#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 -0.23 -0.00 1.61 0.15 -1.26 -5.13 113.70 108.84 2dme s SER 2 Ca 0.00 0.42 -0.30 0.00 0.70 0.00 0.00 55.95 56.77 2dme s SER 2 Cb 0.00 0.42 -0.07 0.00 -1.71 0.00 0.00 66.02 64.66 2dme s SER 2 CO 0.00 -0.09 1.76 -0.55 1.20 0.00 0.00 173.24 175.56 2dme s SER 3 N -0.02 6.58 0.00 5.45 0.15 -1.26 -4.86 113.70 119.75 2dme s SER 3 Ca 0.05 2.42 0.00 0.00 0.70 0.00 0.00 55.95 59.12 2dme s SER 3 Cb -0.05 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.73 2dme s SER 3 CO -0.10 -0.96 0.00 0.61 1.20 0.00 0.00 173.24 173.98 2dme n GLY 4 N 4.25 4.23 3.22 9.45 0.00 -1.26 -5.15 105.19 119.92 2dme n GLY 4 Ca 0.18 -1.17 -0.22 0.00 0.00 0.00 0.00 46.02 44.81 2dme n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dme s SER 5 N 0.00 2.10 -0.01 1.61 0.15 -1.26 -5.15 113.70 111.14 2dme s SER 5 Ca 0.00 -0.59 0.05 0.00 0.70 0.00 0.00 55.95 56.11 2dme s SER 5 Cb 0.00 -0.12 -0.03 0.00 -1.71 0.00 0.00 66.02 64.17 2dme s SER 5 CO 0.00 0.03 -0.16 -0.55 1.20 0.00 0.00 173.24 173.76 2dme s SER 6 N -1.59 3.89 0.00 5.45 0.15 -1.26 -4.76 113.70 115.58 2dme s SER 6 Ca 0.03 -0.31 0.00 0.00 0.70 0.00 0.00 55.95 56.37 2dme s SER 6 Cb -0.09 -0.72 0.00 0.00 -1.71 0.00 0.00 66.02 63.49 2dme s SER 6 CO 0.03 0.30 0.00 0.61 1.20 0.00 0.00 173.24 175.38 2dme n GLY 7 N 1.96 3.02 3.56 9.45 0.00 -1.26 -5.02 105.19 116.90 2dme n GLY 7 Ca -0.16 -0.85 -0.36 0.00 0.00 0.00 0.00 46.02 44.64 2dme n GLY 7 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dme s SER 8 N 0.00 5.95 0.09 1.61 0.15 -1.26 -4.86 113.70 115.39 2dme s SER 8 Ca 0.00 -0.98 -0.35 0.00 0.70 0.00 0.00 55.95 55.32 2dme s SER 8 Cb 0.00 -2.56 -0.15 0.00 -1.71 0.00 0.00 66.02 61.59 2dme s SER 8 CO 0.00 -1.99 1.57 0.00 1.20 0.00 0.00 173.24 174.02 2dme h ALA 9 N 10.63 -1.03 -0.88 5.45 0.00 -1.96 -1.41 119.26 130.07 2dme h ALA 9 Ca 0.09 -0.15 0.15 0.00 0.00 0.00 0.00 54.91 54.99 2dme h ALA 9 Cb 1.02 0.74 -0.15 0.00 0.00 0.00 0.00 17.79 19.40 2dme h ALA 9 CO 1.33 -1.13 -0.35 -0.44 0.00 0.00 0.00 179.25 178.66 2dme h ASP 10 N -0.89 -1.27 -0.57 0.00 3.32 -2.00 0.38 116.42 115.39 2dme h ASP 10 Ca -0.04 0.28 0.05 0.00 0.02 0.00 0.00 57.03 57.35 2dme h ASP 10 Cb 0.81 0.68 -0.05 0.00 0.22 0.00 0.00 39.33 40.99 2dme h ASP 10 CO -0.13 -0.29 0.29 1.56 -1.72 0.00 0.00 179.24 178.95 2dme h GLN 11 N -0.04 0.54 0.32 3.56 4.20 -1.89 -1.25 115.11 120.55 2dme h GLN 11 Ca 0.33 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 59.00 2dme h GLN 11 Cb 0.60 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.25 2dme h GLN 11 CO -0.90 0.36 -0.27 0.82 -0.67 0.00 0.00 178.83 178.16 2dme h ILE 12 N 0.55 0.00 -0.78 2.54 2.04 0.80 -0.38 117.51 122.28 2dme h ILE 12 Ca 0.26 0.00 0.18 0.00 1.00 0.00 0.00 64.86 66.30 2dme h ILE 12 Cb 0.18 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 36.14 2dme h ILE 12 CO -0.18 0.00 0.18 0.03 0.00 0.00 0.00 178.15 178.18 2dme h ARG 13 N -0.58 0.24 0.12 2.37 3.08 -1.07 -0.97 114.38 117.56 2dme h ARG 13 Ca -0.04 -0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.01 2dme h ARG 13 Cb 0.49 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.46 2dme h ARG 13 CO -0.01 0.16 -0.23 0.37 -1.07 0.00 0.00 179.97 179.19 2dme h GLN 14 N 0.24 -0.41 -0.78 0.04 -0.00 -0.97 -2.39 115.11 110.85 2dme h GLN 14 Ca 0.45 0.03 0.17 0.00 -0.00 0.00 0.00 58.65 59.30 2dme h GLN 14 Cb 0.81 0.09 -0.11 0.00 0.00 0.00 0.00 27.48 28.28 2dme h GLN 14 CO -0.56 -0.27 0.25 1.03 0.00 0.00 0.00 178.83 179.28 2dme h SER 15 N -0.42 0.14 -0.84 -0.69 0.87 0.27 0.10 113.55 112.98 2dme h SER 15 Ca 0.03 0.14 0.20 0.00 -1.23 0.00 0.00 61.79 60.93 2dme h SER 15 Cb 0.44 0.16 -0.13 0.00 -0.44 0.00 0.00 62.40 62.44 2dme h SER 15 CO -0.12 0.00 0.25 0.58 -0.53 0.00 0.00 176.83 177.01 2dme h VAL 16 N 0.34 0.42 0.26 2.23 2.07 -0.87 -1.13 116.25 119.56 2dme h VAL 16 Ca 0.45 -0.09 -0.01 0.00 0.82 0.00 0.00 66.70 67.87 2dme h VAL 16 Cb 0.77 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.65 2dme h VAL 16 CO -0.49 0.05 -0.25 0.03 0.02 0.00 0.00 177.57 