb 0.00 0.40 0.17 0.00 -1.46 0.00 0.00 42.92 42.02 2dme s ASP 57 CO 0.00 -0.12 2.37 0.35 0.52 0.00 0.00 175.17 178.29 2dme n THR 58 N 1.52 4.54 -2.88 1.71 -2.24 -1.26 -4.58 114.28 111.09 2dme n THR 58 Ca -0.10 -4.18 -0.11 0.00 -2.27 0.00 0.00 64.05 57.40 2dme n THR 58 Cb 0.57 -1.71 0.04 0.00 -2.10 0.00 0.00 70.33 67.14 2dme n THR 58 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2dme n ASP 59 N 0.81 1.02 -0.32 3.42 2.03 -1.26 -4.87 116.55 117.38 2dme n ASP 59 Ca 0.54 -1.77 0.04 0.00 0.52 0.00 0.00 54.79 54.13 2dme n ASP 59 Cb 0.35 -0.25 0.19 0.00 -0.72 0.00 0.00 41.12 40.68 2dme n ASP 59 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2dme h ALA 60 N 0.09 1.30 -0.00 -1.67 0.00 -1.99 0.19 119.26 117.18 2dme h ALA 60 Ca -0.15 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2dme h ALA 60 Cb 0.66 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 2dme h ALA 60 CO 0.20 0.16 0.00 1.57 0.00 0.00 0.00 179.25 181.18 2dme h LYS 61 N 0.88 0.00 0.04 0.00 2.10 -1.94 -0.43 116.57 117.22 2dme h LYS 61 Ca 0.43 0.00 -0.31 0.00 -2.00 0.00 0.00 60.65 58.78 2dme h LYS 61 Cb 0.39 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 31.69 2dme h LYS 61 CO -0.25 0.00 -1.69 0.98 -2.00 0.00 0.00 179.45 176.49 2dme n TYR 62 N -3.09 0.96 -0.01 0.07 4.19 0.56 -4.05 117.16 115.80 2dme n TYR 62 Ca -0.03 0.32 -0.11 0.00 3.31 0.00 0.00 57.90 61.39 2dme n TYR 62 Cb 0.07 -1.11 -0.05 0.00 0.49 0.00 0.00 39.34 38.74 2dme n TYR 62 CO 0.00 0.00 0.00 0.87 0.91 0.00 0.00 176.86 178.64 2dme h LYS 63 N -0.59 0.14 -0.74 2.98 1.57 -0.80 -1.99 116.57 117.14 2dme h LYS 63 Ca -0.42 -0.01 0.17 0.00 -1.87 0.00 0.00 60.65 58.51 2dme h LYS 63 Cb 1.61 -0.03 -0.13 0.00 0.08 0.00 0.00 32.23 33.76 2dme h LYS 63 CO -0.12 0.14 0.02 -0.97 -0.57 0.00 0.00 179.45 177.95 2dme h ASN 64 N 0.10 -0.31 -0.65 0.86 -0.73 -1.30 0.17 115.58 113.73 2dme h ASN 64 Ca 0.04 0.19 -0.09 0.00 1.87 0.00 0.00 56.30 58.31 2dme h ASN 64 Cb 0.04 0.32 -0.02 0.00 0.27 0.00 0.00 38.32 38.92 2dme h ASN 64 CO -0.01 -0.16 0.07 0.50 -0.37 0.00 0.00 177.43 177.46 2dme h LYS 65 N 0.12 1.11 0.38 6.67 1.63 -1.64 -2.33 116.57 122.51 2dme h LYS 65 Ca 0.40 -0.32 -0.02 0.00 -0.85 0.00 0.00 60.65 59.87 2dme h LYS 65 Cb 0.70 -0.12 -0.01 0.00 -0.60 0.00 0.00 32.23 32.21 2dme h LYS 65 CO -0.63 1.03 -0.28 -0.92 -3.45 0.00 0.00 179.45 175.20 2dme h TYR 66 N 1.03 -0.75 -0.93 1.91 3.20 0.05 -1.06 116.97 120.41 2dme h TYR 66 