#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dme h SER 2 N 0.00 0.00 -5.05 1.61 0.02 -2.07 -3.49 113.55 104.56 2dme h SER 2 Ca 0.00 -0.31 -0.08 0.00 -0.84 0.00 0.00 61.79 60.55 2dme h SER 2 Cb 0.00 0.00 -0.16 0.00 0.14 0.00 0.00 62.40 62.38 2dme h SER 2 CO 0.00 1.05 -0.18 -0.44 -1.14 0.00 0.00 176.83 176.12 2dme s SER 3 N -6.22 -0.19 0.00 3.07 0.01 -1.26 -4.86 113.70 104.25 2dme s SER 3 Ca -0.19 -0.12 0.00 0.00 1.31 0.00 0.00 55.95 56.94 2dme s SER 3 Cb 0.03 0.39 0.00 0.00 0.21 0.00 0.00 66.02 66.65 2dme s SER 3 CO 0.39 -0.65 0.00 0.61 0.41 0.00 0.00 173.24 174.00 2dme n GLY 4 N 0.50 -0.21 3.57 3.44 0.00 -1.26 -4.97 105.19 106.26 2dme n GLY 4 Ca -0.18 -0.72 -0.41 0.00 0.00 0.00 0.00 46.02 44.70 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 6.56 -0.47 1.61 0.15 -1.26 -4.94 113.70 115.34 2dme s SER 5 Ca 0.00 -2.02 -0.22 0.00 0.70 0.00 0.00 55.95 54.41 2dme s SER 5 Cb 0.00 -2.58 0.03 0.00 -1.71 0.00 0.00 66.02 61.77 2dme s SER 5 CO 0.00 -1.45 0.73 -0.44 1.20 0.00 0.00 173.24 173.27 2dme s SER 6 N 4.74 6.33 0.00 5.45 0.01 -1.26 -4.90 113.70 124.07 2dme s SER 6 Ca 0.53 -0.38 0.00 0.00 1.31 0.00 0.00 55.95 57.41 2dme s SER 6 Cb 0.02 -2.35 0.00 0.00 0.21 0.00 0.00 66.02 63.90 2dme s SER 6 CO 0.02 -0.91 0.00 0.61 0.41 0.00 0.00 173.24 173.38 2dme n GLY 7 N 5.06 -0.39 3.70 3.44 0.00 -1.26 -5.11 105.19 110.63 2dme n GLY 7 Ca -0.01 -0.89 -0.37 0.00 0.00 0.00 0.00 46.02 44.76 2dme n GLY 7 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dme s SER 8 N -4.00 6.34 -0.01 1.61 0.01 -1.26 -4.99 113.70 111.40 2dme s SER 8 Ca 0.00 0.39 -0.22 0.00 1.31 0.00 0.00 55.95 57.43 2dme s SER 8 Cb 0.00 -2.17 -0.21 0.00 0.21 0.00 0.00 66.02 63.85 2dme s SER 8 CO 0.00 0.05 1.14 0.00 0.41 0.00 0.00 173.24 174.84 2dme h ALA 9 N 7.08 0.10 -0.48 1.44 0.00 -1.99 -2.91 119.26 122.49 2dme h ALA 9 Ca -0.39 -0.45 0.14 0.00 0.00 0.00 0.00 54.91 54.21 2dme h ALA 9 Cb 1.16 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.93 2dme h ALA 9 CO 0.72 0.15 0.58 -0.44 0.00 0.00 0.00 179.25 180.27 2dme h ASP 10 N -0.26 0.00 0.00 0.00 5.19 -1.99 -0.79 116.42 118.57 2dme h ASP 10 Ca -0.03 0.00 -0.07 0.00 -0.62 0.00 0.00 57.03 56.31 2dme h ASP 10 Cb 0.98 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.48 2dme h ASP 10 CO 0.06 0.00 -0.43 1.56 -3.12 0.00 0.00 179.24 177.31 2dme h GLN 11 N 0.00 0.00 -0.42 3.56 7.50 -1.97 -2.74 115.11 121.03 2dme h GLN 11 Ca 0.23 0.00 0.08 0.00 0.50 0.00 0.00 58.65 59.46 2dme h GLN 11 Cb 1.39 0.00 -0.08 0.00 0.05 0.00 0.00 27.48 28.84 2dme h GLN 11 CO -0.00 0.82 -0.06 0.82 -1.50 0.00 0.00 178.83 178.91 2dme h ILE 12 N -1.00 0.62 0.30 2.54 2.04 -0.99 0.13 117.51 121.14 2dme h ILE 12 Ca -0.11 -0.02 -0.01 0.00 1.00 0.00 0.00 64.86 65.72 2dme h ILE 12 Cb 0.95 0.57 0.00 0.00 -0.74 0.00 0.00 36.82 37.60 2dme h ILE 12 CO -0.07 0.01 -0.14 0.03 0.00 0.00 0.00 178.15 177.98 2dme h ARG 13 N 0.05 -0.38 -0.45 2.37 3.08 -1.40 -2.87 114.38 114.78 2dme h ARG 13 Ca 0.21 0.03 0.09 0.00 0.07 0.00 0.00 59.98 60.38 2dme h ARG 13 Cb 0.31 0.09 -0.10 0.00 0.08 0.00 0.00 29.97 30.35 2dme h ARG 13 CO -0.40 -0.08 -0.25 0.37 -1.07 0.00 0.00 179.97 178.54 2dme h GLN 14 N -0.70 -0.15 -0.60 0.04 4.15 -1.18 -0.85 115.11 115.83 2dme h GLN 14 Ca -0.04 0.01 0.12 0.00 0.77 0.00 0.00 58.65 59.51 2dme h GLN 14 Cb 0.48 0.03 -0.10 0.00 0.21 0.00 0.00 27.48 28.11 2dme h GLN 14 CO 0.07 -0.10 0.04 1.03 -1.93 0.00 0.00 178.83 177.94 2dme h SER 15 N -0.15 -0.18 -0.58 -0.69 0.87 -0.77 -1.79 113.55 110.26 2dme h SER 15 Ca 0.21 0.14 0.10 0.00 -1.23 0.00 0.00 61.79 61.01 2dme h SER 15 Cb 0.48 0.23 -0.11 0.00 -0.44 0.00 0.00 62.40 62.56 2dme h SER 15 CO -0.54 -0.08 -0.35 0.58 -0.53 0.00 0.00 176.83 175.91 2dme h VAL 16 N 0.16 0.16 -0.51 2.23 2.07 -0.92 -1.96 116.25 117.48 2dme h VAL 16 Ca 0.32 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.89 2dme h VAL 16 Cb 0.50 0.16 -0.08 0.00 -1.52 0.00 0.00 31.29 30.36 2dme h VAL 16 CO -0.48 0.00 -0.45 0.03 0.02 0.00 0.00 177.57 176.69 2dme h