176.93 2dme h ARG 17 N 0.27 -0.48 -0.59 1.57 3.08 -0.92 -0.78 114.38 116.54 2dme h ARG 17 Ca 0.51 0.03 0.11 0.00 0.07 0.00 0.00 59.98 60.70 2dme h ARG 17 Cb 0.95 0.11 -0.12 0.00 0.08 0.00 0.00 29.97 31.00 2dme h ARG 17 CO -0.58 -0.32 -0.27 1.25 -1.07 0.00 0.00 179.97 178.98 2dme h HIS 18 N -0.50 -0.70 -0.11 3.04 2.76 -1.39 -0.90 115.15 117.35 2dme h HIS 18 Ca -0.03 0.07 0.04 0.00 -2.20 0.00 0.00 60.37 58.24 2dme h HIS 18 Cb 0.43 0.40 -0.06 0.00 1.55 0.00 0.00 27.41 29.72 2dme h HIS 18 CO -0.14 -0.35 -0.46 0.77 -1.30 0.00 0.00 177.93 176.45 2dme h SER 19 N -0.11 -1.44 -0.19 3.26 0.02 -1.07 0.20 113.55 114.22 2dme h SER 19 Ca 0.26 0.18 0.05 0.00 -0.84 0.00 0.00 61.79 61.44 2dme h SER 19 Cb 0.53 0.57 -0.07 0.00 0.14 0.00 0.00 62.40 63.57 2dme h SER 19 CO -0.66 -0.45 -0.36 -0.07 -1.14 0.00 0.00 176.83 174.15 2dme h LEU 20 N -0.54 -1.13 -0.99 5.07 3.38 -0.19 -0.69 115.31 120.22 2dme h LEU 20 Ca 0.06 0.17 0.13 0.00 0.09 0.00 0.00 57.88 58.33 2dme h LEU 20 Cb 0.65 0.48 -0.09 0.00 0.09 0.00 0.00 40.66 41.80 2dme h LEU 20 CO -0.40 -0.38 0.62 0.50 0.09 0.00 0.00 178.44 178.87 2dme h LYS 21 N -0.40 0.91 -0.43 1.13 3.64 -0.70 -1.92 116.57 118.80 2dme h LYS 21 Ca 0.10 -0.05 0.09 0.00 -1.27 0.00 0.00 60.65 59.52 2dme h LYS 21 Cb 0.57 -0.20 -0.09 0.00 -0.41 0.00 0.00 32.23 32.09 2dme h LYS 21 CO -0.41 0.60 -0.24 0.22 -2.27 0.00 0.00 179.45 177.36 2dme h ASP 22 N 0.94 -0.81 0.67 4.20 3.58 0.95 0.46 116.42 126.40 2dme h ASP 22 Ca 0.51 0.17 -0.03 0.00 0.42 0.00 0.00 57.03 58.10 2dme h ASP 22 Cb 0.56 0.42 0.01 0.00 1.72 0.00 0.00 39.33 42.03 2dme h ASP 22 CO -0.29 -0.26 -0.32 0.40 -2.88 0.00 0.00 179.24 175.89 2dme h ILE 23 N -0.15 0.28 -0.08 2.25 2.04 -1.10 -2.32 117.51 118.43 2dme h ILE 23 Ca 0.20 -0.16 0.02 0.00 1.00 0.00 0.00 64.86 65.93 2dme h ILE 23 Cb 0.47 0.33 -0.00 0.00 -0.74 0.00 0.00 36.82 36.88 2dme h ILE 23 CO -0.53 0.02 0.27 -0.07 0.00 0.00 0.00 178.15 177.84 2dme h LEU 24 N -1.01 0.00 0.02 1.44 3.38 -1.07 0.29 115.31 118.36 2dme h LEU 24 Ca -0.09 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.61 2dme h LEU 24 Cb 0.72 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.49 2dme h LEU 24 CO 0.15 0.00 -1.09 0.24 0.09 0.00 0.00 178.44 177.83 2dme h MET 25 N 0.00 0.66 0.00 1.13 2.86 0.40 -2.06 114.93 117.93 2dme h MET 25 Ca 0.04 -0.75 -0.07 0.00 -2.06 0.00 0.00 59.70 56.86 2dme h MET 25 Cb 0.57 0.22 -0.01 0.00 0.06 0.00 0.00 31.60 32.45 2dme h MET 25 CO -0.00 1.33 -0.73 -0.22 1.06 0.00 0.00 176.91 178.35 2dme h LYS 26 N 0.35 0.00 0.00 1.72 3.11 -0.37 -2.49 116.57 118.89 2dme h LYS 26 Ca -0.14 0.00 -0.07 0.00 -2.81 0.00 0.00 60.65 57.63 2dme h LYS 26 Cb 1.75 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 32.97 2dme h LYS 26 CO 0.21 0.21 -0.59 0.00 -2.81 0.00 0.00 179.45 176.47 2dme h ARG 27 N 0.00 0.00 0.07 1.90 2.47 -0.60 -3.01 114.38 115.20 2dme h ARG 27 Ca -0.04 0.00 -0.35 0.00 -1.26 0.00 0.00 59.98 58.33 2dme h ARG 27 Cb 1.25 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 29.53 2dme h ARG 27 CO 0.03 0.25 -2.02 1.47 0.56 0.00 0.00 179.97 180.26 2dme n LEU 28 N -3.05 2.09 0.12 3.04 -0.00 -0.77 -3.16 117.00 115.27 2dme n LEU 28 Ca 0.00 0.20 -0.01 0.00 -0.00 0.00 0.00 56.01 56.21 2dme n LEU 28 Cb 0.67 -0.67 0.25 0.00 -0.00 0.00 0.00 43.42 43.66 2dme n LEU 28 CO 0.39 0.73 0.64 0.00 -0.00 0.00 0.00 177.39 179.15 2dme h THR 29 N 0.04 1.32 0.06 1.47 1.03 -1.56 -3.29 112.91 111.97 2dme h THR 29 Ca -0.42 -1.56 -0.00 0.00 -0.01 0.00 0.00 66.41 64.42 2dme h THR 29 Cb 2.03 1.76 0.00 0.00 -1.07 0.00 0.00 68.15 70.87 2dme h THR 29 CO 0.06 0.46 -0.03 -0.78 -0.01 0.00 0.00 175.52 175.22 2dme h ASP 30 N 0.12 -0.06 -1.99 0.00 3.58 -1.69 -3.47 116.42 112.90 2dme h ASP 30 Ca 0.01 -0.27 -0.20 0.00 0.42 0.00 0.00 57.03 56.99 2dme h ASP 30 Cb 0.82 0.02 0.12 0.00 1.72 0.00 0.00 39.33 42.01 2dme h ASP 30 CO 0.06 0.55 -0.10 -0.24 -2.88 0.00 0.00 179.24 176.64 2dme n SER 31 N -4.79 -3.09 -2.17 2.28 2.88 -1.19 -4.81 113.62 102.74 2dme n SER 31 Ca -0.04 -0.48 -0.21 0.00 -1.33 0.00 0.00 58.87 56.81 2dme n SER 31 Cb 