Ca 0.19 -0.00 0.20 0.00 3.14 0.00 0.00 58.73 62.27 2dme h TYR 66 Cb 0.49 0.28 -0.07 0.00 1.54 0.00 0.00 36.73 38.96 2dme h TYR 66 CO 0.04 -0.40 0.61 0.07 -1.64 0.00 0.00 178.16 176.84 2dme h ARG 67 N -0.63 0.45 -0.45 1.82 0.11 -1.25 0.21 114.38 114.63 2dme h ARG 67 Ca -0.05 -0.03 -0.05 0.00 0.10 0.00 0.00 59.98 59.95 2dme h ARG 67 Cb 0.52 -0.10 -0.02 0.00 1.11 0.00 0.00 29.97 31.48 2dme h ARG 67 CO 0.02 0.30 0.07 1.03 0.10 0.00 0.00 179.97 181.50 2dme h SER 68 N 0.46 0.65 0.11 0.08 0.87 -1.00 0.48 113.55 115.21 2dme h SER 68 Ca 0.49 -0.12 -0.01 0.00 -1.23 0.00 0.00 61.79 60.93 2dme h SER 68 Cb 1.15 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 62.94 2dme h SER 68 CO -0.21 0.67 -0.05 -0.07 -0.53 0.00 0.00 176.83 176.64 2dme h LEU 69 N 0.67 -0.13 -0.65 2.23 3.38 0.72 -2.96 115.31 118.57 2dme h LEU 69 Ca 0.15 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.89 2dme h LEU 69 Cb 0.31 0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.09 2dme h LEU 69 CO 0.00 0.16 0.00 0.00 0.09 0.00 0.00 178.44 178.69 2dme h MET 70 N -0.42 0.00 -0.23 1.13 -0.00 -1.35 -3.13 114.93 110.92 2dme h MET 70 Ca -0.02 0.00 0.01 0.00 -0.00 0.00 0.00 59.70 59.69 2dme h MET 70 Cb 0.34 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 31.93 2dme h MET 70 CO 0.03 0.00 0.16 0.35 -0.00 0.00 0.00 176.91 177.44 2dme h PHE 71 N 0.00 0.28 -0.00 -0.10 3.04 0.14 0.12 116.94 120.42 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 0.74 -0.10 0.00 0.00 2.56 0.00 0.00 35.95 39.15 2dme h PHE 71 CO 0.00 0.18 -0.41 0.09 -2.02 0.00 0.00 178.31 176.14 2dme n ASN 72 N -4.50 0.87 -0.06 0.41 3.02 -1.18 -2.67 115.26 111.14 2dme n ASN 72 Ca 0.01 -0.67 -0.13 0.00 -0.03 0.00 0.00 54.58 53.75 2dme n ASN 72 Cb 0.08 0.25 -0.14 0.00 -0.61 0.00 0.00 39.78 39.36 2dme n ASN 72 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2dme n LEU 73 N -1.01 1.33 0.06 3.41 4.77 -0.09 -4.33 117.00 121.14 2dme n LEU 73 Ca 0.09 0.14 0.03 0.00 -0.03 0.00 0.00 56.01 56.24 2dme n LEU 73 Cb 0.35 -0.17 -0.05 0.00 -2.33 0.00 0.00 43.42 41.21 2dme n LEU 73 CO 0.31 0.62 -0.17 0.07 -1.33 0.00 0.00 177.39 176.88 2dme h LYS 74 N 0.01 0.00 -6.83 3.23 2.10 -0.99 -3.46 116.57 110.63 2dme h LYS 74 Ca -0.45 0.00 -0.53 0.00 -2.00 0.00 0.00 60.65 57.67 2dme h LYS 74 Cb 2.07 0.00 0.09 0.00 -0.90 0.00 0.00 32.23 33.49 2dme h LYS 74 CO 0.03 0.21 0.87 -0.51 -2.00 0.00 0.00 179.45 178.06 2dme s ASP 75 N -5.70 