#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gsl n LYS 8 N 0.00 0.41 0.01 -1.46 3.00 -1.26 -4.98 118.16 113.88 2gsl n LYS 8 Ca 0.00 -2.95 -0.12 0.00 -0.00 0.00 0.00 58.31 55.24 2gsl n LYS 8 Cb 0.00 -0.35 -0.09 0.00 0.00 0.00 0.00 35.03 34.58 2gsl n LYS 8 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.40 176.96 2gsl h ASP 9 N -0.10 -0.09 0.00 3.14 5.19 -1.97 -3.10 116.42 119.50 2gsl h ASP 9 Ca -0.28 -0.52 0.00 0.00 -0.62 0.00 0.00 57.03 55.61 2gsl h ASP 9 Cb 1.22 0.02 0.00 0.00 0.18 0.00 0.00 39.33 40.75 2gsl h ASP 9 CO 0.37 0.53 0.00 2.30 -3.12 0.00 0.00 179.24 179.32 2gsl n ILE 10 N -4.84 0.00 0.00 0.35 -5.35 -1.26 -3.17 119.36 105.09 2gsl n ILE 10 Ca -0.08 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.40 2gsl n ILE 10 Cb 0.30 -0.20 0.00 0.00 -1.74 0.00 0.00 39.64 38.00 2gsl n ILE 10 CO 0.00 0.00 0.00 -1.14 -1.76 0.00 0.00 176.55 173.65 2gsl n ARG 11 N -0.48 0.00 -2.69 6.28 0.63 -1.18 -4.98 116.66 114.24 2gsl n ARG 11 Ca 0.00 0.01 -0.03 0.00 -0.92 0.00 0.00 57.85 56.91 2gsl n ARG 11 Cb 0.00 -0.36 0.12 0.00 0.45 0.00 0.00 32.46 32.67 2gsl n ARG 11 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2gsl n ASP 12 N -2.19 -1.16 -4.05 6.15 8.00 -1.18 -5.01 116.55 117.11 2gsl n ASP 12 Ca 0.00 -2.25 -0.34 0.00 0.71 0.00 0.00 54.79 52.91 2gsl n ASP 12 Cb 0.00 0.59 -0.11 0.00 -0.02 0.00 0.00 41.12 41.59 2gsl n ASP 12 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2gsl s TYR 13 N -0.33 3.34 0.99 1.24 4.12 -1.19 -5.03 117.35 120.49 2gsl s TYR 13 Ca 0.13 -2.87 -0.11 0.00 0.02 0.00 0.00 57.07 54.24 2gsl s TYR 13 Cb 0.43 -3.08 0.19 0.00 -1.52 0.00 0.00 41.96 37.98 2gsl s TYR 13 CO -0.11 -0.81 1.10 -1.54 0.02 0.00 0.00 175.55 174.21 2gsl s SER 14 N 0.34 2.36 0.27 2.29 1.04 -1.26 -4.80 113.70 113.93 2gsl s SER 14 Ca 0.17 1.87 -0.01 0.00 0.48 0.00 0.00 55.95 58.46 2gsl s SER 14 Cb -0.22 -2.43 0.36 0.00 0.10 0.00 0.00 66.02 63.83 2gsl s SER 14 CO -0.02 -3.40 1.77 1.23 0.98 0.00 0.00 173.24 173.79 2gsl h GLY 15 N -2.07 0.81 1.73 7.32 0.00 -1.96 -2.06 103.07 106.83 2gsl h GLY 15 Ca -0.50 -0.54 -0.11 0.00 0.00 0.00 0.00 47.33 46.18 2gsl h GLY 15 CO 0.46 0.50 -0.39 -2.00 0.00 0.00 0.00 176.54 175.12 2gsl h LEU 16 N 0.70 0.32 -0.86 3.11 5.85 -1.94 -1.61 115.31 120.87 2gsl h LEU 16 Ca 0.14 -0.13 -0.12 0.00 0.84 0.00 0.00 57.88 58.61 2gsl h LEU 16 Cb 0.46 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.38 2gsl h LEU 16 CO 0.02 0.68 -0.56 -0.33 -0.34 0.00 0.00 178.44 177.91 2gsl h GLU 17 N 0.26 0.02 -0.00 1.25 5.08 -1.81 -1.96 114.58 117.42 2gsl h GLU 17 Ca 0.03 -0.01 -0.14 0.00 -1.00 0.00 0.00 59.36 58.23 2gsl h GLU 17 Cb 0.80 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.04 2gsl h GLU 17 CO 0.06 0.58 -0.68 -0.07 -1.00 0.00 0.00 179.01 177.90 2gsl h LEU 18 N 0.02 0.00 -0.09 1.33 3.38 -0.87 -3.02 115.31 116.05 2gsl h LEU 18 Ca -0.01 -0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.72 2gsl h LEU 18 Cb 1.00 -0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.76 2gsl h LEU 18 CO 0.07 0.68 -1.01 0.00 0.09 0.00 0.00 178.44 178.28 2gsl h ALA 19 N 1.32 0.27 -0.56 1.53 0.00 -1.07 -0.52 119.26 120.22 2gsl h ALA 19 Ca -0.01 -0.72 0.07 0.00 0.00 0.00 0.00 54.91 54.25 2gsl h ALA 19 Cb 1.21 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.95 2gsl h ALA 19 CO 0.09 0.79 0.25 0.35 0.00 0.00 0.00 179.25 180.73 2gsl h PHE 20 N 0.26 0.46 -0.20 0.00 3.57 -1.32 0.89 116.94 120.59 2gsl h PHE 20 Ca -0.10 0.02 -0.18 0.00 3.53 0.00 0.00 57.97 61.25 2gsl h PHE 20 Cb 1.66 -0.12 -0.00 0.00 2.79 0.00 0.00 35.95 40.27 2gsl h PHE 20 CO 0.07 0.18 -0.59 1.25 -2.23 0.00 0.00 178.31 176.99 2gsl h LEU 21 N 0.48 0.74 -0.56 0.59 5.85 -1.51 -3.18 115.31 117.71 2gsl h LEU 21 Ca 0.27 -0.41 -0.00 0.00 0.84 0.00 0.00 57.88 58.57 2gsl h LEU 21 Cb 0.24 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.04 2gsl h LEU 21 CO -0.22 1.16 0.33 1.23 -0.34 0.00 0.00 178.44 180.60 2gsl h GLY 22 N 0.93 0.82 2.00 3.75 0.00 0.57 -1.83 103.07 109.31 2gsl h GLY 22 Ca -0.00 -0.35 -0.00 0.00 0.00 0.00 0.00 47.33 46.98 2gsl h GLY 22 CO 0.12 0.33 -0.00 -1.80 0.00 0.00 0.00 176.54 175.19 2gsl h ASP 23 N 0.76 0.00 0.22 0.19 3.58 0.74 -0.29 116.42 121.62 2gsl h ASP 23 Ca 0.20 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.64 2gsl h ASP 23 Cb -0.01 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.05 2gsl h ASP 23 CO -0.04 0.00 -0.11 0.00 -2.88 0.00 0.00 179.24 176.22 2gsl h ALA 24 N 2.00 -0.30 -0.65 -0.78 0.00 -1.41 -2.53 119.26 115.59 2gsl h ALA 24 Ca -0.00 -0.13 0.12 0.00 0.00 0.00 0.00 54.91 54.90 2gsl h ALA 24 Cb 0.00 0.12 -0.12 0.00 0.00 0.00 0.00 17.79 17.79 2gsl h ALA 24 CO 0.00 -0.30 -0.27 0.82 0.00 0.00 0.00 179.25 179.51 2gsl h ILE 25 N -1.04 0.22 -0.49 0.00 2.04 -1.06 -0.12 117.51 117.06 2gsl h ILE 25 Ca -0.03 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.90 2gsl h ILE 25 Cb 0.35 0.22 -0.06 0.00 -0.74 0.00 0.00 36.82 36.60 2gsl h ILE 25 CO 0.05 0.00 0.18 -0.25 0.00 0.00 0.00 178.15 178.13 2gsl h TRP 26 N -0.09 0.31 0.04 1.37 2.91 -1.15 -1.14 115.95 118.20 2gsl h TRP 26 Ca 0.28 0.02 0.01 0.00 1.13 0.00 0.00 58.89 60.34 2gsl h TRP 26 Cb 0.54 -0.07 -0.02 0.00 -0.51 0.00 0.00 29.16 29.10 2gsl h TRP 26 CO -0.61 0.10 -0.11 0.93 -1.03 0.00 0.00 178.44 177.72 2gsl h GLU 27 N 0.35 -0.20 -0.48 2.65 4.39 -0.63 -0.40 114.58 120.26 2gsl h GLU 27 Ca 0.24 0.01 0.09 0.00 0.34 0.00 0.00 59.36 60.04 2gsl h GLU 27 Cb 0.25 0.05 -0.08 0.00 -0.10 0.00 0.00 28.75 28.87 2gsl h GLU 27 CO -0.24 -0.13 0.04 1.25 -1.16 0.00 0.00 179.01 178.76 2gsl h LEU 28 N -0.21 -0.13 -0.50 1.33 5.85 -0.48 0.52 115.31 121.69 2gsl h LEU 28 Ca 0.03 0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.84 2gsl h LEU 28 Cb 0.24 0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.42 2gsl h LEU 28 CO -0.09 -0.03 0.24 -0.33 -0.34 0.00 0.00 178.44 177.89 2gsl h GLU 29 N 0.15 0.72 -0.32 1.25 4.39 -0.87 -0.47 114.58 119.44 2gsl h GLU 29 Ca 0.24 -0.11 -0.15 0.00 0.34 0.00 0.00 59.36 59.69 2gsl h GLU 29 Cb 0.35 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.86 2gsl h GLU 29 CO -0.37 0.60 -0.40 0.82 -1.16 0.00 0.00 179.01 178.50 2gsl h ILE 30 N 0.67 1.29 -0.44 3.13 1.08 -0.33 -2.53 117.51 120.38 2gsl h ILE 30 Ca 0.17 -1.58 -0.06 0.00 -0.39 0.00 0.00 64.86 63.00 2gsl h ILE 30 Cb 0.12 1.47 -0.02 0.00 -3.07 0.00 0.00 