0.16 -0.67 -0.02 0.00 -0.75 0.00 0.00 64.21 62.93 2dme n SER 31 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2dme n ASN 32 N -2.90 6.38 -4.82 -3.46 3.02 -1.26 -4.92 115.26 107.30 2dme n ASN 32 Ca 0.08 -3.08 -0.24 0.00 -0.03 0.00 0.00 54.58 51.30 2dme n ASN 32 Cb 0.33 -1.16 -0.05 0.00 -0.61 0.00 0.00 39.78 38.29 2dme n ASN 32 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2dme s LEU 33 N -1.85 3.84 -0.01 3.41 1.43 -1.25 -5.02 118.68 119.23 2dme s LEU 33 Ca 0.46 -0.16 0.02 0.00 -1.03 0.00 0.00 54.13 53.41 2dme s LEU 33 Cb 0.31 -2.42 0.03 0.00 0.03 0.00 0.00 46.19 44.14 2dme s LEU 33 CO -0.10 0.02 0.79 2.29 0.23 0.00 0.00 176.35 179.57 2dme n LYS 34 N -0.72 0.91 -1.65 1.70 0.00 -1.26 -4.82 118.16 112.32 2dme n LYS 34 Ca -0.08 -1.06 -0.39 0.00 -0.00 0.00 0.00 58.31 56.78 2dme n LYS 34 Cb 0.56 -0.73 0.04 0.00 -0.00 0.00 0.00 35.03 34.90 2dme n LYS 34 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.40 178.73 2dme n VAL 35 N -0.28 3.51 -1.21 0.58 0.24 -1.26 -4.97 118.33 114.94 2dme n VAL 35 Ca 0.02 -0.50 -0.30 0.00 -2.04 0.00 0.00 64.34 61.52 2dme n VAL 35 Cb 0.48 -1.30 0.14 0.00 -1.47 0.00 0.00 33.84 31.69 2dme n VAL 35 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 2dme s PRO 36 N -2.66 1.30 0.54 7.34 0.04 -1.26 -4.93 135.00 135.38 2dme s PRO 36 Ca 0.72 0.83 0.31 0.00 0.04 0.00 0.00 61.00 62.91 2dme s PRO 36 Cb -0.44 -1.81 1.52 0.00 0.04 0.00 0.00 34.50 33.80 2dme s PRO 36 CO 0.49 -2.21 2.07 1.49 0.04 0.00 0.00 177.00 178.88 2dme h GLU 37 N -1.53 0.00 0.00 4.56 4.22 -2.03 -2.08 114.58 117.72 2dme h GLU 37 Ca -0.49 0.00 -0.05 0.00 0.08 0.00 0.00 59.36 58.90 2dme h GLU 37 Cb 1.28 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.52 2dme h GLU 37 CO 0.54 0.09 -0.23 1.49 -2.18 0.00 0.00 179.01 178.72 2dme h GLU 38 N 0.00 0.00 0.14 1.92 4.57 -2.00 -3.16 114.58 116.06 2dme h GLU 38 Ca -0.00 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.17 2dme h GLU 38 Cb 0.38 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.97 2dme h GLU 38 CO 0.01 0.23 -0.07 -0.22 -1.18 0.00 0.00 179.01 177.78 2dme h LYS 39 N 0.00 -0.18 -0.42 1.92 1.63 -1.73 0.14 116.57 117.93 2dme h LYS 39 Ca -0.00 0.01 0.06 0.00 -0.85 0.00 0.00 60.65 59.87 2dme h LYS 39 Cb 0.59 0.04 -0.09 0.00 -0.60 0.00 0.00 32.23 32.18 2dme h LYS 39 CO 0.03 -0.12 -0.52 0.00 -3.45 0.00 0.00 179.45 175.39 2dme h ALA 40 N -1.91 -0.67 -0.40 5.00 0.00 -1.71 0.51 119.26 120.08 2dme h ALA 40 Ca -0.02 0.02 0.08 0.00 0.00 0.00 0.00 54.91 55.00 2dme h ALA 40 Cb 0.15 1.06 -0.08 0.00 0.00 0.00 0.00 17.79 18.91 2dme h ALA 40 CO 0.03 -0.99 -0.16 0.00 0.00 0.00 0.00 179.25 178.13 2dme h ALA 41 N 0.12 0.17 -0.69 0.00 0.00 -1.60 0.06 119.26 117.32 2dme h ALA 41 Ca 0.10 0.15 0.11 0.00 0.00 0.00 0.00 54.91 55.26 2dme h ALA 41 Cb 0.59 0.41 -0.08 0.00 0.00 0.00 0.00 17.79 18.72 2dme h ALA 41 CO -0.60 -0.52 0.30 0.87 0.00 0.00 0.00 179.25 179.30 2dme h LYS 42 N -0.08 0.48 0.76 0.00 1.57 0.46 -0.21 116.57 119.56 2dme h LYS 42 Ca 0.20 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.91 2dme h LYS 42 Cb 0.38 -0.11 0.01 0.00 0.08 0.00 0.00 32.23 32.59 2dme h LYS 42 CO -0.46 0.32 -0.36 0.28 -0.57 0.00 0.00 179.45 178.66 2dme h VAL 43 N 0.50 0.16 -0.69 0.50 2.07 0.41 -2.76 116.25 116.44 2dme h VAL 43 Ca 0.35 -0.16 0.15 0.00 0.82 0.00 0.00 66.70 67.86 2dme h VAL 43 Cb 0.44 0.19 -0.11 0.00 -1.52 0.00 0.00 31.29 30.29 2dme h VAL 43 CO -0.32 0.01 0.08 0.00 0.02 0.00 0.00 177.57 177.37 2dme h ALA 44 N -1.01 0.78 -0.01 1.67 0.00 -0.76 0.65 119.26 120.59 2dme h ALA 44 Ca -0.10 0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2dme h ALA 44 Cb 0.80 0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 2dme h ALA 44 CO 0.17 -0.37 0.05 1.15 0.00 0.00 0.00 179.25 180.25 2dme h THR 45 N 0.19 0.11 0.00 0.00 2.02 -0.98 0.17 112.91 114.42 2dme h THR 45 Ca 0.37 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.55 2dme h THR 45 Cb 0.63 0.95 0.00 0.00 -1.74 0.00 0.00 68.15 67.99 2dme h THR 45 CO -0.53 0.00 -0.93 0.29 0.37 0.00 0.00 175.52 174.71 2dme n LYS 