6.36 0.33 7.07 1.11 -1.09 -4.91 116.67 119.85 2dme s ASP 75 Ca -0.02 2.97 0.12 0.00 0.18 0.00 0.00 52.55 55.80 2dme s ASP 75 Cb 0.09 -2.64 0.56 0.00 1.07 0.00 0.00 42.92 41.99 2dme s ASP 75 CO 0.80 -0.91 1.73 1.55 1.18 0.00 0.00 175.17 179.52 2dme h PRO 76 N 4.51 0.00 0.00 8.23 0.13 -1.91 -2.58 132.00 140.38 2dme h PRO 76 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2dme h PRO 76 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2dme h PRO 76 CO 0.77 0.48 0.00 0.36 -0.23 0.00 0.00 178.00 179.38 2dme n LYS 77 N -3.95 0.55 -3.81 0.86 0.00 -1.26 -4.50 118.16 106.05 2dme n LYS 77 Ca -0.02 0.03 -0.28 0.00 -0.00 0.00 0.00 58.31 58.05 2dme n LYS 77 Cb 0.50 -1.50 -0.16 0.00 -0.00 0.00 0.00 35.03 33.87 2dme n LYS 77 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.40 178.61 2dme s ASN 78 N -2.20 2.86 -0.08 -5.58 3.84 -0.97 -4.97 114.94 107.83 2dme s ASN 78 Ca 0.28 -0.74 0.13 0.00 0.21 0.00 0.00 52.86 52.75 2dme s ASN 78 Cb 0.15 -0.75 0.26 0.00 -0.55 0.00 0.00 41.25 40.36 2dme s ASN 78 CO 0.28 -0.25 1.13 0.59 -2.79 0.00 0.00 177.10 176.06 2dme n ASN 79 N 4.96 1.22 -0.02 -4.21 4.13 -1.26 -4.62 115.26 115.46 2dme n ASN 79 Ca -0.10 -2.69 -0.06 0.00 1.68 0.00 0.00 54.58 53.41 2dme n ASN 79 Cb 0.47 -0.35 -0.02 0.00 -1.54 0.00 0.00 39.78 38.34 2dme n ASN 79 CO 0.00 0.00 0.00 -0.38 0.28 0.00 0.00 177.26 177.16 2dme n ILE 80 N -0.51 0.73 -0.33 2.41 5.41 -1.26 -4.56 119.36 121.26 2dme n ILE 80 Ca 0.10 0.07 -0.09 0.00 1.00 0.00 0.00 62.75 63.83 2dme n ILE 80 Cb 0.78 -1.67 -0.08 0.00 -0.71 0.00 0.00 39.64 37.97 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 -3.48 -0.83 -0.20 1.39 7.94 -1.26 0.24 117.00 120.80 2dme n LEU 81 Ca -0.10 1.44 0.20 0.00 -1.11 0.00 0.00 56.01 56.44 2dme n LEU 81 Cb 0.42 -0.21 0.56 0.00 0.53 0.00 0.00 43.42 44.73 2dme n LEU 81 CO 0.02 -1.16 1.22 2.19 -1.11 0.00 0.00 177.39 178.56 2dme h PHE 82 N 0.00 0.41 -0.09 1.96 -5.15 -1.86 0.24 116.94 112.45 2dme h PHE 82 Ca 0.12 0.01 -0.23 0.00 -0.20 0.00 0.00 57.97 57.67 2dme h PHE 82 Cb 0.32 -0.13 0.01 0.00 0.22 0.00 0.00 35.95 36.37 2dme h PHE 82 CO -0.85 0.12 -0.86 0.87 -2.00 0.00 0.00 178.31 175.58 2dme h LYS 83 N 0.32 0.71 -0.20 6.09 1.57 0.28 -2.68 116.57 122.65 2dme h LYS 83 Ca 0.43 -0.64 -0.14 0.00 -1.87 0.00 0.00 60.65 58.43 2dme h LYS 83 Cb 1.20 0.15 -0.01 0.00 0.08 0.00 0.00 32.23 33.65 2dme h LYS 83 CO -0.13 1.24 -0.48 0.87 -0.57 0.00 0.00 179.45 180.38 2dme h