36.82 35.32 2gsl h ILE 30 CO -0.02 0.51 0.03 0.03 -0.69 0.00 0.00 178.15 178.01 2gsl h ARG 31 N 0.62 0.75 -0.35 2.37 3.08 -0.78 -2.85 114.38 117.22 2gsl h ARG 31 Ca 0.05 -0.22 -0.02 0.00 0.07 0.00 0.00 59.98 59.85 2gsl h ARG 31 Cb 0.96 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.91 2gsl h ARG 31 CO 0.09 0.80 0.11 -0.22 -1.07 0.00 0.00 179.97 179.68 2gsl h LYS 32 N 0.60 0.49 0.14 0.04 3.64 -1.05 -2.10 116.57 118.33 2gsl h LYS 32 Ca 0.13 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.43 2gsl h LYS 32 Cb 0.44 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.17 2gsl h LYS 32 CO 0.02 0.44 -0.07 -0.92 -2.27 0.00 0.00 179.45 176.65 2gsl h TYR 33 N 0.49 -0.18 0.00 1.91 5.03 -1.24 -3.25 116.97 119.74 2gsl h TYR 33 Ca 0.12 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.43 2gsl h TYR 33 Cb 0.15 0.06 0.00 0.00 1.55 0.00 0.00 36.73 38.49 2gsl h TYR 33 CO 0.01 0.25 0.00 0.66 -1.32 0.00 0.00 178.16 177.76 2gsl n TYR 34 N -4.96 0.01 0.84 -3.82 4.01 -1.09 -2.88 117.16 109.27 2gsl n TYR 34 Ca -0.09 0.00 0.14 0.00 -0.16 0.00 0.00 57.90 57.79 2gsl n TYR 34 Cb 0.26 -0.50 0.52 0.00 -0.31 0.00 0.00 39.34 39.31 2gsl n TYR 34 CO 0.00 0.00 0.00 -0.11 -0.46 0.00 0.00 176.86 176.29 2gsl n LEU 35 N -1.51 0.35 -0.19 7.72 7.94 -0.79 -3.37 117.00 127.16 2gsl n LEU 35 Ca 0.05 0.53 0.13 0.00 -1.11 0.00 0.00 56.01 55.61 2gsl n LEU 35 Cb 0.26 -0.42 0.66 0.00 0.53 0.00 0.00 43.42 44.45 2gsl n LEU 35 CO 0.21 -0.07 0.94 0.00 -1.11 0.00 0.00 177.39 177.35 2gsl n GLN 36 N -1.82 1.26 -0.01 1.96 10.64 -1.14 -3.93 117.38 124.33 2gsl n GLN 36 Ca 0.06 -0.38 0.08 0.00 -1.83 0.00 0.00 57.00 54.94 2gsl n GLN 36 Cb 0.38 -1.42 -0.14 0.00 -0.86 0.00 0.00 30.24 28.19 2gsl n GLN 36 CO 0.00 0.00 0.00 1.19 -1.83 0.00 0.00 177.06 176.42 2gsl n PHE 37 N -0.48 0.00 -1.55 2.61 3.72 -1.22 -5.02 117.46 115.52 2gsl n PHE 37 Ca 0.19 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.59 2gsl n PHE 37 Cb 0.19 -0.45 0.00 0.00 -0.94 0.00 0.00 39.48 38.28 2gsl n PHE 37 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2gsl n GLY 38 N 1.47 0.75 3.88 1.37 0.00 -1.25 -5.07 105.19 106.33 2gsl n GLY 38 Ca -0.05 -0.40 -0.31 0.00 0.00 0.00 0.00 46.02 45.26 2gsl n GLY 38 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2gsl s TYR 39 N -2.54 3.44 0.79 1.61 1.51 -1.26 -5.07 117.35 115.83 2gsl s TYR 39 Ca 0.00 0.91 -0.11 0.00 -1.01 0.00 0.00 57.07 56.86 2gsl s TYR 39 Cb 0.00 -2.30 0.07 0.00 -0.11 0.00 0.00 41.96 39.61 2gsl s TYR 39 CO 0.00 0.13 1.09 0.54 -1.11 0.00 0.00 175.55 176.20 2gsl s ASN 40 N -2.72 4.41 0.16 2.29 6.03 -1.26 -4.71 114.94 119.14 2gsl s ASN 40 Ca 0.48 1.65 -0.17 0.00 -1.03 0.00 0.00 52.86 53.79 2gsl s ASN 40 Cb -0.11 -2.38 0.07 0.00 -3.03 0.00 0.00 41.25 35.80 2gsl s ASN 40 CO 0.25 -2.07 1.68 0.40 -2.03 0.00 0.00 177.10 175.33 2gsl h ILE 41 N -1.15 0.65 -0.43 0.54 1.08 -1.98 0.53 117.51 116.75 2gsl h ILE 41 Ca -0.45 -0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.03 2gsl h ILE 41 Cb 1.24 0.64 -0.03 0.00 -3.07 0.00 0.00 36.82 35.60 2gsl h ILE 41 CO 0.54 0.00 0.27 1.55 -0.69 0.00 0.00 178.15 179.82 2gsl h PRO 42 N 0.01 0.52 -0.50 2.37 0.13 -1.99 0.11 