46 N -3.22 0.36 0.06 6.66 5.02 0.22 -3.64 118.16 123.62 2dme n LYS 46 Ca -0.03 0.04 -0.11 0.00 -2.02 0.00 0.00 58.31 56.19 2dme n LYS 46 Cb 0.13 -1.66 -0.08 0.00 -0.02 0.00 0.00 35.03 33.39 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 0.90 0.61 -0.18 1.08 0.34 -3.22 117.51 117.04 2dme h ILE 47 Ca 0.00 -1.08 -0.03 0.00 -0.39 0.00 0.00 64.86 63.36 2dme h ILE 47 Cb 0.80 1.47 0.01 0.00 -3.07 0.00 0.00 36.82 36.03 2dme h ILE 47 CO 0.00 0.22 -0.29 -0.33 -0.69 0.00 0.00 178.15 177.06 2dme h GLU 48 N -0.81 -0.79 -1.78 2.37 3.07 -1.71 0.24 114.58 115.17 2dme h GLU 48 Ca -0.02 0.05 0.52 0.00 -0.50 0.00 0.00 59.36 59.41 2dme h GLU 48 Cb 0.53 0.18 -0.07 0.00 -0.84 0.00 0.00 28.75 28.55 2dme h GLU 48 CO 0.04 -0.48 1.33 0.36 -1.40 0.00 0.00 179.01 178.87 2dme n LYS 49 N -5.37 0.00 -0.08 2.33 2.85 -1.24 0.86 118.16 117.51 2dme n LYS 49 Ca -0.12 1.02 -0.20 0.00 -1.05 0.00 0.00 58.31 57.96 2dme n LYS 49 Cb 0.35 -2.38 -0.12 0.00 -0.65 0.00 0.00 35.03 32.23 2dme n LYS 49 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 177.40 175.44 2dme n GLU 50 N -3.74 0.68 0.27 -1.58 4.07 -1.04 -4.08 120.64 115.22 2dme n GLU 50 Ca 0.40 0.21 -0.11 0.00 -0.06 0.00 0.00 57.16 57.61 2dme n GLU 50 Cb 1.87 -1.59 -0.05 0.00 -0.06 0.00 0.00 31.44 31.61 2dme n GLU 50 CO 0.00 0.00 0.00 1.25 -0.06 0.00 0.00 177.13 178.32 2dme h LEU 51 N -0.09 -0.59 -1.57 4.31 5.85 0.40 0.18 115.31 123.80 2dme h LEU 51 Ca -0.53 0.02 0.14 0.00 0.84 0.00 0.00 57.88 58.35 2dme h LEU 51 Cb 1.90 0.15 -0.02 0.00 0.37 0.00 0.00 40.66 43.06 2dme h LEU 51 CO -0.06 -0.35 0.68 0.15 -0.34 0.00 0.00 178.44 178.52 2dme h PHE 52 N -0.83 0.00 0.00 1.25 3.57 -0.74 0.40 116.94 120.59 2dme h PHE 52 Ca -0.07 0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.33 2dme h PHE 52 Cb 0.53 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.26 2dme h PHE 52 CO 0.06 0.00 -0.56 1.03 -2.23 0.00 0.00 178.31 176.61 2dme h SER 53 N 0.00 0.00 -0.31 0.41 0.87 -1.63 0.47 113.55 113.36 2dme h SER 53 Ca 0.23 -0.71 0.09 0.00 -1.23 0.00 0.00 61.79 60.17 2dme h SER 53 Cb 1.59 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.53 2dme h SER 53 CO -0.00 1.18 0.23 0.15 -0.53 0.00 0.00 176.83 177.86 2dme h PHE 54 N -1.00 0.00 0.00 2.24 3.57 0.14 -2.53 116.94 119.36 2dme h PHE 54 Ca -0.15 0.00 -0.34 0.00 3.53 0.00 0.00 57.97 61.00 2dme h PHE 54 Cb 1.07 0.00 -0.06 0.00 2.79 0.00 0.00 35.95 39.75 2dme h PHE 54 CO 0.17 0.00 -2.30 1.19 -2.23 0.00 0.00 178.31 175.14 2dme n PHE 55 N -4.35 0.00 -2.68 0.41 3.72 -0.28 -4.99 117.46 109.28 2dme n PHE 55 Ca 0.04 0.00 -0.19 0.00 -0.05 0.00 0.00 57.45 57.25 2dme n PHE 55 Cb 0.40 -0.92 0.00 0.00 -0.94 0.00 0.00 39.48 38.02 2dme n PHE 55 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 2dme n ARG 56 N -2.84 -2.83 -3.58 -1.08 1.74 0.17 -4.92 116.66 103.32 2dme n ARG 56 Ca -0.34 0.79 -0.07 0.00 -0.77 0.00 0.00 57.85 57.47 2dme n ARG 56 Cb 1.06 -5.49 -0.03 0.00 -1.02 0.00 0.00 32.46 26.97 2dme n ARG 56 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2dme s ASP 57 N -2.28 -0.25 -0.43 0.55 1.01 -1.24 -5.03 116.67 109.00 2dme s ASP 57 Ca 0.12 0.15 0.05 0.00 0.71 0.00 0.00 52.55 53.58 2dme s ASP 57 Cb -0.06 0.23 0.65 0.00 1.01 0.00 0.00 42.92 44.75 2dme s ASP 57 CO 0.15 -0.32 1.86 0.35 0.21 0.00 0.00 175.17 177.42 2dme n THR 58 N 0.26 3.12 -1.20 -1.27 -2.24 -1.26 -4.59 114.28 107.09 2dme n THR 58 Ca -0.05 -2.02 -0.29 0.00 -2.27 0.00 0.00 64.05 59.43 2dme n THR 58 Cb 0.59 -0.45 0.17 0.00 -2.10 0.00 0.00 70.33 68.55 2dme n THR 58 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2dme s ASP 59 N -1.45 2.67 0.35 3.42 1.01 -1.26 -4.68 116.67 116.74 2dme s ASP 59 Ca 0.55 1.15 0.13 0.00 0.71 0.00 0.00 52.55 55.10 2dme s ASP 59 Cb 0.47 -1.81 0.99 0.00 1.01 0.00 0.00 42.92 43.58 2dme s ASP 59 CO 0.10 -3.10 1.74 0.00 0.21 0.00 0.00 175.17 174.11 2dme h ALA 60 N -1.87 1.98 -0.17 5.23 0.00 -1.99 0.62 119.26 123.06 2dme h ALA 60 Ca -0.54 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.47 2dme h ALA 60 Cb 1.33 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.14 