LYS 84 N 0.45 0.52 -0.32 3.15 1.57 0.20 0.23 116.57 122.38 2dme h LYS 84 Ca -0.08 -0.30 -0.11 0.00 -1.87 0.00 0.00 60.65 58.29 2dme h LYS 84 Cb 1.50 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.81 2dme h LYS 84 CO 0.17 0.89 -0.27 0.28 -0.57 0.00 0.00 179.45 179.95 2dme h VAL 85 N 0.42 1.27 0.01 0.50 2.07 -0.66 0.34 116.25 120.20 2dme h VAL 85 Ca 0.02 -1.36 -0.07 0.00 0.82 0.00 0.00 66.70 66.11 2dme h VAL 85 Cb 1.00 1.32 -0.01 0.00 -1.52 0.00 0.00 31.29 32.08 2dme h VAL 85 CO 0.09 0.44 -0.35 -0.07 0.02 0.00 0.00 177.57 177.71 2dme h LEU 86 N 0.56 0.03 -0.48 2.57 4.07 -1.38 -3.36 115.31 117.32 2dme h LEU 86 Ca 0.07 -0.89 0.02 0.00 0.08 0.00 0.00 57.88 57.17 2dme h LEU 86 Cb 0.75 -0.01 -0.03 0.00 1.08 0.00 0.00 40.66 42.45 2dme h LEU 86 CO 0.06 1.14 0.29 0.11 -1.08 0.00 0.00 178.44 178.96 2dme h LYS 87 N -0.96 0.57 0.00 1.13 1.79 -0.61 -3.47 116.57 115.03 2dme h LYS 87 Ca -0.09 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.35 2dme h LYS 87 Cb 1.11 -0.13 0.00 0.00 -1.58 0.00 0.00 32.23 31.63 2dme h LYS 87 CO -0.04 0.38 0.00 0.41 -1.08 0.00 0.00 179.45 179.12 2dme n GLY 88 N -1.23 1.44 0.51 3.86 0.00 -0.01 -4.97 105.19 104.79 2dme n GLY 88 Ca 0.03 0.00 0.28 0.00 0.00 0.00 0.00 46.02 46.33 2dme n GLY 88 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2dme h GLU 89 N 0.00 0.00 -5.65 1.61 5.08 -1.65 -3.37 114.58 110.60 2dme h GLU 89 Ca 0.00 0.00 -0.54 0.00 -1.00 0.00 0.00 59.36 57.82 2dme h GLU 89 Cb 0.00 0.00 -0.29 0.00 0.50 0.00 0.00 28.75 28.96 2dme h GLU 89 CO 0.00 0.00 -0.83 0.08 -1.00 0.00 0.00 179.01 177.26 2dme s VAL 90 N -4.52 1.37 0.15 3.13 1.01 -0.49 -4.99 120.40 116.05 2dme s VAL 90 Ca -0.03 -0.76 -0.08 0.00 0.00 0.00 0.00 61.98 61.11 2dme s VAL 90 Cb 0.15 -1.14 -0.06 0.00 0.00 0.00 0.00 36.38 35.33 2dme s VAL 90 CO 0.52 0.37 0.44 0.42 0.00 0.00 0.00 175.10 176.85 2dme s THR 91 N -0.43 5.07 -1.46 3.92 -4.23 -1.26 -4.45 115.64 112.81 2dme s THR 91 Ca 0.07 0.28 0.15 0.00 -1.18 0.00 0.00 61.69 61.00 2dme s THR 91 Cb -0.07 -3.63 0.27 0.00 1.34 0.00 0.00 72.50 70.41 2dme s THR 91 CO -0.01 0.07 1.40 -0.81 -0.54 0.00 0.00 174.62 174.74 2dme n PRO 92 N 0.24 0.22 -0.01 3.99 -0.04 -1.26 -1.26 135.00 136.89 2dme n PRO 92 Ca -0.03 0.14 0.08 0.00 -0.04 0.00 0.00 63.50 63.65 2dme n PRO 92 Cb 0.52 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.36 2dme n PRO 92 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2dme n