132.00 132.65 2gsl h PRO 42 Ca 0.17 -0.03 -0.07 0.00 -0.87 0.00 0.00 66.00 65.21 2gsl h PRO 42 Cb 0.26 -0.12 -0.02 0.00 0.13 0.00 0.00 31.00 31.26 2gsl h PRO 42 CO -0.37 0.35 0.06 1.15 -0.23 0.00 0.00 178.00 178.96 2gsl h THR 43 N 0.54 1.25 -0.65 1.56 2.02 -1.87 -1.25 112.91 114.51 2gsl h THR 43 Ca 0.17 -0.98 0.08 0.00 0.77 0.00 0.00 66.41 66.45 2gsl h THR 43 Cb -0.02 0.91 -0.07 0.00 -1.74 0.00 0.00 68.15 67.23 2gsl h THR 43 CO -0.06 0.35 0.31 0.25 0.37 0.00 0.00 175.52 176.74 2gsl h LEU 44 N 0.73 0.40 -0.35 2.58 5.85 -0.55 -1.80 115.31 122.17 2gsl h LEU 44 Ca 0.15 0.06 -0.06 0.00 0.84 0.00 0.00 57.88 58.87 2gsl h LEU 44 Cb 0.44 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.44 2gsl h LEU 44 CO 0.01 0.24 -0.00 0.78 -0.34 0.00 0.00 178.44 179.13 2gsl h ASN 45 N 0.55 0.60 -0.68 1.25 4.21 -0.52 -2.27 115.58 118.72 2gsl h ASN 45 Ca 0.32 -0.31 0.09 0.00 1.21 0.00 0.00 56.30 57.61 2gsl h ASN 45 Cb 0.32 -0.16 -0.04 0.00 -1.12 0.00 0.00 38.32 37.31 2gsl h ASN 45 CO -0.25 0.77 0.45 0.50 -1.29 0.00 0.00 177.43 177.60 2gsl h LYS 46 N 0.42 0.54 0.35 0.81 3.64 -0.70 0.31 116.57 121.95 2gsl h LYS 46 Ca 0.10 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.43 2gsl h LYS 46 Cb 0.46 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.16 2gsl h LYS 46 CO 0.02 0.36 -0.17 1.88 -2.27 0.00 0.00 179.45 179.27 2gsl h TYR 47 N 0.56 -0.43 -0.94 1.91 0.99 -1.14 -2.89 116.97 115.03 2gsl h TYR 47 Ca 0.31 -0.01 0.16 0.00 2.00 0.00 0.00 58.73 61.19 2gsl h TYR 47 Cb 0.47 0.14 -0.08 0.00 1.00 0.00 0.00 36.73 38.27 2gsl h TYR 47 CO -0.00 -0.27 0.60 -0.24 -0.00 0.00 0.00 178.16 178.25 2gsl h VAL 48 N -1.04 0.80 -0.66 -2.88 3.04 -1.28 -0.79 116.25 113.43 2gsl h VAL 48 Ca -0.05 -0.25 -0.05 0.00 -1.01 0.00 0.00 66.70 65.35 2gsl h VAL 48 Cb 0.36 0.02 -0.03 0.00 -2.01 0.00 0.00 31.29 29.63 2gsl h VAL 48 CO 0.08 0.13 0.23 0.50 -1.01 0.00 0.00 177.57 177.50 2gsl h LYS 49 N 0.72 0.99 0.00 4.17 1.63 -1.01 -0.49 116.57 122.58 2gsl h LYS 49 Ca 0.49 -0.18 0.00 0.00 -0.85 0.00 0.00 60.65 60.10 2gsl h LYS 49 Cb 0.79 -0.16 0.00 0.00 -0.60 0.00 0.00 32.23 32.26 2gsl h LYS 49 CO -0.25 0.83 0.00 0.00 -3.45 0.00 0.00 179.45 176.59 2gsl n ALA 50 N -2.45 1.64 0.22 5.00 0.00 -0.31 -2.42 120.51 122.19 2gsl n ALA 50 Ca 0.06 0.06 0.04 0.00 0.00 0.00 0.00 53.44 53.59 2gsl n ALA 50 Cb 0.20 -1.35 -0.06 0.00 0.00 0.00 0.00 19.45 18.24 2gsl n ALA 50 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2gsl n LYS 51 N -2.06 2.43 0.00 0.00 4.76 -0.92 -4.57 118.16 117.81 2gsl n LYS 51 Ca 0.02 -0.04 0.11 0.00 -2.87 0.00 0.00 58.31 55.54 2gsl n LYS 51 Cb 0.21 -1.04 0.03 0.00 -1.84 0.00 0.00 35.03 32.39 2gsl n LYS 51 CO 0.00 0.00 0.00 1.55 -1.37 0.00 0.00 177.40 177.58 2gsl n VAL 52 N -1.47 0.00 -2.68 -0.18 3.14 -0.24 -4.55 118.33 112.35 2gsl n VAL 52 Ca 0.00 -0.36 -0.32 0.00 -2.96 0.00 0.00 64.34 60.70 2gsl n VAL 52 Cb 0.18 1.34 -0.05 0.00 -1.06 0.00 0.00 33.84 34.25 2gsl n VAL 52 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 2gsl s ASN 53 N -2.19 6.72 0.13 6.55 2.20 -1.02 -4.93 114.94 122.40 2gsl s ASN 53 Ca 0.21 1.51 -0.33 0.00 -0.94 0.00 0.00 52.86 53.31 2gsl s ASN 53 Cb 0.18 -2.48 -0.10 0.00 -2.00 0.00 0.00 41.25 36.85 2gsl s ASN 53 CO 0.44 -0.45 1.55 0.00 -2.94 0.00 0.00 177.10 175.71 2gsl h ALA 54 N 1.42 -0.77 -0.59 3.54 0.00 -1.93 -2.34 119.26 118.58 2gsl h ALA 54 Ca -0.48 -0.00 0.08 0.00 0.00 0.00 0.00 54.91 54.51 2gsl h ALA 54 Cb 1.18 1.11 -0.10 0.00 0.00 0.00 0.00 17.79 19.97 2gsl h ALA 54 CO 0.62 -1.05 -0.47 0.87 0.00 0.00 0.00 179.25 179.22 2gsl h LYS 55 N -0.41 -0.23 -0.78 0.00 1.57 -1.90 0.14 116.57 114.97 2gsl h LYS 55 Ca 0.07 0.02 0.06 0.00 -1.87 0.00 0.00 60.65 58.93 2gsl h LYS 55 Cb 0.60 0.05 -0.06 0.00 0.08 0.00 0.00 32.23 32.91 2gsl h LYS 55 CO -0.58 -0.15 0.46 -0.92 -0.57 0.00 0.00 179.45 177.69 2gsl h TYR 56 N -0.23 0.85 -0.67 -1.35 5.03 -1.78 -1.06 116.97 117.76 2gsl h TYR 56 Ca 0.16 0.03 -0.02 0.00 2.58 0.00 0.00 58.73 61.48 2gsl h TYR 56 Cb 0.56 -0.27 -0.03 0.00 1.55 0.00 0.00 36.73 38.54 2gsl h TYR 56 CO -0.75 0.41 0.33 1.96 -1.32 0.00 0.00 178.16 178.80 2gsl h GLN 57 N 0.84 0.96 -0.39 1.82 4.20 -0.70 -2.36 115.11 119.48 2gsl h GLN 57 Ca 0.35 -0.14 0.08 0.00 0.06 0.00 0.00 58.65 59.00 2gsl h GLN 57 Cb 0.20 -0.18 -0.09 0.00 0.30 0.00 0.00 27.48 27.72 2gsl h GLN 57 CO -0.19 0.75 -0.20 1.03 -0.67 0.00 0.00 178.83 179.56 2gsl h SER 58 N 0.93 -0.68 -0.85 1.46 0.87 0.51 -0.17 113.55 115.62 2gsl h SER 58 Ca 0.23 0.15 0.01 0.00 -1.23 0.00 0.00 61.79 60.96 2gsl h SER 58 Cb 0.10 0.36 -0.04 0.00 -0.44 0.00 0.00 62.40 62.38 2gsl h SER 58 CO -0.03 -0.23 0.56 0.25 -0.53 0.00 0.00 176.83 176.85 2gsl h LEU 59 N -0.13 0.97 -1.20 2.23 5.85 -1.06 -1.50 115.31 120.47 2gsl h LEU 59 Ca 0.19 -0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.81 2gsl h LEU 59 Cb 0.43 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 2gsl h LEU 59 CO -0.47 0.70 -0.26 0.40 -0.34 0.00 0.00 178.44 178.46 2gsl h ILE 60 N 1.14 1.24 0.82 4.05 1.08 -0.63 -1.82 117.51 123.39 2gsl h ILE 60 Ca 0.31 -1.12 -0.04 0.00 -0.39 0.00 0.00 64.86 63.62 2gsl h ILE 60 Cb -0.12 1.44 0.01 0.00 -3.07 0.00 0.00 36.82 35.08 2gsl h ILE 60 CO -0.07 0.34 -0.39 0.22 -0.69 0.00 0.00 178.15 177.55 2gsl h TYR 61 N 0.20 -1.02 -0.18 1.37 -0.00 -0.07 -2.86 116.97 114.41 2gsl h TYR 61 Ca 0.03 -0.02 0.05 0.00 -0.00 0.00 0.00 58.73 58.79 2gsl h TYR 61 Cb 0.58 0.34 -0.01 0.00 -0.00 0.00 0.00 36.73 37.64 2gsl h TYR 61 CO 0.01 -0.64 0.19 0.87 -0.00 0.00 0.00 178.16 178.59 2gsl h LYS 62 N -1.26 0.00 0.00 1.82 1.57 -1.37 -0.90 116.57 116.43 2gsl h LYS 62 Ca -0.11 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.62 2gsl h LYS 62 Cb 0.84 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.15 2gsl h LYS 62 CO 0.18 0.00 -0.20 -0.22 -0.57 0.00 0.00 179.45 178.64 2gsl h LYS 63 N 0.00 0.00 0.00 3.15 1.63 -1.12 -3.36 116.57 116.87 2gsl h LYS 63 Ca 0.08 0.00 -0.08 0.00 -0.85 0.00 0.00 60.65 59.81 2gsl h LYS 63 Cb 0.46 0.00 -0.17 0.00 -0.60 0.00 0.00 32.23 31.92 2gsl h LYS 63 CO -0.00 0.20 -0.72 0.44 -3.45 0.00 0.00 179.45 175.92 2gsl n ILE 64 N -3.21 0.10 -0.01 2.00 -6.64 -0.80 -4.90 119.36 105.90 2gsl n ILE 64 Ca 0.02 -0.57 -0.17 0.00 -1.77 0.00 0.00 62.75 60.26 2gsl n ILE 64 Cb 0.53 0.68 -0.10 0.00 -1.44 0.00 0.00 39.64 39.31 2gsl n ILE 64 CO 0.00 0.00 0.00 -0.29 -1.77 0.00 