2dme h ALA 60 CO 0.58 -0.44 0.10 1.57 0.00 0.00 0.00 179.25 181.06 2dme h LYS 61 N 0.49 0.22 0.28 0.00 2.10 -1.95 0.29 116.57 118.00 2dme h LYS 61 Ca 0.64 -0.01 -0.01 0.00 -2.00 0.00 0.00 60.65 59.26 2dme h LYS 61 Cb 1.38 -0.05 0.00 0.00 -0.90 0.00 0.00 32.23 32.67 2dme h LYS 61 CO -0.42 0.15 -0.14 -0.92 -2.00 0.00 0.00 179.45 176.13 2dme h TYR 62 N 0.23 -0.35 -0.69 0.07 3.20 -0.00 -3.11 116.97 116.31 2dme h TYR 62 Ca 0.06 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.92 2dme h TYR 62 Cb -0.01 0.12 -0.03 0.00 1.54 0.00 0.00 36.73 38.34 2dme h TYR 62 CO 0.00 -0.06 0.41 0.87 -1.64 0.00 0.00 178.16 177.75 2dme h LYS 63 N -1.01 0.94 -0.65 1.82 1.57 -1.32 -2.56 116.57 115.37 2dme h LYS 63 Ca -0.04 -0.09 0.14 0.00 -1.87 0.00 0.00 60.65 58.79 2dme h LYS 63 Cb 0.45 -0.20 -0.11 0.00 0.08 0.00 0.00 32.23 32.46 2dme h LYS 63 CO 0.06 0.68 0.01 -0.91 -0.57 0.00 0.00 179.45 178.72 2dme h ASN 64 N 0.95 -0.28 -0.44 0.86 -0.26 -0.52 0.99 115.58 116.88 2dme h ASN 64 Ca 0.25 0.16 -0.04 0.00 -0.56 0.00 0.00 56.30 56.11 2dme h ASN 64 Cb -0.02 0.28 -0.02 0.00 -1.06 0.00 0.00 38.32 37.50 2dme h ASN 64 CO -0.05 -0.12 0.12 0.50 -1.06 0.00 0.00 177.43 176.82 2dme h LYS 65 N 0.12 0.69 0.38 0.81 1.63 -1.41 -0.80 116.57 117.98 2dme h LYS 65 Ca 0.34 -0.16 -0.01 0.00 -0.85 0.00 0.00 60.65 59.98 2dme h LYS 65 Cb 0.56 -0.09 -0.02 0.00 -0.60 0.00 0.00 32.23 32.08 2dme h LYS 65 CO -0.55 0.68 -0.32 -0.92 -3.45 0.00 0.00 179.45 174.89 2dme h TYR 66 N 0.57 -0.84 0.00 1.91 3.20 -0.71 0.42 116.97 121.52 2dme h TYR 66 Ca 0.14 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.00 2dme h TYR 66 Cb 0.29 0.32 -0.00 0.00 1.54 0.00 0.00 36.73 38.88 2dme h TYR 66 CO 0.02 -0.46 -0.07 0.07 -1.64 0.00 0.00 178.16 176.08 2dme h ARG 67 N -0.70 0.00 0.21 1.82 0.11 -0.87 -2.10 114.38 112.85 2dme h ARG 67 Ca -0.03 0.00 -0.32 0.00 0.10 0.00 0.00 59.98 59.73 2dme h ARG 67 Cb 0.61 0.00 0.03 0.00 1.11 0.00 0.00 29.97 31.73 2dme h ARG 67 CO -0.02 0.07 -1.39 1.03 0.10 0.00 0.00 179.97 179.75 2dme h SER 68 N 0.00 0.80 -0.06 0.08 0.87 -0.23 -2.12 113.55 112.89 2dme h SER 68 Ca -0.00 -0.82 -0.01 0.00 -1.23 0.00 0.00 61.79 59.73 2dme h SER 68 Cb 0.22 -0.26 -0.00 0.00 -0.44 0.00 0.00 62.40 61.92 2dme h SER 68 CO 0.01 1.64 0.01 -0.07 -0.53 0.00 0.00 176.83 177.88 2dme h LEU 69 N 0.17 0.11 -1.12 2.23 3.38 0.34 -2.96 115.31 117.46 2dme h LEU 69 Ca -0.22 -0.29 -0.08 0.00 0.09 0.00 0.00 57.88 57.38 2dme h LEU 69 Cb 2.08 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 42.79 2dme h LEU 69 CO 0.26 0.37 -0.37 0.00 0.09 0.00 0.00 178.44 178.79 2dme h MET 70 N -0.16 0.00 -0.76 1.13 -0.00 -1.53 -3.13 114.93 110.49 2dme h MET 70 Ca 0.02 0.00 0.16 0.00 -0.00 0.00 0.00 59.70 59.88 2dme h MET 70 Cb 0.31 0.00 -0.11 0.00 -0.00 0.00 0.00 31.60 31.80 2dme h MET 70 CO 0.00 0.37 0.22 0.35 -0.00 0.00 0.00 176.91 177.85 2dme h PHE 71 N 0.00 0.35 0.00 -0.10 3.04 -1.20 0.53 116.94 119.56 2dme h PHE 71 Ca -0.00 0.04 -0.04 0.00 3.98 0.00 0.00 57.97 61.95 2dme h PHE 71 Cb 0.79 -0.04 -0.01 0.00 2.56 0.00 0.00 35.95 39.26 2dme h PHE 71 CO 0.00 -0.06 -0.17 -0.91 -2.02 0.00 0.00 178.31 175.14 2dme h ASN 72 N 0.31 0.00 0.13 0.41 2.35 -1.59 -2.87 115.58 114.31 2dme h ASN 72 Ca 0.43 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 56.18 2dme h ASN 72 Cb 0.74 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.11 2dme h ASN 72 CO -0.50 0.17 -0.06 -0.07 -1.65 0.00 0.00 177.43 175.32 2dme h LEU 73 N 0.00 -0.15 0.00 1.61 3.38 -0.10 -3.14 115.31 116.91 2dme h LEU 73 Ca -0.00 -0.41 0.00 0.00 0.09 0.00 0.00 57.88 57.56 2dme h LEU 73 Cb 0.78 0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.57 2dme h LEU 73 CO 0.02 0.44 0.00 2.29 0.09 0.00 0.00 178.44 181.29 2dme n LYS 74 N -4.88 0.29 -2.18 1.13 2.85 -0.02 -4.72 118.16 110.62 2dme n LYS 74 Ca -0.08 0.10 -0.42 0.00 -1.05 0.00 0.00 58.31 56.86 2dme n LYS 74 Cb 0.27 -1.50 -0.03 0.00 -0.65 0.00 0.00 35.03 33.13 2dme n LYS 74 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 2dme s ASP 75 N -2.38 6.80 0.42 -5.58 