ASP 93 N -1.27 1.10 -0.10 3.54 2.03 -1.26 -4.42 116.55 116.16 2dme n ASP 93 Ca 0.07 -0.22 -0.12 0.00 0.52 0.00 0.00 54.79 55.05 2dme n ASP 93 Cb 0.11 1.57 -0.15 0.00 -0.72 0.00 0.00 41.12 41.94 2dme n ASP 93 CO 0.00 0.00 0.00 1.57 -1.92 0.00 0.00 177.20 176.85 2dme n HIS 94 N -1.91 0.09 -0.21 -0.67 -0.00 -0.88 -4.31 115.22 107.34 2dme n HIS 94 Ca -0.02 0.03 0.31 0.00 0.46 0.00 0.00 57.72 58.50 2dme n HIS 94 Cb 0.39 -1.01 0.69 0.00 -0.12 0.00 0.00 29.99 29.93 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 0.00 0.00 0.09 0.27 5.85 -1.41 0.61 115.31 120.72 2dme h LEU 95 Ca -0.54 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.18 2dme h LEU 95 Cb 2.15 0.00 0.00 0.00 0.37 0.00 0.00 40.66 43.18 2dme h LEU 95 CO 0.00 0.00 -0.04 0.40 -0.34 0.00 0.00 178.44 178.46 2dme h ILE 96 N 0.00 1.07 -0.24 4.05 2.04 -1.83 -3.21 117.51 119.40 2dme h ILE 96 Ca 0.48 -1.42 0.07 0.00 1.00 0.00 0.00 64.86 64.98 2dme h ILE 96 Cb 2.20 1.87 -0.01 0.00 -0.74 0.00 0.00 36.82 40.14 2dme h ILE 96 CO -0.01 0.30 0.34 0.03 0.00 0.00 0.00 178.15 178.82 2dme h ARG 97 N -0.86 0.00 -6.63 2.37 3.08 -1.11 -3.42 114.38 107.80 2dme h ARG 97 Ca -0.01 0.00 -0.58 0.00 0.07 0.00 0.00 59.98 59.45 2dme h ARG 97 Cb 0.59 0.00 0.11 0.00 0.08 0.00 0.00 29.97 30.75 2dme h ARG 97 CO 0.02 0.00 0.31 -1.33 -1.07 0.00 0.00 179.97 177.89 2dme n MET 98 N -3.49 1.70 -2.28 0.04 2.81 -0.81 -4.96 117.12 110.13 2dme n MET 98 Ca 0.03 0.60 -0.31 0.00 -1.81 0.00 0.00 57.70 56.20 2dme n MET 98 Cb 0.47 -2.10 -0.02 0.00 -0.71 0.00 0.00 33.22 30.86 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 -0.48 6.49 0.00 7.83 0.01 -1.26 -4.92 113.70 121.36 2dme s SER 99 Ca 0.58 1.47 0.15 0.00 1.31 0.00 0.00 55.95 59.46 2dme s SER 99 Cb -0.62 -2.47 0.86 0.00 0.21 0.00 0.00 66.02 64.00 2dme s SER 99 CO 0.60 -0.66 1.36 -0.81 0.41 0.00 0.00 173.24 174.15 2dme n PRO 100 N -1.93 0.39 -0.08 12.44 -0.04 -1.26 -2.06 135.00 142.46 2dme n PRO 100 Ca 0.06 0.05 -0.09 0.00 -0.04 0.00 0.00 63.50 63.48 2dme n PRO 100 Cb 0.54 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.38 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 -1.10 1.23 0.07 0.54 4.07 -1.26 -4.55 120.64 119.64 2dme n GLU 101 Ca 0.10 0.01 -0.22 0.00 -0.06 0.00 0.00 57.16 56.99 2dme n GLU 101 Cb 0.08 -1.42 -0.15 0.00 -0.06 0.00 0.00 31.44 29.89 2dme n GLU 101 CO 0.00 0.00 0.00 0.93 -0.06 0.00 0.00 177.13 178.00 2dme h GLU 102 N 0.00 0.36 -0.97 5.31 