ARG 17 N -0.18 -0.17 -0.70 1.57 3.08 -1.16 -1.38 114.38 115.44 2dme h ARG 17 Ca 0.22 0.01 0.08 0.00 0.07 0.00 0.00 59.98 60.37 2dme h ARG 17 Cb 0.55 0.04 -0.11 0.00 0.08 0.00 0.00 29.97 30.53 2dme h ARG 17 CO -0.67 -0.12 -0.51 1.25 -1.07 0.00 0.00 179.97 178.84 2dme h HIS 18 N -0.18 -1.58 -0.39 3.04 -0.00 -1.35 -1.66 115.15 113.03 2dme h HIS 18 Ca 0.08 0.10 0.04 0.00 -0.00 0.00 0.00 60.37 60.59 2dme h HIS 18 Cb 0.40 0.78 -0.05 0.00 -0.00 0.00 0.00 27.41 28.54 2dme h HIS 18 CO -0.83 -0.43 -0.30 1.03 -0.00 0.00 0.00 177.93 177.40 2dme h SER 19 N -0.19 -1.06 -0.85 3.26 0.87 -0.91 0.50 113.55 115.18 2dme h SER 19 Ca 0.16 0.15 0.21 0.00 -1.23 0.00 0.00 61.79 61.08 2dme h SER 19 Cb 0.53 0.46 -0.15 0.00 -0.44 0.00 0.00 62.40 62.80 2dme h SER 19 CO -0.77 -0.16 0.01 -0.07 -0.53 0.00 0.00 176.83 175.31 2dme h LEU 20 N -0.09 -0.40 -1.28 2.23 3.38 -0.76 0.93 115.31 119.31 2dme h LEU 20 Ca 0.06 0.23 -0.06 0.00 0.09 0.00 0.00 57.88 58.20 2dme h LEU 20 Cb 0.25 0.40 -0.01 0.00 0.09 0.00 0.00 40.66 41.39 2dme h LEU 20 CO -0.41 -0.24 -0.21 0.50 0.09 0.00 0.00 178.44 178.17 2dme h LYS 21 N 0.08 0.23 -0.13 1.13 3.64 0.04 -2.38 116.57 119.17 2dme h LYS 21 Ca 0.48 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.79 2dme h LYS 21 Cb 0.89 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.68 2dme h LYS 21 CO -0.76 0.43 0.08 0.22 -2.27 0.00 0.00 179.45 177.15 2dme h ASP 22 N 0.21 0.15 0.45 4.20 3.58 0.56 -0.03 116.42 125.53 2dme h ASP 22 Ca 0.04 -0.02 -0.02 0.00 0.42 0.00 0.00 57.03 57.44 2dme h ASP 22 Cb 0.49 -0.04 0.00 0.00 1.72 0.00 0.00 39.33 41.51 2dme h ASP 22 CO 0.03 0.13 -0.22 0.40 -2.88 0.00 0.00 179.24 176.70 2dme h ILE 23 N 0.16 0.00 -0.36 2.25 2.04 -1.20 -2.96 117.51 117.44 2dme h ILE 23 Ca 0.05 -0.21 0.10 0.00 1.00 0.00 0.00 64.86 65.81 2dme h ILE 23 Cb 0.00 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.07 2dme h ILE 23 CO -0.01 0.00 0.57 -0.07 0.00 0.00 0.00 178.15 178.64 2dme h LEU 24 N -0.81 0.00 -0.45 1.44 3.38 -1.49 0.47 115.31 117.85 2dme h LEU 24 Ca -0.06 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.75 2dme h LEU 24 Cb 0.46 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 2dme h LEU 24 CO 0.10 0.00 -0.43 0.24 0.09 0.00 0.00 178.44 178.44 2dme h MET 25 N 0.00 0.82 0.00 1.13 2.86 -0.84 -0.15 114.93 118.75 2dme h MET 25 Ca 0.17 -0.45 -0.18 0.00 -2.06 0.00 0.00 59.70 57.18 2dme h MET 25 Cb 1.31 0.02 -0.03 0.00 0.06 0.00 0.00 31.60 32.96 2dme h MET 25 CO -0.00 1.08 -1.18 -0.22 1.06 0.00 0.00 176.91 177.66 2dme h LYS 26 N 0.66 0.00 0.00 1.72 3.11 -0.00 -2.30 116.57 119.76 2dme h LYS 26 Ca 0.05 0.00 -0.10 0.00 -2.81 0.00 0.00 60.65 57.78 2dme h LYS 26 Cb 1.00 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 32.22 2dme h LYS 26 CO 0.10 0.49 -0.49 0.00 -2.81 0.00 0.00 179.45 176.74 2dme h ARG 27 N 0.00 0.00 0.03 1.90 2.47 -0.94 -2.56 114.38 115.28 2dme h ARG 27 Ca -0.12 0.00 -0.33 0.00 -1.26 0.00 0.00 59.98 58.27 2dme h ARG 27 Cb 1.64 0.00 -0.05 0.00 -1.65 0.00 0.00 29.97 29.91 2dme h ARG 27 CO 0.07 0.49 -1.96 1.47 0.56 0.00 0.00 179.97 180.61 2dme n LEU 28 N -3.25 1.24 0.15 3.04 -0.00 -0.07 -3.05 117.00 115.06 2dme n LEU 28 Ca 0.02 0.25 0.13 0.00 -0.00 0.00 0.00 56.01 56.41 2dme n LEU 28 Cb 0.72 -0.12 0.36 0.00 -0.00 0.00 0.00 43.42 44.38 2dme n LEU 28 CO 0.40 0.55 0.87 0.00 -0.00 0.00 0.00 177.39 179.21 2dme h THR 29 N 0.02 0.00 0.07 1.47 1.03 -1.49 -3.30 112.91 110.71 2dme h THR 29 Ca -0.39 -0.60 -0.36 0.00 -0.01 0.00 0.00 66.41 65.06 2dme h THR 29 Cb 2.06 1.58 -0.04 0.00 -1.07 0.00 0.00 68.15 70.68 2dme h THR 29 CO 0.06 0.00 -2.03 -0.67 -0.01 0.00 0.00 175.52 172.87 2dme n ASP 30 N -2.52 2.04 -3.82 0.00 -0.08 -0.96 -4.97 116.55 106.24 2dme n ASP 30 Ca 0.05 0.18 -0.30 0.00 -1.51 0.00 0.00 54.79 53.20 2dme n ASP 30 Cb 0.44 -0.78 0.23 0.00 2.34 0.00 0.00 41.12 43.34 2dme n ASP 30 CO 0.00 0.00 0.00 -0.94 0.12 0.00 0.00 177.20 176.38 2dme s SER 31 N -6.93 1.69 -0.10 1.67 1.04 -1.17 -4.89 113.70 105.00 2dme s SER 31 Ca -0.27 0.36 -0.01 0.00 0.48 0.00 0.00 55.95 56.51 2dme s SER 31 Cb 0.08 -0.43 0.02 0.00 0.10 0.00 0.00 66.02 65.78 2dme s SER 31 CO 0.68 -3.62 2.28 0.59 0.98 0.00 0.00 173.24 174.15 2dme n ASN 32 N -4.38 5.67 -4.64 7.02 4.13 -1.26 -4.86 115.26 116.95 2dme n ASN 32 Ca 0.16 -2.62 -0.36 0.00 1.68 0.00 0.00 54.58 53.44 2dme n ASN 32 Cb 0.60 -1.16 -0.10 0.00 -1.54 0.00 0.00 39.78 37.58 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 -0.57 3.95 -0.41 3.41 1.43 -1.25 -4.98 118.68 120.26 2dme s LEU 33 Ca 0.20 0.08 0.05 0.00 -1.03 0.00 0.00 54.13 53.44 2dme s LEU 33 Cb 0.13 -2.03 0.52 0.00 0.03 0.00 0.00 46.19 44.83 2dme s LEU 33 CO -0.01 0.11 1.64 1.17 0.23 0.00 0.00 176.35 179.48 2dme n LYS 34 N 3.97 2.41 -2.66 1.70 3.00 -1.26 -4.73 118.16 120.60 2dme n LYS 34 Ca -0.16 -3.35 -0.35 0.00 -0.00 0.00 0.00 58.31 54.45 2dme n LYS 34 Cb 0.52 -2.07 -0.05 0.00 0.00 0.00 0.00 35.03 33.42 2dme n LYS 34 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.40 177.54 2dme s VAL 35 N -3.85 4.00 0.39 3.15 -7.23 -1.26 -5.02 120.40 110.58 2dme s VAL 35 Ca 0.53 1.43 -0.26 0.00 -1.81 0.00 0.00 61.98 61.86 2dme s VAL 35 Cb 0.45 -3.68 -0.09 0.00 0.56 0.00 0.00 36.38 33.62 2dme s VAL 35 CO 0.02 -0.10 1.19 -2.16 -0.31 0.00 0.00 175.10 173.75 2dme s PRO 36 N -2.72 4.10 0.32 4.82 0.04 -1.26 -4.91 135.00 135.39 2dme s PRO 36 Ca 0.59 1.91 0.06 0.00 0.04 0.00 0.00 61.00 63.61 2dme s PRO 36 Cb -0.17 -2.75 0.88 0.00 0.04 0.00 0.00 34.50 32.49 2dme s PRO 36 CO 0.22 -0.30 1.60 1.49 0.04 0.00 0.00 177.00 180.05 2dme h GLU 37 N 2.78 0.08 -0.86 4.56 4.22 -2.02 0.54 114.58 123.88 2dme h GLU 37 Ca -0.49 -0.01 0.22 0.00 0.08 0.00 0.00 59.36 59.16 2dme h GLU 37 Cb 1.23 -0.02 -0.13 0.00 0.50 0.00 0.00 28.75 30.33 2dme h GLU 37 CO 0.63 0.06 0.28 1.49 -2.18 0.00 0.00 179.01 179.29 2dme h GLU 38 N 0.09 0.28 -0.10 1.92 4.57 -2.00 -2.47 114.58 116.88 2dme h GLU 38 Ca 0.64 -0.02 0.01 0.00 -1.18 0.00 0.00 59.36 58.81 2dme h GLU 38 Cb 1.42 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.94 2dme h GLU 38 CO -0.79 0.18 -0.06 1.17 -1.18 0.00 0.00 179.01 178.34 2dme n LYS 39 N -5.15 -0.04 -0.15 1.92 3.00 0.19 0.07 118.16 118.00 2dme n LYS 39 Ca 0.20 1.02 -0.09 0.00 -0.00 0.00 0.00 58.31 59.44 2dme n LYS 39 Cb 0.64 -1.52 -0.04 0.00 0.00 0.00 0.00 35.03 34.10 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 -0.83 -0.39 -0.04 3.14 0.00 -1.58 -1.70 119.26 117.87 2dme h ALA 40 Ca 0.02 0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.01 2dme h ALA 40 Cb 0.04 0.91 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 2dme h ALA 40 CO -0.09 -0.85 -0.16 0.00 0.00 0.00 0.00 179.25 178.15 2dme h ALA 41 N 0.49 -0.57 -0.92 0.00 0.00 -1.11 -1.18 119.26 115.97 2dme h ALA 41 Ca 0.15 -0.02 0.14 0.00 0.00 0.00 0.00 54.91 55.18 2dme h ALA 41 Cb 0.58 0.69 -0.15 0.00 0.00 0.00 0.00 17.79 18.91 2dme h ALA 41 CO -0.61 -0.63 -0.36 1.63 0.00 0.00 0.00 179.25 179.28 2dme n LYS 42 N -3.41 -0.22 0.02 0.00 5.02 0.11 -0.21 118.16 119.47 2dme n LYS 42 Ca -0.02 1.42 -0.11 0.00 -2.02 0.00 0.00 58.31 57.58 2dme n LYS 42 Cb 0.11 -2.11 -0.05 0.00 -0.02 0.00 0.00 35.03 32.97 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 0.26 0.07 -0.18 2.07 -0.76 -2.12 116.25 115.59 2dme h VAL 43 Ca 0.32 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.86 2dme h VAL 43 Cb 0.55 0.26 -0.04 0.00 -1.52 0.00 0.00 31.29 30.55 2dme h VAL 43 CO -0.92 0.00 -0.27 0.00 0.02 0.00 0.00 177.57 176.40 2dme h ALA 44 N 0.33 -0.43 -1.31 1.67 0.00 0.63 -0.78 119.26 119.38 2dme h ALA 44 Ca 0.08 -0.03 0.38 0.00 0.00 0.00 0.00 54.91 55.34 2dme h ALA 44 Cb 0.56 0.45 -0.06 0.00 0.00 0.00 0.00 17.79 18.75 2dme h ALA 44 CO -0.34 -0.80 0.93 1.15 0.00 0.00 0.00 179.25 180.20 2dme h THR 45 N -0.46 0.34 0.01 0.00 2.02 -0.46 0.50 112.91 114.86 2dme h THR 45 Ca 0.04 -0.01 -0.00 0.00 0.77 0.00 0.00 66.41 67.21 2dme h THR 45 Cb 0.50 0.32 0.00 0.00 -1.74 0.00 0.00 68.15 67.23 2dme h THR 45 CO -0.19 0.00 -0.00 0.11 0.37 0.00 0.00 175.52 175.82 2dme h LYS 46 N 0.02 -0.01 -0.83 6.66 6.56 -0.52 -2.97 116.57 125.48 2dme h LYS 46 Ca 0.63 0.00 0.11 0.00 -1.06 0.00 0.00 60.65 60.34 2dme h LYS 46 Cb 2.47 0.00 -0.13 0.00 -0.57 0.00 0.00 32.23 34.00 2dme h LYS 46 CO -0.03 0.86 -0.37 -0.89 -2.06 0.00 0.00 179.45 176.95 2dme n ILE 47 N -4.66 -0.47 0.18 1.86 2.08 0.15 -0.79 119.36 117.70 2dme n ILE 47 Ca -0.09 1.97 -0.13 0.00 0.56 0.00 0.00 62.75 65.05 2dme n ILE 47 Cb 0.42 -2.56 -0.08 0.00 -0.75 0.00 0.00 39.64 36.67 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 -0.45 -0.80 0.38 3.07 -1.66 0.24 114.58 115.36 2dme h GLU 48 Ca 0.25 0.03 0.27 0.00 -0.50 0.00 0.00 59.36 59.41 2dme h GLU 48 Cb 0.46 0.10 -0.15 0.00 -0.84 0.00 0.00 28.75 28.32 2dme h GLU 48 CO -0.82 -0.14 0.18 1.17 -1.40 0.00 0.00 179.01 178.01 2dme n LYS 49 N -5.16 -0.06 -0.07 2.33 4.81 0.02 -0.20 118.16 119.84 2dme n LYS 49 Ca -0.10 1.17 -0.10 0.00 -0.87 0.00 0.00 58.31 58.41 2dme n LYS 49 Cb 0.27 -1.95 -0.07 0.00 0.02 0.00 0.00 35.03 33.30 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 0.00 -0.50 1.64 4.57 -1.14 -3.31 114.58 115.84 2dme h GLU 50 Ca 0.57 0.00 0.05 0.00 -1.18 0.00 0.00 59.36 58.80 2dme h GLU 50 Cb 1.32 0.00 -0.08 0.00 -0.16 0.00 0.00 28.75 29.83 2dme h GLU 50 CO -0.70 0.57 -0.48 1.25 -1.18 0.00 0.00 179.01 178.47 2dme h LEU 51 N -1.00 -1.66 -0.88 1.64 5.85 0.13 0.26 115.31 119.65 2dme h LEU 51 Ca -0.06 0.23 0.22 0.00 0.84 0.00 0.00 57.88 59.11 2dme h LEU 51 Cb 0.69 0.70 -0.16 0.00 0.37 0.00 0.00 40.66 42.27 2dme h LEU 51 CO -0.04 -0.30 0.05 0.15 -0.34 0.00 0.00 178.44 177.96 2dme h PHE 52 N -0.23 0.01 0.73 1.25 3.57 -0.77 -1.31 116.94 120.18 2dme h PHE 52 Ca 0.08 0.06 -0.04 0.00 3.53 0.00 0.00 57.97 61.61 2dme h PHE 52 Cb 0.45 0.14 0.01 0.00 2.79 0.00 0.00 35.95 39.34 2dme h PHE 52 CO -0.81 -0.31 -0.35 1.03 -2.23 0.00 0.00 178.31 175.64 2dme h SER 53 N 0.08 -0.83 -0.08 0.41 0.87 -0.95 0.92 113.55 113.97 2dme h SER 53 Ca 0.51 0.01 0.01 0.00 -1.23 0.00 0.00 61.79 61.09 2dme h SER 53 Cb 0.99 0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 63.16 2dme h SER 53 CO -0.77 -0.47 -0.05 0.33 -0.53 0.00 0.00 176.83 175.34 2dme n PHE 54 N -5.44 -0.03 -0.16 2.24 7.35 0.66 -1.54 117.46 120.54 2dme n PHE 54 Ca -0.13 0.10 -0.10 0.00 -0.76 0.00 0.00 57.45 56.56 2dme n PHE 54 Cb 0.39 -0.49 -0.00 0.00 0.35 0.00 0.00 39.48 39.73 2dme n PHE 54 CO 0.00 0.00 0.00 0.74 -0.76 0.00 0.00 176.76 176.74 2dme h PHE 55 N 0.00 0.90 -1.81 -5.13 0.04 -1.45 -3.47 116.94 106.02 2dme h PHE 55 Ca 0.01 -0.16 -0.24 0.00 2.80 0.00 0.00 57.97 60.39 2dme h PHE 55 Cb 0.03 -0.23 -0.01 0.00 2.20 0.00 0.00 35.95 37.94 2dme h PHE 55 CO -0.92 0.87 -0.31 -2.13 -0.60 0.00 0.00 178.31 175.22 2dme n ARG 56 N -4.35 -1.16 -3.57 1.51 0.63 0.32 -4.99 116.66 105.03 2dme n ARG 56 Ca 0.00 0.57 -0.11 0.00 -0.92 0.00 0.00 57.85 57.39 2dme n ARG 56 Cb 0.32 -4.71 -0.05 0.00 0.45 0.00 0.00 32.46 28.46 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 -2.51 -0.38 -0.90 6.15 2.15 -1.24 -5.03 116.67 114.90 2dme s ASP 57 Ca 0.02 0.40 0.00 0.00 0.43 0.00 0.00 52.55 53.41 2dme s ASP 57 Cb -0.01 0.31 0.33 0.00 -0.30 0.00 0.00 42.92 43.25 2dme s ASP 57 CO 0.03 -0.36 1.65 0.35 -0.17 0.00 0.00 175.17 176.67 2dme n THR 58 N 0.71 5.13 -3.76 1.71 -2.24 -1.26 -4.54 114.28 110.02 2dme n THR 58 Ca -0.10 -5.70 -0.23 0.00 -2.27 0.00 0.00 64.05 55.74 2dme n THR 58 Cb 0.58 -1.48 0.01 0.00 -2.10 0.00 0.00 70.33 67.34 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 -0.16 2.53 -0.39 3.42 2.03 -1.26 -4.59 116.55 118.13 2dme n ASP 59 Ca 0.44 -2.69 -0.08 0.00 0.52 0.00 0.00 54.79 52.98 2dme n ASP 59 Cb 0.30 -0.08 -0.06 0.00 -0.72 0.00 0.00 41.12 40.56 2dme n ASP 59 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2dme n ALA 60 N -2.01 -0.47 -0.16 -1.67 0.00 -1.26 -1.25 120.51 113.70 2dme n ALA 60 Ca -0.15 0.84 -0.06 0.00 0.00 0.00 0.00 53.44 54.06 2dme n ALA 60 Cb 0.57 -0.21 -0.05 0.00 0.00 0.00 0.00 19.45 19.76 2dme n ALA 60 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2dme h LYS 61 N 0.00 -0.08 -0.72 0.00 1.57 -1.95 0.18 116.57 115.57 2dme h LYS 61 Ca 0.20 0.01 0.08 0.00 -1.87 0.00 0.00 60.65 59.07 2dme h LYS 61 Cb 0.43 0.02 -0.10 0.00 0.08 0.00 0.00 32.23 32.66 2dme h LYS 61 CO -0.90 -0.06 -0.37 0.98 -0.57 0.00 0.00 179.45 178.54 2dme n TYR 62 N -4.16 -0.18 0.18 -1.35 9.36 -0.38 0.06 117.16 120.70 2dme n TYR 62 Ca -0.00 0.90 -0.15 0.00 3.32 0.00 0.00 57.90 61.97 2dme n TYR 62 Cb 0.15 -0.65 -0.08 0.00 -0.63 0.00 0.00 39.34 38.14 2dme n TYR 62 CO 0.00 0.00 0.00 0.87 0.22 0.00 0.00 176.86 177.95 2dme h LYS 63 N 0.00 -0.40 -0.82 2.98 1.57 -1.03 -2.66 116.57 116.21 2dme h LYS 63 Ca 0.17 0.03 0.26 0.00 -1.87 0.00 0.00 60.65 59.24 2dme h LYS 63 Cb 0.35 0.09 -0.15 0.00 0.08 0.00 0.00 32.23 32.60 2dme h LYS 63 CO -0.70 -0.21 0.13 -1.71 -0.57 0.00 0.00 179.45 176.39 2dme n ASN 64 N -5.24 0.01 0.25 0.86 2.85 0.11 -0.41 115.26 113.69 2dme n ASN 64 Ca -0.10 1.38 -0.11 0.00 -0.11 0.00 0.00 54.58 55.64 2dme n ASN 64 Cb 0.21 -0.55 -0.05 0.00 1.24 0.00 0.00 39.78 40.63 2dme n ASN 64 CO 0.00 0.00 0.00 0.50 -2.11 0.00 0.00 177.26 175.65 2dme h LYS 65 N 0.00 -0.66 -0.80 1.20 1.63 -1.12 -2.68 116.57 114.13 2dme h LYS 65 Ca 0.55 0.05 0.12 0.00 -0.85 0.00 0.00 60.65 60.51 2dme h LYS 65 Cb 1.24 0.15 -0.13 0.00 -0.60 0.00 0.00 32.23 32.89 2dme h LYS 65 CO -0.73 -0.44 -0.41 -0.92 -3.45 0.00 0.00 179.45 173.50 2dme h TYR 66 N -1.18 -1.19 -0.71 1.91 3.20 -0.39 0.82 116.97 119.43 2dme h TYR 66 Ca -0.07 0.10 0.10 0.00 3.14 0.00 0.00 58.73 61.99 2dme h TYR 66 Cb 0.53 0.64 -0.05 0.00 1.54 0.00 0.00 36.73 39.39 2dme h TYR 66 CO 0.00 -0.40 0.47 0.07 -1.64 0.00 0.00 178.16 176.66 2dme h ARG 67 N -0.09 0.56 -0.08 1.82 0.11 -1.02 -2.07 114.38 113.60 2dme h ARG 67 Ca 0.26 -0.03 -0.03 0.00 0.10 0.00 0.00 59.98 60.28 2dme h ARG 67 Cb 0.56 -0.13 -0.00 0.00 1.11 0.00 0.00 29.97 31.51 2dme h ARG 67 CO -0.84 0.37 -0.05 1.03 0.10 0.00 0.00 179.97 180.58 2dme h SER 68 N 0.58 0.19 -0.32 0.08 0.87 0.85 0.67 113.55 116.47 2dme h SER 68 Ca 0.33 -0.44 0.07 0.00 -1.23 0.00 0.00 61.79 60.51 2dme h SER 68 Cb 0.50 -0.05 -0.08 0.00 -0.44 0.00 0.00 62.40 62.33 2dme h SER 68 CO -0.11 0.59 -0.29 -0.07 -0.53 0.00 0.00 176.83 176.42 2dme h LEU 69 N -0.21 -0.94 -0.85 2.23 3.38 -0.02 -0.69 115.31 118.21 2dme h LEU 69 Ca 0.02 0.17 -0.12 0.00 0.09 0.00 0.00 57.88 58.03 2dme h LEU 69 Cb 0.53 0.44 -0.02 0.00 0.09 0.00 0.00 40.66 41.70 2dme h LEU 69 CO 0.01 -0.31 -0.56 0.00 0.09 0.00 0.00 178.44 177.67 2dme h MET 70 N -0.26 0.04 -0.95 1.13 -0.00 -1.51 -3.26 114.93 110.12 2dme h MET 70 Ca 0.15 -0.03 0.17 0.00 -0.00 0.00 0.00 59.70 60.00 2dme h MET 70 Cb 0.51 0.00 -0.17 0.00 -0.00 0.00 0.00 31.60 31.94 2dme h MET 70 CO -0.46 0.59 -0.29 0.34 -0.00 0.00 0.00 176.91 177.09 2dme n PHE 71 N -3.87 0.22 -0.05 -0.10 7.35 0.22 -0.07 117.46 121.16 2dme n PHE 71 Ca -0.01 1.17 -0.14 0.00 -0.76 0.00 0.00 57.45 57.70 2dme n PHE 71 Cb 0.57 -0.98 -0.07 0.00 0.35 0.00 0.00 39.48 39.35 2dme n PHE 71 CO 0.00 0.00 0.00 -0.91 -0.76 0.00 0.00 176.76 175.09 2dme h ASN 72 N 0.00 0.53 -0.69 -2.13 2.35 -1.58 -1.23 115.58 112.82 2dme h ASN 72 Ca 0.41 -0.57 0.14 0.00 -0.55 0.00 0.00 56.30 55.74 2dme h ASN 72 Cb 0.65 -0.15 -0.10 0.00 0.05 0.00 0.00 38.32 38.76 2dme h ASN 72 CO -0.97 1.00 0.15 -0.07 -1.65 0.00 0.00 177.43 175.89 2dme h LEU 73 N 0.08 -0.02 -0.09 1.61 3.38 -0.54 -1.13 115.31 118.60 2dme h LEU 73 Ca 0.00 0.14 -0.25 0.00 0.09 0.00 0.00 57.88 57.86 2dme h LEU 73 Cb 0.92 0.19 0.01 0.00 0.09 0.00 0.00 40.66 41.87 2dme h LEU 73 CO 0.07 -0.03 -0.97 0.07 0.09 0.00 0.00 178.44 177.67 2dme h LYS 74 N 0.26 0.60 -4.50 1.13 2.10 -0.63 -3.46 116.57 112.07 2dme h LYS 74 Ca 0.38 -0.62 -0.63 0.00 -2.00 0.00 0.00 60.65 57.78 2dme h LYS 74 Cb 0.62 0.17 -0.01 0.00 -0.90 0.00 0.00 32.23 32.12 2dme h LYS 74 CO -0.48 1.23 0.69 -3.47 -2.00 0.00 0.00 179.45 175.42 2dme n ASP 75 N -3.83 0.78 0.00 7.07 -0.08 -0.43 -4.75 116.55 115.32 2dme n ASP 75 Ca -0.09 0.76 0.07 0.00 -1.51 0.00 0.00 54.79 54.02 2dme n ASP 75 Cb 0.85 -0.67 0.32 0.00 2.34 