2.15 -1.09 -4.89 116.67 112.09 2dme s ASP 75 Ca 0.16 2.06 0.29 0.00 0.43 0.00 0.00 52.55 55.49 2dme s ASP 75 Cb 0.10 -2.54 1.21 0.00 -0.30 0.00 0.00 42.92 41.38 2dme s ASP 75 CO 0.20 -0.81 1.86 1.55 -0.17 0.00 0.00 175.17 177.80 2dme h PRO 76 N 8.59 0.00 0.13 4.34 0.13 -1.89 -3.09 132.00 140.22 2dme h PRO 76 Ca -0.36 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 64.52 2dme h PRO 76 Cb 1.16 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.30 2dme h PRO 76 CO 0.94 0.00 -1.22 0.87 -0.23 0.00 0.00 178.00 178.36 2dme h LYS 77 N 0.00 0.28 -5.21 0.86 1.79 -1.93 -3.41 116.57 108.95 2dme h LYS 77 Ca 0.00 -0.48 -0.68 0.00 -2.18 0.00 0.00 60.65 57.30 2dme h LYS 77 Cb 0.43 0.18 -0.16 0.00 -1.58 0.00 0.00 32.23 31.10 2dme h LYS 77 CO 0.00 1.23 1.15 1.21 -1.08 0.00 0.00 179.45 181.96 2dme s ASN 78 N -7.05 6.71 -0.69 0.86 3.84 -1.17 -4.84 114.94 112.61 2dme s ASN 78 Ca -0.17 -2.17 -0.01 0.00 0.21 0.00 0.00 52.86 50.72 2dme s ASN 78 Cb 0.03 -2.44 0.42 0.00 -0.55 0.00 0.00 41.25 38.71 2dme s ASN 78 CO 0.80 -1.08 1.97 -0.46 -2.79 0.00 0.00 177.10 175.54 2dme n ASN 79 N 6.89 7.44 0.07 -4.21 6.94 -1.26 -4.47 115.26 126.66 2dme n ASN 79 Ca 0.30 -3.80 0.00 0.00 -0.02 0.00 0.00 54.58 51.06 2dme n ASN 79 Cb 0.48 -0.95 0.00 0.00 -2.36 0.00 0.00 39.78 36.95 2dme n ASN 79 CO 0.00 0.00 0.00 -0.38 -1.03 0.00 0.00 177.26 175.85 2dme n ILE 80 N -0.80 0.47 -0.02 1.53 5.41 -1.26 -4.76 119.36 119.94 2dme n ILE 80 Ca 0.59 0.16 -0.00 0.00 1.00 0.00 0.00 62.75 64.49 2dme n ILE 80 Cb 0.57 -1.05 -0.00 0.00 -0.71 0.00 0.00 39.64 38.44 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 -3.31 -0.05 -0.31 1.39 7.94 -1.26 0.17 117.00 121.57 2dme n LEU 81 Ca 0.00 0.78 0.01 0.00 -1.11 0.00 0.00 56.01 55.69 2dme n LEU 81 Cb 0.07 -0.36 0.08 0.00 0.53 0.00 0.00 43.42 43.73 2dme n LEU 81 CO 0.00 -0.42 0.65 2.19 -1.11 0.00 0.00 177.39 178.70 2dme h PHE 82 N 0.00 -0.72 0.40 1.96 -0.00 -1.90 0.52 116.94 117.20 2dme h PHE 82 Ca 0.01 0.09 -0.01 0.00 -0.00 0.00 0.00 57.97 58.06 2dme h PHE 82 Cb 0.02 0.45 -0.02 0.00 -0.00 0.00 0.00 35.95 36.39 2dme h PHE 82 CO -0.70 -0.39 -0.42 -0.22 -0.00 0.00 0.00 178.31 176.57 2dme h LYS 83 N -0.03 -0.82 -1.01 6.09 3.64 -0.57 0.03 116.57 123.91 2dme h LYS 83 Ca 0.37 0.06 0.26 0.00 -1.27 0.00 0.00 60.65 60.06 2dme h LYS 83 Cb 0.62 0.19 -0.08 0.00 -0.41 0.00 0.00 32.23 32.54 2dme h LYS 83 CO -0.90 -0.54 0.67 0.87 -2.27 0.00 0.00 179.45 177.28 2dme h LYS 84 N -0.85 0.34 0.16 1.90 1.57 0.11 0.22 116.57 120.03 2dme h LYS 84 Ca -0.03 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 2dme h LYS 84 Cb 0.76 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.99 2dme h LYS 84 CO -0.08 0.22 -0.08 0.28 -0.57 0.00 0.00 179.45 179.23 2dme h VAL 85 N 0.35 0.00 -0.73 0.50 2.07 -0.06 0.29 116.25 118.67 2dme h VAL 85 Ca 0.55 -0.17 0.16 0.00 0.82 0.00 0.00 66.70 68.06 2dme h VAL 85 Cb 1.49 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 31.15 2dme h VAL 85 CO -0.22 0.00 0.17 -0.07 0.02 0.00 0.00 177.57 177.47 2dme h LEU 86 N -0.39 0.00 -0.68 2.57 4.07 -0.67 0.34 115.31 120.56 2dme h LEU 86 Ca -0.02 0.15 0.02 0.00 0.08 0.00 0.00 57.88 58.11 2dme h LEU 86 Cb 0.17 0.20 -0.04 0.00 1.08 0.00 0.00 40.66 42.07 2dme h LEU 86 CO 0.04 -0.04 0.43 0.11 -1.08 0.00 0.00 178.44 177.90 2dme h LYS 87 N 0.26 0.83 0.00 1.13 1.79 -0.68 -3.47 116.57 116.44 2dme h LYS 87 Ca 0.41 -0.05 0.00 0.00 -2.18 0.00 0.00 60.65 58.83 2dme h LYS 87 Cb 0.71 -0.19 0.00 0.00 -1.58 0.00 0.00 32.23 31.17 2dme h LYS 87 CO -0.51 0.55 0.00 0.41 -1.08 0.00 0.00 179.45 178.82 2dme n GLY 88 N -1.28 1.21 0.38 3.86 0.00 0.11 -5.01 105.19 104.45 2dme n GLY 88 Ca 0.07 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.06 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 -0.26 -3.83 1.61 -0.58 0.80 -4.34 120.64 114.04 2dme n GLU 89 Ca 0.00 1.49 -0.34 0.00 -0.42 0.00 0.00 57.16 57.89 2dme n GLU 89 Cb 0.00 -2.20 -0.05 0.00 -0.57 0.00 0.00 31.44 28.62 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 -5.84 5.37 0.05 2.62 1.01 0.16 -4.97 120.40 