0.00 176.55 174.49 2gsl h ILE 65 N 6.69 1.41 0.36 7.28 6.09 -1.34 -3.28 117.51 134.72 2gsl h ILE 65 Ca -0.10 -1.99 -0.02 0.00 -1.37 0.00 0.00 64.86 61.38 2gsl h ILE 65 Cb 1.60 2.48 0.00 0.00 0.47 0.00 0.00 36.82 41.37 2gsl h ILE 65 CO 0.04 0.58 -0.17 0.78 -3.07 0.00 0.00 178.15 176.32 2gsl h ASN 66 N -0.05 -0.41 0.28 2.19 2.35 -1.86 -2.84 115.58 115.25 2gsl h ASN 66 Ca -0.06 -0.09 0.00 0.00 -0.55 0.00 0.00 56.30 55.60 2gsl h ASN 66 Cb 1.25 0.11 0.00 0.00 0.05 0.00 0.00 38.32 39.73 2gsl h ASN 66 CO 0.11 -0.15 0.00 0.47 -1.65 0.00 0.00 177.43 176.21 2gsl n ASP 67 N -5.22 0.00 -4.75 5.81 10.43 -1.26 -4.75 116.55 116.80 2gsl n ASP 67 Ca -0.10 0.44 -0.32 0.00 2.57 0.00 0.00 54.79 57.38 2gsl n ASP 67 Cb 0.25 -0.46 0.09 0.00 1.84 0.00 0.00 41.12 42.84 2gsl n ASP 67 CO 0.00 0.00 0.00 -0.22 -1.07 0.00 0.00 177.20 175.91 2gsl s LEU 68 N -2.92 3.12 0.41 0.64 2.96 -1.07 -4.99 118.68 116.83 2gsl s LEU 68 Ca 0.05 1.95 -0.24 0.00 -0.22 0.00 0.00 54.13 55.67 2gsl s LEU 68 Cb 0.06 -4.54 -0.09 0.00 0.50 0.00 0.00 46.19 42.13 2gsl s LEU 68 CO 0.16 -2.08 1.09 -1.81 -1.32 0.00 0.00 176.35 172.39 2gsl s ASP 69 N -3.01 6.60 0.21 3.68 1.01 -1.26 -4.81 116.67 119.08 2gsl s ASP 69 Ca 0.64 2.15 -0.18 0.00 0.71 0.00 0.00 52.55 55.87 2gsl s ASP 69 Cb -0.19 -2.59 0.19 0.00 1.01 0.00 0.00 42.92 41.33 2gsl s ASP 69 CO 0.52 -0.61 1.57 -0.33 0.21 0.00 0.00 175.17 176.53 2gsl h GLU 70 N 2.44 -0.08 -0.90 8.23 4.39 -1.94 0.55 114.58 127.28 2gsl h GLU 70 Ca -0.49 0.01 0.16 0.00 0.34 0.00 0.00 59.36 59.38 2gsl h GLU 70 Cb 1.23 0.02 -0.16 0.00 -0.10 0.00 0.00 28.75 29.73 2gsl h GLU 70 CO 0.62 -0.05 -0.31 1.49 -1.16 0.00 0.00 179.01 179.60 2gsl h GLU 71 N -0.09 -0.03 0.00 2.33 4.81 -2.01 0.89 114.58 120.49 2gsl h GLU 71 Ca 0.29 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 59.44 2gsl h GLU 71 Cb 0.57 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.95 2gsl h GLU 71 CO -0.81 -0.02 -0.42 0.74 -0.73 0.00 0.00 179.01 177.77 2gsl h PHE 72 N -0.03 0.00 -0.42 0.92 -1.00 -1.51 -3.04 116.94 111.86 2gsl h PHE 72 Ca 0.37 0.00 -0.06 0.00 2.81 0.00 0.00 57.97 61.09 2gsl h PHE 72 Cb 0.62 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.17 2gsl h PHE 72 CO -0.76 0.42 0.04 0.87 -1.61 0.00 0.00 178.31 177.27 2gsl h LYS 73 N 0.00 0.71 0.21 1.51 1.57 0.28 -1.54 116.57 119.31 2gsl h LYS 73 Ca -0.00 -0.21 0.01 0.00 -1.87 0.00 0.00 60.65 58.58 2gsl h LYS 73 Cb 1.02 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 33.23 2gsl h LYS 73 CO 0.05 0.77 -0.32 0.28 -0.57 0.00 0.00 179.45 179.66 2gsl h VAL 74 N 0.55 0.33 -0.87 0.50 2.07 -0.73 -1.40 116.25 116.70 2gsl h VAL 74 Ca 0.12 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.79 2gsl h VAL 74 Cb 0.42 0.33 -0.10 0.00 -1.52 0.00 0.00 31.29 30.43 2gsl h VAL 74 CO 0.01 0.00 0.46 0.40 0.02 0.00 0.00 177.57 178.47 2gsl h ILE 75 N -0.60 0.73 0.00 4.57 2.04 -1.48 0.43 117.51 123.21 2gsl h ILE 75 Ca 0.01 -0.22 0.00 0.00 1.00 0.00 0.00 64.86 65.64 2gsl h ILE 75 Cb 0.59 0.02 0.00 0.00 -0.74 0.00 0.00 36.82 36.69 2gsl h ILE 75 CO -0.13 0.12 0.00 0.61 0.00 0.00 0.00 178.15 178.75 2gsl n GLY 76 N -1.33 -2.88 0.34 5.37 0.00 -0.59 0.47 105.19 