4.39 -1.87 -3.05 114.58 118.75 2dme h GLU 102 Ca -0.45 -0.61 0.32 0.00 0.34 0.00 0.00 59.36 58.96 2dme h GLU 102 Cb 1.96 0.23 -0.16 0.00 -0.10 0.00 0.00 28.75 30.68 2dme h GLU 102 CO 0.01 1.29 0.37 -0.07 -1.16 0.00 0.00 179.01 179.46 2dme h LEU 103 N -0.21 0.14 0.07 1.33 3.38 -1.66 0.13 115.31 118.49 2dme h LEU 103 Ca -0.20 0.23 -0.15 0.00 0.09 0.00 0.00 57.88 57.85 2dme h LEU 103 Cb 1.81 0.27 0.02 0.00 0.09 0.00 0.00 40.66 42.85 2dme h LEU 103 CO 0.17 -0.27 -0.64 0.00 0.09 0.00 0.00 178.44 177.80 2dme h ALA 104 N 1.90 -0.02 -1.26 1.53 0.00 -1.80 -3.45 119.26 116.16 2dme h ALA 104 Ca 0.69 -0.62 -0.47 0.00 0.00 0.00 0.00 54.91 54.51 2dme h ALA 104 Cb 1.60 0.06 0.12 0.00 0.00 0.00 0.00 17.79 19.57 2dme h ALA 104 CO -0.72 0.32 -0.71 0.45 0.00 0.00 0.00 179.25 178.58 2dme n SER 105 N -4.22 -2.15 -2.38 0.00 2.88 0.46 -4.83 113.62 103.37 2dme n SER 105 Ca -0.12 0.62 -0.25 0.00 -1.33 0.00 0.00 58.87 57.79 2dme n SER 105 Cb 0.72 -0.67 0.01 0.00 -0.75 0.00 0.00 64.21 63.52 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 1.01 3.32 -3.94 -1.46 5.02 -1.26 -5.00 118.16 115.85 2dme n LYS 106 Ca 0.09 -4.34 -0.32 0.00 -2.02 0.00 0.00 58.31 51.71 2dme n LYS 106 Cb 0.30 -2.19 -0.05 0.00 -0.02 0.00 0.00 35.03 33.07 2dme n LYS 106 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2dme s GLU 107 N -3.54 3.37 -0.21 1.97 2.02 -1.26 -5.03 118.70 116.02 2dme s GLU 107 Ca 0.47 -0.39 -0.05 0.00 0.02 0.00 0.00 54.97 55.02 2dme s GLU 107 Cb 0.40 -3.04 -0.19 0.00 0.10 0.00 0.00 34.13 31.40 2dme s GLU 107 CO -0.12 0.65 -0.02 1.28 0.02 0.00 0.00 175.26 177.07 2dme n LEU 108 N 0.77 2.66 0.20 1.80 7.99 -1.26 -4.21 117.00 124.94 2dme n LEU 108 Ca -0.09 0.07 0.18 0.00 -0.01 0.00 0.00 56.01 56.16 2dme n LEU 108 Cb 0.52 -0.97 0.74 0.00 -0.11 0.00 0.00 43.42 43.60 2dme n LEU 108 CO 0.45 0.82 1.15 0.00 -1.51 0.00 0.00 177.39 178.31 2dme h ALA 109 N -0.14 1.80 -0.75 -1.18 0.00 -2.00 -2.40 119.26 114.59 2dme h ALA 109 Ca -0.53 -0.01 0.12 0.00 0.00 0.00 0.00 54.91 54.50 2dme h ALA 109 Cb 1.86 0.02 -0.13 0.00 0.00 0.00 0.00 17.79 19.54 2dme h ALA 109 CO -0.08 -0.56 -0.35 0.00 0.00 0.00 0.00 179.25 178.25 2dme h ALA 110 N 1.34 0.04 -2.65 0.00 0.00 -2.01 -3.40 119.26 112.57 2dme h ALA 110 Ca 0.11 0.21 -0.52 0.00 0.00 0.00 0.00 54.91 54.72 2dme h ALA 110 Cb 1.00 0.87 0.10 0.00 0.00 0.00 0.00 17.79 19.76 2dme h ALA 110 CO -0.00 -0.65 0.43 -1.58 0.00 0.00 0.00 179.25 177.44 