0.00 0.00 41.12 43.96 2dme n ASP 75 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 2dme n PRO 76 N 3.94 0.05 -0.06 -0.67 -0.04 -1.26 -2.42 135.00 134.54 2dme n PRO 76 Ca 0.30 0.23 -0.08 0.00 -0.04 0.00 0.00 63.50 63.90 2dme n PRO 76 Cb -0.04 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 31.77 2dme n PRO 76 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 2dme n LYS 77 N -1.44 0.66 -3.56 0.54 -0.00 -1.26 -4.80 118.16 108.29 2dme n LYS 77 Ca 0.04 0.12 -0.41 0.00 -0.00 0.00 0.00 58.31 58.06 2dme n LYS 77 Cb 0.15 -1.65 -0.10 0.00 -0.00 0.00 0.00 35.03 33.44 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 -5.71 5.78 -0.42 -5.58 2.47 -1.02 -4.95 114.94 105.52 2dme s ASN 78 Ca -0.07 -1.19 0.07 0.00 0.42 0.00 0.00 52.86 52.08 2dme s ASN 78 Cb 0.07 -2.04 0.43 0.00 -1.45 0.00 0.00 41.25 38.26 2dme s ASN 78 CO 0.83 -0.47 1.10 -0.46 -3.72 0.00 0.00 177.10 174.38 2dme n ASN 79 N 5.01 4.37 0.00 -4.21 6.94 -1.26 -4.65 115.26 121.46 2dme n ASN 79 Ca -0.11 -3.60 0.00 0.00 -0.02 0.00 0.00 54.58 50.84 2dme n ASN 79 Cb 0.45 -0.46 0.00 0.00 -2.36 0.00 0.00 39.78 37.41 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 -0.45 0.00 0.00 1.53 5.41 -1.26 -4.76 119.36 119.83 2dme n ILE 80 Ca 0.36 0.00 -0.02 0.00 1.00 0.00 0.00 62.75 64.09 2dme n ILE 80 Cb 0.70 -0.72 -0.01 0.00 -0.71 0.00 0.00 39.64 38.90 2dme n ILE 80 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 176.55 176.80 2dme h LEU 81 N 0.00 -0.16 -1.04 1.39 5.85 -1.88 0.22 115.31 119.69 2dme h LEU 81 Ca 0.00 0.02 0.41 0.00 0.84 0.00 0.00 57.88 59.15 2dme h LEU 81 Cb 0.65 0.06 -0.16 0.00 0.37 0.00 0.00 40.66 41.58 2dme h LEU 81 CO 0.00 -0.05 0.59 2.22 -0.34 0.00 0.00 178.44 180.86 2dme n PHE 82 N -2.80 1.03 0.04 1.25 1.16 -1.26 0.49 117.46 117.37 2dme n PHE 82 Ca -0.01 1.03 -0.13 0.00 -1.87 0.00 0.00 57.45 56.48 2dme n PHE 82 Cb 0.04 -1.44 -0.09 0.00 -1.61 0.00 0.00 39.48 36.37 2dme n PHE 82 CO 0.00 0.00 0.00 -0.22 -1.87 0.00 0.00 176.76 174.67 2dme h LYS 83 N 0.00 -0.14 -0.90 3.97 3.64 -1.52 -0.89 116.57 120.73 2dme h LYS 83 Ca 0.82 0.01 0.08 0.00 -1.27 0.00 0.00 60.65 60.29 2dme h LYS 83 Cb 2.28 0.03 -0.06 0.00 -0.41 0.00 0.00 32.23 34.07 2dme h LYS 83 CO -0.68 0.29 0.58 0.87 -2.27 0.00 0.00 179.45 178.25 2dme h LYS 84 N -0.63 0.93 0.46 1.90 1.57 0.33 0.23 116.57 121.35 2dme h LYS 84 Ca -0.01 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.69 2dme h LYS 84 Cb 0.50 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.60 2dme h LYS 84 CO 0.02 0.62 -0.22 0.28 -0.57 0.00 0.00 179.45 179.58 2dme h VAL 85 N 0.96 0.18 -0.02 0.50 2.07 -0.68 0.36 116.25 119.63 2dme h VAL 85 Ca 0.40 -0.57 0.03 0.00 0.82 0.00 0.00 66.70 67.38 2dme h VAL 85 Cb 0.30 0.29 -0.04 0.00 -1.52 0.00 0.00 31.29 30.31 2dme h VAL 85 CO -0.16 0.04 -0.22 -0.07 0.02 0.00 0.00 177.57 177.18 2dme h LEU 86 N -1.10 -0.64 -0.50 2.57 4.07 -0.98 -2.43 115.31 116.30 2dme h LEU 86 Ca -0.06 0.09 0.06 0.00 0.08 0.00 0.00 57.88 58.05 2dme h LEU 86 Cb 0.53 0.27 -0.05 0.00 1.08 0.00 0.00 40.66 42.49 2dme h LEU 86 CO 0.10 -0.28 0.22 0.50 -1.08 0.00 0.00 178.44 177.90 2dme h LYS 87 N -0.33 0.41 0.00 1.13 1.63 -0.66 -3.47 116.57 115.28 2dme h LYS 87 Ca 0.06 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.84 2dme h LYS 87 Cb 0.42 -0.09 0.00 0.00 -0.60 0.00 0.00 32.23 31.96 2dme h LYS 87 CO -0.21 0.27 0.00 0.41 -3.45 0.00 0.00 179.45 176.47 2dme n GLY 88 N -1.25 1.26 0.30 5.01 0.00 -0.42 -5.00 105.19 105.08 2dme n GLY 88 Ca 0.05 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.19 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 -0.07 -4.48 1.61 -0.58 0.95 -4.13 120.64 113.94 2dme n GLU 89 Ca 0.00 1.28 -0.34 0.00 -0.42 0.00 0.00 57.16 57.68 2dme n GLU 89 Cb 0.00 -2.03 -0.11 0.00 -0.57 0.00 0.00 31.44 28.73 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 -5.81 3.95 0.20 2.62 1.01 0.58 -4.96 120.40 117.98 2dme s VAL 90 Ca -0.11 -0.37 -0.13 0.00 0.00 0.00 0.00 61.98 61.37 2dme s VAL 90 Cb 0.25 -2.66 -0.07 0.00 0.00 