106.58 2gsl n GLY 76 Ca 0.18 0.30 0.09 0.00 0.00 0.00 0.00 46.02 46.59 2gsl n GLY 76 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2gsl h LYS 77 N 0.00 0.76 -0.69 1.61 3.64 -1.01 0.46 116.57 121.35 2gsl h LYS 77 Ca 0.00 -0.05 0.06 0.00 -1.27 0.00 0.00 60.65 59.39 2gsl h LYS 77 Cb 0.00 -0.17 -0.06 0.00 -0.41 0.00 0.00 32.23 31.59 2gsl h LYS 77 CO 0.00 0.51 0.39 -0.09 -2.27 0.00 0.00 179.45 177.98 2gsl h ARG 78 N 0.79 0.70 0.01 1.90 2.43 0.27 -2.27 114.38 118.21 2gsl h ARG 78 Ca 0.52 -0.04 -0.20 0.00 -0.81 0.00 0.00 59.98 59.45 2gsl h ARG 78 Cb 0.71 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 30.07 2gsl h ARG 78 CO -0.34 0.46 -0.95 0.00 -1.51 0.00 0.00 179.97 177.63 2gsl h ALA 79 N 1.35 0.44 -0.96 2.80 0.00 0.25 -3.21 119.26 119.93 2gsl h ALA 79 Ca 0.31 -0.85 0.24 0.00 0.00 0.00 0.00 54.91 54.60 2gsl h ALA 79 Cb 0.18 -0.14 -0.07 0.00 0.00 0.00 0.00 17.79 17.76 2gsl h ALA 79 CO -0.18 1.15 0.64 0.87 0.00 0.00 0.00 179.25 181.73 2gsl h LYS 80 N 0.01 0.33 -4.02 0.00 1.57 0.39 -3.25 116.57 111.60 2gsl h LYS 80 Ca -0.02 -0.02 -0.77 0.00 -1.87 0.00 0.00 60.65 57.98 2gsl h LYS 80 Cb 1.67 -0.07 -0.25 0.00 0.08 0.00 0.00 32.23 33.65 2gsl h LYS 80 CO 0.13 0.22 -0.14 -0.80 -0.57 0.00 0.00 179.45 178.28 2gsl s ASN 81 N -5.50 6.31 0.00 0.86 0.02 -1.14 -4.75 114.94 110.74 2gsl s ASN 81 Ca -0.08 -2.09 0.00 0.00 -1.02 0.00 0.00 52.86 49.67 2gsl s ASN 81 Cb 0.23 -2.19 0.00 0.00 0.02 0.00 0.00 41.25 39.31 2gsl s ASN 81 CO 0.79 -0.75 0.00 -1.20 0.02 0.00 0.00 177.10 175.95 2gsl n SER 82 N 4.81 0.00 -3.65 -1.22 7.64 -1.23 -4.96 113.62 115.02 2gsl n SER 82 Ca -0.05 0.00 0.01 0.00 1.01 0.00 0.00 58.87 59.84 2gsl n SER 82 Cb 0.42 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.56 2gsl n SER 82 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2gsl s ASN 83 N 1.00 -0.11 0.22 6.43 2.20 -1.26 -5.20 114.94 118.22 2gsl s ASN 83 Ca 0.00 0.18 -0.14 0.00 -0.94 0.00 0.00 52.86 51.95 2gsl s ASN 83 Cb 0.00 0.89 0.01 0.00 -2.00 0.00 0.00 41.25 40.15 2gsl s ASN 83 CO 0.00 -0.03 0.49 0.42 -2.94 0.00 0.00 177.10 175.04 2gsl s THR 86 N 0.89 0.02 -0.54 0.54 -4.23 -1.26 -5.19 115.64 105.87 2gsl s THR 86 Ca -0.06 -1.18 -0.24 0.00 -1.18 0.00 0.00 61.69 59.04 2gsl s THR 86 Cb -0.03 -1.95 0.04 0.00 1.34 0.00 0.00 72.50 71.91 2gsl s THR 86 CO -0.11 -0.08 0.92 0.12 -0.54 0.00 0.00 174.62 174.93 2gsl s PHE 87 N -3.96 2.82 -0.63 3.99 2.19 -1.26 -5.01 117.98 116.12 2gsl s PHE 87 Ca 0.17 -0.03 -0.27 0.00 0.33 0.00 0.00 56.93 57.13 2gsl s PHE 87 Cb -0.01 -4.02 0.01 0.00 -1.31 0.00 0.00 43.02 37.69 2gsl s PHE 87 CO 0.04 -1.31 1.46 -1.25 1.83 0.00 0.00 175.22 175.99 2gsl s PRO 88 N 3.84 3.12 0.00 10.12 0.04 -1.26 -4.85 135.00 146.00 2gsl s PRO 88 Ca 0.30 0.24 0.00 0.00 0.04 0.00 0.00 61.00 61.58 2gsl s PRO 88 Cb -0.13 -4.20 0.00 0.00 0.04 0.00 0.00 34.50 30.21 2gsl s PRO 88 CO 0.19 -2.18 0.41 2.89 0.04 0.00 0.00 177.00 178.35 2gsl n ARG 89 N 9.02 0.47 0.00 4.56 0.00 -1.26 -1.67 116.66 127.77 2gsl n ARG 89 Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.96 2gsl n ARG 89 Cb 0.50 -1.06 0.00 0.00 -0.00 0.00 0.00 32.46 31.90 2gsl n ARG 89 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 