2dme s TRP 111 N -5.98 2.48 0.35 0.00 0.23 -0.91 -4.96 118.94 110.16 2dme s TRP 111 Ca -0.14 1.54 -0.29 0.00 -2.03 0.00 0.00 56.10 55.19 2dme s TRP 111 Cb 0.18 -3.35 -0.11 0.00 0.03 0.00 0.00 33.47 30.22 2dme s TRP 111 CO 0.70 -1.95 1.42 1.03 0.96 0.00 0.00 176.95 179.11 2dme s ARG 112 N -3.57 4.22 -0.41 4.98 1.81 -1.26 -4.93 118.95 119.78 2dme s ARG 112 Ca 0.73 2.41 0.05 0.00 -1.72 0.00 0.00 55.73 57.20 2dme s ARG 112 Cb -0.26 -3.02 0.50 0.00 -0.45 0.00 0.00 34.95 31.72 2dme s ARG 112 CO 0.35 -0.39 1.59 0.54 -0.68 0.00 0.00 175.30 176.71 2dme n ARG 113 N 0.80 2.60 0.21 3.54 5.12 -1.26 -4.72 116.66 122.95 2dme n ARG 113 Ca 0.01 -3.48 -0.13 0.00 -1.93 0.00 0.00 57.85 52.33 2dme n ARG 113 Cb 0.40 -2.11 -0.07 0.00 -1.16 0.00 0.00 32.46 29.52 2dme n ARG 113 CO 0.00 0.00 0.00 -0.09 -1.93 0.00 0.00 177.63 175.61 2dme h ARG 114 N 1.60 -0.55 -3.78 5.56 9.65 -2.02 -3.41 114.38 121.43 2dme h ARG 114 Ca 0.41 0.04 -0.59 0.00 -1.10 0.00 0.00 59.98 58.74 2dme h ARG 114 Cb 1.52 0.13 -0.40 0.00 -1.39 0.00 0.00 29.97 29.82 2dme h ARG 114 CO 0.90 -0.24 -0.75 -1.54 2.80 0.00 0.00 179.97 181.14 2dme s SER 115 N -4.91 4.09 0.53 -3.80 1.04 -1.26 -5.12 113.70 104.27 2dme s SER 115 Ca -0.13 -1.66 -0.21 0.00 0.48 0.00 0.00 55.95 54.42 2dme s SER 115 Cb 0.02 -0.99 -0.05 0.00 0.10 0.00 0.00 66.02 65.09 2dme s SER 115 CO 0.47 -0.40 1.27 -0.83 0.98 0.00 0.00 173.24 174.73 2dme s GLY 116 N 1.50 2.83 1.24 7.32 0.00 -1.26 -5.02 107.32 113.93 2dme s GLY 116 Ca 0.09 1.14 -0.20 0.00 0.00 0.00 0.00 44.72 45.75 2dme s GLY 116 CO -0.21 1.62 1.11 2.56 0.00 0.00 0.00 173.10 178.18 2dme s PRO 117 N -2.94 -1.51 -1.17 2.90 0.04 -1.26 -4.89 135.00 126.18 2dme s PRO 117 Ca 0.71 -0.16 -0.21 0.00 0.04 0.00 0.00 61.00 61.37 2dme s PRO 117 Cb -0.35 -1.57 0.03 0.00 0.04 0.00 0.00 34.50 32.65 2dme s PRO 117 CO 0.41 -3.88 1.71 -1.12 0.04 0.00 0.00 177.00 174.15 2dme s SER 118 N -3.97 6.32 0.56 6.66 0.01 -1.26 -4.97 113.70 117.06 2dme s SER 118 Ca 0.72 -1.91 -0.08 0.00 1.31 0.00 0.00 55.95 55.99 2dme s SER 118 Cb -0.08 -2.58 -0.03 0.00 0.21 0.00 0.00 66.02 63.54 2dme s SER 118 CO 0.56 -1.69 0.91 -0.94 0.41 0.00 0.00 173.24 172.49 2dme s SER 119 N 5.10 6.16 0.00 2.44 1.04 -1.26 -5.37 113.70 121.80 2dme s SER 119 Ca 0.55 1.13 0.00 0.00 0.48 0.00 0.00 55.95 58.12 2dme s SER 119 Cb 0.01 -2.29 0.00 0.00 0.10 0.00 0.00 66.02 63.85 2dme s SER 119 CO 0.03 -0.78 0.00 0.61 0.98 0.00 0.00 173.24 174.09