0.00 0.00 36.38 33.90 2dme s VAL 90 CO 0.67 0.57 0.57 0.42 0.00 0.00 0.00 175.10 177.33 2dme s THR 91 N -0.50 4.86 -1.44 3.92 -4.23 -1.26 -4.29 115.64 112.70 2dme s THR 91 Ca 0.08 0.72 0.15 0.00 -1.18 0.00 0.00 61.69 61.46 2dme s THR 91 Cb -0.12 -3.68 0.26 0.00 1.34 0.00 0.00 72.50 70.30 2dme s THR 91 CO 0.02 0.08 1.41 -0.81 -0.54 0.00 0.00 174.62 174.78 2dme n PRO 92 N 0.34 0.21 -0.09 3.99 -0.04 -1.26 -1.38 135.00 136.78 2dme n PRO 92 Ca -0.02 0.14 -0.09 0.00 -0.04 0.00 0.00 63.50 63.49 2dme n PRO 92 Cb 0.52 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.35 2dme n PRO 92 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2dme n ASP 93 N -1.28 0.99 0.03 3.54 9.92 -1.26 -4.07 116.55 124.41 2dme n ASP 93 Ca 0.07 -0.02 -0.09 0.00 -0.53 0.00 0.00 54.79 54.23 2dme n ASP 93 Cb 0.12 0.76 -0.13 0.00 -0.64 0.00 0.00 41.12 41.22 2dme n ASP 93 CO 0.00 0.00 0.00 -0.74 0.13 0.00 0.00 177.20 176.59 2dme h HIS 94 N 0.00 0.04 -1.22 1.24 2.76 -1.90 -3.33 115.15 112.75 2dme h HIS 94 Ca -0.47 -0.03 0.36 0.00 -2.20 0.00 0.00 60.37 58.03 2dme h HIS 94 Cb 2.01 -0.00 -0.10 0.00 1.55 0.00 0.00 27.41 30.87 2dme h HIS 94 CO 0.00 1.04 0.80 1.25 -1.30 0.00 0.00 177.93 179.73 2dme h LEU 95 N 0.01 0.28 -0.03 0.26 5.85 -1.45 0.19 115.31 120.42 2dme h LEU 95 Ca -0.15 0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.63 2dme h LEU 95 Cb 1.90 0.06 0.00 0.00 0.37 0.00 0.00 40.66 42.99 2dme h LEU 95 CO 0.11 -0.04 -0.10 0.40 -0.34 0.00 0.00 178.44 178.47 2dme h ILE 96 N 0.19 1.49 -0.45 4.05 2.04 -1.83 -3.17 117.51 119.84 2dme h ILE 96 Ca 0.70 -1.58 0.13 0.00 1.00 0.00 0.00 64.86 65.11 2dme h ILE 96 Cb 2.16 2.47 -0.02 0.00 -0.74 0.00 0.00 36.82 40.69 2dme h ILE 96 CO -0.30 0.43 0.33 0.03 0.00 0.00 0.00 178.15 178.64 2dme h ARG 97 N -0.48 0.00 -6.74 2.37 3.08 -0.84 -3.43 114.38 108.35 2dme h ARG 97 Ca -0.01 0.00 -0.40 0.00 0.07 0.00 0.00 59.98 59.64 2dme h ARG 97 Cb 0.75 0.00 0.21 0.00 0.08 0.00 0.00 29.97 31.01 2dme h ARG 97 CO 0.02 0.00 -0.55 -1.33 -1.07 0.00 0.00 179.97 177.04 2dme n MET 98 N -4.35 -2.51 -4.07 0.04 2.81 -0.49 -5.01 117.12 103.54 2dme n MET 98 Ca 0.08 -0.72 -0.28 0.00 -1.81 0.00 0.00 57.70 54.96 2dme n MET 98 Cb 0.53 -1.82 -0.06 0.00 -0.71 0.00 0.00 33.22 31.16 2dme n MET 98 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 2dme s SER 99 N -2.19 5.51 0.00 7.83 0.15 -1.26 -5.00 113.70 118.74 2dme s SER 99 Ca 0.58 -0.08 0.14 0.00 0.70 0.00 0.00 55.95 57.30 2dme s SER 99 Cb -0.15 -1.45 0.61 0.00 -1.71 0.00 0.00 66.02 63.32 2dme s SER 99 CO 0.60 0.12 1.45 -0.81 1.20 0.00 0.00 173.24 175.80 2dme n PRO 100 N 0.05 0.01 -0.06 5.44 -0.04 -1.26 -1.45 135.00 137.69 2dme n PRO 100 Ca -0.08 0.25 -0.04 0.00 -0.04 0.00 0.00 63.50 63.59 2dme n PRO 100 Cb 0.53 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.34 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 -1.49 0.67 0.04 0.54 2.13 -1.26 -4.42 120.64 116.84 2dme n GLU 101 Ca 0.04 -0.01 -0.18 0.00 0.66 0.00 0.00 57.16 57.67 2dme n GLU 101 Cb 0.16 -1.57 -0.14 0.00 0.27 0.00 0.00 31.44 30.16 2dme n GLU 101 CO 0.00 0.00 0.00 1.05 -0.41 0.00 0.00 177.13 177.77 2dme h GLU 102 N 0.00 0.24 -1.04 5.31 4.11 -1.89 -3.26 114.58 118.06 2dme h GLU 102 Ca -0.35 -0.42 0.29 0.00 0.07 0.00 0.00 59.36 58.95 2dme h GLU 102 Cb 1.85 0.16 -0.13 0.00 0.50 0.00 0.00 28.75 31.13 2dme h GLU 102 CO 0.03 1.09 0.63 -0.07 0.07 0.00 0.00 179.01 180.76 2dme h LEU 103 N 0.07 0.53 0.00 3.06 3.38 -1.46 0.55 115.31 121.44 2dme h LEU 103 Ca -0.32 0.14 -0.19 0.00 0.09 0.00 0.00 57.88 57.60 2dme h LEU 103 Cb 2.04 0.07 -0.03 0.00 0.09 0.00 0.00 40.66 42.83 2dme h LEU 103 CO 0.13 -0.01 -1.03 0.00 0.09 0.00 0.00 178.44 177.62 2dme h ALA 104 N 1.73 0.52 -0.84 1.53 0.00 -1.78 -3.46 119.26 116.96 2dme h ALA 104 Ca 0.68 -0.89 -0.58 0.00 0.00 0.00 0.00 54.91 54.13 2dme h ALA 104 Cb 1.57 -0.00 0.09 0.00 0.00 0.00 0.00 17.79 19.45 2dme h ALA 104 CO -0.47 1.13 -0.38 0.45 0.00 0.00 0.00 179.25 179.98 2dme n SER 105 N -3.23 -0.90 -1.89 0.00 2.88 0.19 -4.82 113.62 105.84 2dme n SER 105 Ca -0.03 0.95 -0.10 0.00 -1.33 0.00 0.00 58.87 58.36 2dme n SER 105 Cb 0.90 -0.79 0.22 0.00 -0.75 0.00 0.00 64.21 63.79 2dme n SER 105 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2dme n LYS 106 N 0.90 2.91 -3.34 -1.46 3.00 -1.26 -4.92 118.16 113.99 2dme n LYS 106 Ca 0.15 -2.57 -0.38 0.00 -0.00 0.00 0.00 58.31 55.51 2dme n LYS 106 Cb 0.19 -2.05 -0.07 0.00 0.00 0.00 0.00 35.03 33.10 2dme n LYS 106 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.40 175.40 2dme s GLU 107 N -2.66 4.25 -0.12 1.64 2.56 -1.26 -4.96 118.70 118.16 2dme s GLU 107 Ca 0.47 0.34 -0.10 0.00 0.00 0.00 0.00 54.97 55.68 2dme s GLU 107 Cb 0.38 -3.49 -0.05 0.00 2.00 0.00 0.00 34.13 32.97 2dme s GLU 107 CO 0.11 0.04 -0.21 1.28 -0.56 0.00 0.00 175.26 175.91 2dme n LEU 108 N 4.15 1.42 -0.48 2.70 7.99 -1.26 -4.58 117.00 126.94 2dme n LEU 108 Ca -0.07 0.23 0.41 0.00 -0.01 0.00 0.00 56.01 56.57 2dme n LEU 108 Cb 0.51 -0.54 0.68 0.00 -0.11 0.00 0.00 43.42 43.96 2dme n LEU 108 CO 0.42 -0.09 1.23 0.00 -1.51 0.00 0.00 177.39 177.44 2dme n ALA 109 N -3.93 1.38 -0.28 -1.18 0.00 -1.26 -0.83 120.51 114.41 2dme n ALA 109 Ca -0.20 0.87 0.04 0.00 0.00 0.00 0.00 53.44 54.15 2dme n ALA 109 Cb 0.51 -1.07 0.09 0.00 0.00 0.00 0.00 19.45 18.98 2dme n ALA 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dme n ALA 110 N -2.53 0.13 -1.43 0.00 0.00 -1.26 -4.48 120.51 110.94 2dme n ALA 110 Ca 0.41 0.83 -0.42 0.00 0.00 0.00 0.00 53.44 54.25 2dme n ALA 110 Cb 1.58 -0.48 0.00 0.00 0.00 0.00 0.00 19.45 20.56 2dme n ALA 110 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 2dme n TRP 111 N -5.23 -0.67 -2.14 0.00 5.03 -0.01 -4.96 117.44 109.46 2dme n TRP 111 Ca 0.11 0.65 -0.27 0.00 3.03 0.00 0.00 57.50 61.03 2dme n TRP 111 Cb 0.37 -1.97 0.09 0.00 -1.03 0.00 0.00 31.31 28.77 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 -1.42 1.93 0.11 -0.99 0.52 -1.26 -5.09 118.95 112.75 2dme s ARG 112 Ca 0.62 -0.27 0.05 0.00 -0.52 0.00 0.00 55.73 55.61 2dme s ARG 112 Cb -0.65 -2.10 -0.04 0.00 0.52 0.00 0.00 34.95 32.68 2dme s ARG 112 CO 0.59 -1.46 0.03 -0.98 0.02 0.00 0.00 175.30 173.50 2dme s ARG 113 N -5.38 2.61 -0.58 3.54 1.70 -1.26 -5.08 118.95 114.50 2dme s ARG 113 Ca 0.63 -0.87 -0.13 0.00 -0.47 0.00 0.00 55.73 54.88 2dme s ARG 113 Cb -0.10 -2.55 0.15 0.00 -0.57 0.00 0.00 34.95 31.88 2dme s ARG 113 CO 0.46 0.52 0.51 1.03 -1.08 0.00 0.00 175.30 176.74 2dme s ARG 114 N -2.55 2.95 -0.38 3.89 0.52 -1.26 -5.03 118.95 117.09 2dme s ARG 114 Ca 0.27 -1.90 -0.28 0.00 -0.52 0.00 0.00 55.73 53.30 2dme s ARG 114 Cb -0.11 -4.20 -0.01 0.00 0.52 0.00 0.00 34.95 31.15 2dme s ARG 114 CO 0.20 -1.28 1.62 -1.54 0.02 0.00 0.00 175.30 174.32 2dme s SER 115 N 2.96 6.07 0.00 0.23 1.04 -1.26 -4.80 113.70 117.94 2dme s SER 115 Ca 0.07 1.04 0.00 0.00 0.48 0.00 0.00 55.95 57.54 2dme s SER 115 Cb -0.25 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.34 2dme s SER 115 CO -0.00 -1.61 0.00 0.61 0.98 0.00 0.00 173.24 173.21 2dme n GLY 116 N 5.28 -0.50 3.56 7.32 0.00 -1.26 -5.06 105.19 114.53 2dme n GLY 116 Ca 0.20 -1.03 -0.31 0.00 0.00 0.00 0.00 46.02 44.88 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 -1.91 2.58 0.33 1.61 0.04 -1.26 -4.95 135.00 131.43 2dme s PRO 117 Ca 0.00 0.00 0.05 0.00 0.04 0.00 0.00 61.00 61.09 2dme s PRO 117 Cb 0.00 -4.84 0.06 0.00 0.04 0.00 0.00 34.50 29.75 2dme s PRO 117 CO 0.00 -3.17 0.45 -1.13 0.04 0.00 0.00 177.00 173.20 2dme n SER 118 N 13.58 1.14 -3.91 6.66 3.41 -1.26 -5.15 113.62 128.09 2dme n SER 118 Ca 0.34 -1.84 -0.09 0.00 -0.26 0.00 0.00 58.87 57.02 2dme n SER 118 Cb 0.49 -0.24 -0.04 0.00 -0.26 0.00 0.00 64.21 64.15 2dme n SER 118 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2dme s SER 119 N -3.01 -0.17 0.00 4.04 0.01 -1.26 -5.27 113.70 108.03 2dme s SER 119 Ca 0.34 -0.75 0.00 0.00 1.31 0.00 0.00 55.95 56.85 2dme s SER 119 Cb -0.03 0.62 0.00 0.00 0.21 0.00 0.00 66.02 66.82 2dme s SER 119 CO 0.22 -1.17 0.00 0.61 0.41 0.00 0.00 173.24 173.30