118.80 2dme s VAL 90 Ca -0.13 -0.02 -0.00 0.00 0.00 0.00 0.00 61.98 61.83 2dme s VAL 90 Cb 0.18 -3.56 -0.04 0.00 0.00 0.00 0.00 36.38 32.96 2dme s VAL 90 CO 0.67 0.32 0.20 0.42 0.00 0.00 0.00 175.10 176.72 2dme s THR 91 N -1.34 5.37 0.16 3.92 -4.23 -1.26 -4.39 115.64 113.88 2dme s THR 91 Ca 0.28 -0.36 0.31 0.00 -1.18 0.00 0.00 61.69 60.74 2dme s THR 91 Cb -0.13 -3.60 0.35 0.00 1.34 0.00 0.00 72.50 70.45 2dme s THR 91 CO 0.18 0.17 1.97 1.55 -0.54 0.00 0.00 174.62 177.95 2dme h PRO 92 N 3.21 0.00 0.00 3.99 0.13 -1.90 -0.77 132.00 136.67 2dme h PRO 92 Ca -0.46 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.55 2dme h PRO 92 Cb 1.16 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.27 2dme h PRO 92 CO 0.75 0.07 -1.27 0.38 -0.23 0.00 0.00 178.00 177.69 2dme h ASP 93 N 0.00 0.00 0.32 1.44 3.04 -1.92 -3.37 116.42 115.94 2dme h ASP 93 Ca -0.00 0.00 -0.33 0.00 -3.24 0.00 0.00 57.03 53.46 2dme h ASP 93 Cb 0.54 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 38.82 2dme h ASP 93 CO 0.01 0.44 -1.72 -0.74 -2.04 0.00 0.00 179.24 175.19 2dme h HIS 94 N 0.00 0.44 -0.70 4.15 2.76 -1.90 -3.34 115.15 116.57 2dme h HIS 94 Ca -0.12 -0.32 0.20 0.00 -2.20 0.00 0.00 60.37 57.93 2dme h HIS 94 Cb 1.44 -0.02 -0.03 0.00 1.55 0.00 0.00 27.41 30.35 2dme h HIS 94 CO 0.00 1.49 1.02 1.25 -1.30 0.00 0.00 177.93 180.39 2dme h LEU 95 N 0.07 0.00 0.00 0.26 5.85 -1.30 0.26 115.31 120.45 2dme h LEU 95 Ca -0.32 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.40 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 0.13 0.00 -0.00 0.40 -0.34 0.00 0.00 178.44 178.63 2dme h ILE 96 N 0.00 0.66 -0.10 4.05 2.04 -1.79 -3.31 117.51 119.07 2dme h ILE 96 Ca 0.33 -1.49 0.03 0.00 1.00 0.00 0.00 64.86 64.73 2dme h ILE 96 Cb 2.37 1.25 -0.00 0.00 -0.74 0.00 0.00 36.82 39.70 2dme h ILE 96 CO -0.00 0.22 0.12 0.03 0.00 0.00 0.00 178.15 178.52 2dme h ARG 97 N -1.00 0.00 -6.78 2.37 3.08 -0.75 -3.43 114.38 107.87 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 0.37 0.00 0.18 0.00 0.08 0.00 0.00 29.97 30.60 2dme h ARG 97 CO 0.00 0.00 -0.14 -1.33 -1.07 0.00 0.00 179.97 177.43 2dme n MET 98 N -3.74 0.46 -2.75 0.04 2.81 -0.20 -4.95 117.12 108.78 2dme n MET 98 Ca -0.00 0.20 -0.33 0.00 -1.81 0.00 0.00 57.70 55.75 2dme n MET 98 Cb 0.23 -2.01 -0.06 0.00 -0.71 0.00 0.00 33.22 30.66 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 -1.50 6.80 0.49 7.83 0.01 -1.26 -4.96 113.70 121.11 2dme s SER 99 Ca 0.70 1.75 0.28 0.00 1.31 0.00 0.00 55.95 59.98 2dme s SER 99 Cb -0.36 -2.54 1.16 0.00 0.21 0.00 0.00 66.02 64.48 2dme s SER 99 CO 0.53 -0.46 1.92 1.55 0.41 0.00 0.00 173.24 177.19 2dme h PRO 100 N 1.83 0.00 0.00 12.44 0.13 -1.94 -2.61 132.00 141.85 2dme h PRO 100 Ca -0.49 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.51 2dme h PRO 100 Cb 1.19 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.30 2dme h PRO 100 CO 0.61 0.14 -0.86 1.49 -0.23 0.00 0.00 178.00 179.15 2dme h GLU 101 N 0.00 0.00 0.07 0.86 4.81 -2.02 -3.35 114.58 114.95 2dme h GLU 101 Ca -0.00 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.08 2dme h GLU 101 Cb 0.60 0.00 0.02 0.00 0.63 0.00 0.00 28.75 30.00 2dme h GLU 101 CO 0.02 0.41 -0.63 0.93 -0.73 0.00 0.00 179.01 179.01 2dme h GLU 102 N 0.00 0.30 -1.93 1.92 5.08 -1.88 -3.09 114.58 114.98 2dme h GLU 102 Ca -0.06 -0.42 0.56 0.00 -1.00 0.00 0.00 59.36 58.44 2dme h GLU 102 Cb 1.45 0.14 -0.08 0.00 0.50 0.00 0.00 28.75 30.76 2dme h GLU 102 CO 0.06 1.15 1.39 1.28 -1.00 0.00 0.00 179.01 181.88 2dme n LEU 103 N -4.23 0.01 -0.02 1.33 4.77 -1.01 0.17 117.00 118.02 2dme n LEU 103 Ca -0.12 0.99 -0.17 0.00 -0.03 0.00 0.00 56.01 56.68 2dme n LEU 103 Cb 0.72 -0.49 -0.14 0.00 -2.33 0.00 0.00 43.42 41.17 2dme n LEU 103 CO 0.46 -0.99 -0.80 0.00 -1.33 0.00 0.00 177.39 174.73 2dme n ALA 104 N -2.89 1.13 -1.48 -1.18 0.00 -1.23 -4.88 120.51 109.97 2dme n ALA 104 Ca 0.44 -0.72 -0.42 0.00 0.00 0.00 0.00 53.44 52.74 2dme n ALA 104 Cb 1.98 -0.65 0.01 0.00 0.00 0.00 0.00 19.45 20.78 2dme n ALA 104 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2dme n SER 105 N -3.31 -0.55 -2.36 0.00 3.41 0.46 -4.90 113.62 106.36 2dme n SER 105 Ca -0.29 0.93 -0.29 0.00 -0.26 0.00 0.00 58.87 58.96 2dme n SER 105 Cb 1.05 -1.15 0.03 0.00 -0.26 0.00 0.00 64.21 63.88 2dme n SER 105 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2dme n LYS 106 N 0.51 3.28 -3.04 4.33 5.02 -1.26 -4.99 118.16 122.02 2dme n LYS 106 Ca 0.11 -4.06 -0.40 0.00 -2.02 0.00 0.00 58.31 51.95 2dme n LYS 106 Cb 0.39 -2.27 -0.05 0.00 -0.02 0.00 0.00 35.03 33.09 2dme n LYS 106 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 2dme s GLU 107 N -3.69 4.43 -0.25 1.97 2.56 -1.26 -4.96 118.70 117.50 2dme s GLU 107 Ca 0.52 0.88 -0.15 0.00 0.00 0.00 0.00 54.97 56.23 2dme s GLU 107 Cb 0.43 -3.46 -0.10 0.00 2.00 0.00 0.00 34.13 33.00 2dme s GLU 107 CO -0.12 0.04 -0.35 -0.11 -0.56 0.00 0.00 175.26 174.16 2dme n LEU 108 N 3.87 1.93 0.17 2.70 7.94 -1.26 -4.37 117.00 127.98 2dme n LEU 108 Ca -0.01 0.33 0.14 0.00 -1.11 0.00 0.00 56.01 55.37 2dme n LEU 108 Cb 0.51 -0.79 0.47 0.00 0.53 0.00 0.00 43.42 44.14 2dme n LEU 108 CO 0.47 0.36 1.13 0.00 -1.11 0.00 0.00 177.39 178.24 2dme h ALA 109 N -0.98 2.05 -0.28 1.96 0.00 -2.06 -1.58 119.26 118.36 2dme h ALA 109 Ca -0.53 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.43 2dme h ALA 109 Cb 1.45 0.02 -0.08 0.00 0.00 0.00 0.00 17.79 19.19 2dme h ALA 109 CO -0.32 -0.91 -0.47 0.00 0.00 0.00 0.00 179.25 177.55 2dme h ALA 110 N 0.78 -0.63 -2.08 0.00 0.00 -2.00 -3.42 119.26 111.92 2dme h ALA 110 Ca 0.15 0.01 -0.50 0.00 0.00 0.00 0.00 54.91 54.57 2dme h ALA 110 Cb 1.65 0.93 0.22 0.00 0.00 0.00 0.00 17.79 20.59 2dme h ALA 110 CO -0.00 -0.96 -0.40 0.91 0.00 0.00 0.00 179.25 178.80 2dme n TRP 111 N -5.42 -0.86 -4.09 0.00 5.03 -0.60 -5.04 117.44 106.46 2dme n TRP 111 Ca -0.03 0.19 -0.09 0.00 3.03 0.00 0.00 57.50 60.60 2dme n TRP 111 Cb 0.36 -1.77 -0.10 0.00 -1.03 0.00 0.00 31.31 28.76 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 -3.96 0.62 -0.16 -0.99 0.52 -1.26 -5.09 118.95 108.63 2dme s ARG 112 Ca 0.61 -1.13 -0.14 0.00 -0.52 0.00 0.00 55.73 54.55 2dme s ARG 112 Cb -0.20 0.04 -0.05 0.00 0.52 0.00 0.00 34.95 35.26 2dme s ARG 112 CO 0.65 -0.06 0.32 1.03 0.02 0.00 0.00 175.30 177.25 2dme s ARG 113 N -3.36 4.26 -0.43 3.54 0.52 -1.26 -5.06 118.95 117.17 2dme s ARG 113 Ca 0.04 0.14 -0.11 0.00 -0.52 0.00 0.00 55.73 55.27 2dme s ARG 113 Cb 0.03 -3.43 0.07 0.00 0.52 0.00 0.00 34.95 32.14 2dme s ARG 113 CO -0.06 0.21 0.30 1.03 0.02 0.00 0.00 175.30 176.80 2dme s ARG 114 N 0.55 2.74 0.30 3.54 1.81 -1.26 -4.96 118.95 121.67 2dme s ARG 114 Ca 0.18 -1.41 0.05 0.00 -1.72 0.00 0.00 55.73 52.83 2dme s ARG 114 Cb -0.13 -3.90 0.83 0.00 -0.45 0.00 0.00 34.95 31.30 2dme s ARG 114 CO 0.05 -0.97 1.48 0.45 -0.68 0.00 0.00 175.30 175.63 2dme n SER 115 N 5.02 -0.02 0.00 0.23 2.88 -1.26 -4.89 113.62 115.58 2dme n SER 115 Ca -0.11 1.59 0.00 0.00 -1.33 0.00 0.00 58.87 59.02 2dme n SER 115 Cb 0.43 -0.62 0.00 0.00 -0.75 0.00 0.00 64.21 63.27 2dme n SER 115 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dme n GLY 116 N -1.43 -1.55 3.67 0.46 0.00 -1.26 -4.86 105.19 100.22 2dme n GLY 116 Ca 0.25 -1.55 -0.42 0.00 0.00 0.00 0.00 46.02 44.29 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 0.00 4.23 -0.14 1.61 0.04 -1.26 -4.99 135.00 134.50 2dme s PRO 117 Ca 0.00 2.01 -0.26 0.00 0.04 0.00 0.00 61.00 62.79 2dme s PRO 117 Cb 0.00 -3.74 -0.02 0.00 0.04 0.00 0.00 34.50 30.78 2dme s PRO 117 CO 0.00 -0.70 0.85 -1.54 0.04 0.00 0.00 177.00 175.65 2dme s SER 118 N 2.42 7.03 0.28 6.66 1.04 -1.26 -5.05 113.70 124.82 2dme s SER 118 Ca 0.66 1.26 0.09 0.00 0.48 0.00 0.00 55.95 58.44 2dme s SER 118 Cb -0.31 -2.47 -0.04 0.00 0.10 0.00 0.00 66.02 63.30 2dme s SER 118 CO 0.26 -0.36 0.07 -0.44 0.98 0.00 0.00 173.24 173.74 2dme s SER 119 N 1.09 4.75 0.00 7.02 0.01 -1.26 -5.31 113.70 120.00 2dme s SER 119 Ca 0.41 -0.60 0.00 0.00 1.31 0.00 0.00 55.95 57.06 2dme s SER 119 Cb -0.17 -0.92 0.00 0.00 0.21 0.00 0.00 66.02 65.14 2dme s SER 119 CO 0.15 -0.08 0.00 0.61 0.41 0.00 0.00 173.24 174.33