2gsl n SER 90 N -0.31 0.24 -3.75 2.89 7.64 -1.26 -5.09 113.62 113.99 2gsl n SER 90 Ca 0.00 -0.41 -0.09 0.00 1.01 0.00 0.00 58.87 59.38 2gsl n SER 90 Cb 0.03 0.87 -0.03 0.00 -1.01 0.00 0.00 64.21 64.07 2gsl n SER 90 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2gsl n THR 92 N -0.40 0.00 0.68 0.00 -2.24 -1.26 -4.37 114.28 106.69 2gsl n THR 92 Ca -0.08 -0.59 0.00 0.00 -2.27 0.00 0.00 64.05 61.10 2gsl n THR 92 Cb 0.61 -1.37 0.00 0.00 -2.10 0.00 0.00 70.33 67.47 2gsl n THR 92 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2gsl n VAL 93 N -4.09 0.00 0.00 2.28 0.31 -1.26 -2.67 118.33 112.90 2gsl n VAL 93 Ca 0.13 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.46 2gsl n VAL 93 Cb 0.49 -0.25 0.00 0.00 -0.91 0.00 0.00 33.84 33.17 2gsl n VAL 93 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2gsl n GLU 95 N -0.02 0.00 0.05 5.55 1.02 -1.26 -1.18 120.64 124.80 2gsl n GLU 95 Ca 0.00 0.00 -0.09 0.00 -0.02 0.00 0.00 57.16 57.05 2gsl n GLU 95 Cb 0.08 0.00 0.05 0.00 -0.02 0.00 0.00 31.44 31.55 2gsl n GLU 95 CO 0.00 0.00 0.00 -0.92 1.18 0.00 0.00 177.13 177.39 2gsl h TYR 96 N 0.00 0.53 -0.64 -0.32 5.03 -1.85 -2.53 116.97 117.20 2gsl h TYR 96 Ca 0.00 -0.22 -0.07 0.00 2.58 0.00 0.00 58.73 61.02 2gsl h TYR 96 Cb 0.00 -0.09 -0.03 0.00 1.55 0.00 0.00 36.73 38.17 2gsl h TYR 96 CO 0.00 0.96 0.12 0.87 -1.32 0.00 0.00 178.16 178.79 2gsl h LYS 97 N 0.28 1.02 -0.20 1.82 1.57 -1.44 -2.46 116.57 117.17 2gsl h LYS 97 Ca -0.02 -0.25 -0.14 0.00 -1.87 0.00 0.00 60.65 58.36 2gsl h LYS 97 Cb 1.24 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 33.41 2gsl h LYS 97 CO 0.12 0.93 -0.48 0.93 -0.57 0.00 0.00 179.45 180.38 2gsl h GLU 98 N 0.97 0.52 0.05 3.15 5.08 -1.81 -2.34 114.58 120.21 2gsl h GLU 98 Ca 0.20 -0.30 -0.00 0.00 -1.00 0.00 0.00 59.36 58.26 2gsl h GLU 98 Cb 0.39 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.66 2gsl h GLU 98 CO 0.01 0.89 -0.03 0.00 -1.00 0.00 0.00 179.01 178.88 2gsl h ALA 99 N 1.06 -0.07 0.00 3.43 0.00 -1.25 -0.13 119.26 122.29 2gsl h ALA 99 Ca 0.02 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2gsl h ALA 99 Cb 1.00 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 2gsl h ALA 99 CO 0.09 -0.50 -0.10 1.79 0.00 0.00 0.00 179.25 180.53 2gsl h THR 100 N -0.15 0.60 -0.10 0.00 1.35 -1.41 -2.04 112.91 111.15 2gsl h THR 100 Ca -0.01 -0.43 -0.22 0.00 -0.55 0.00 0.00 66.41 65.20 2gsl h THR 100 Cb 0.13 1.28 0.01 0.00 -1.73 0.00 0.00 68.15 67.83 2gsl h THR 100 CO 0.01 0.10 -0.81 0.00 -0.25 0.00 0.00 175.52 174.57 2gsl h ALA 101 N 1.90 0.37 -0.09 6.62 0.00 -0.75 0.12 119.26 127.43 2gsl h ALA 101 Ca -0.00 -0.62 -0.01 0.00 0.00 0.00 0.00 54.91 54.27 2gsl h ALA 101 Cb 0.27 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 2gsl h ALA 101 CO 0.01 0.72 0.01 1.25 0.00 0.00 0.00 179.25 181.24 2gsl h LEU 102 N 0.43 0.15 -0.12 0.00 5.85 -0.46 -0.71 115.31 120.45 2gsl h LEU 102 Ca -0.06 -0.27 0.01 0.00 0.84 0.00 0.00 57.88 58.40 2gsl h LEU 102 Cb 1.43 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 42.41 2gsl h LEU 102 CO 0.16 0.38 0.03 -0.33 -0.34 0.00 0.00 178.44 178.34 2gsl h GLU 103 N -0.09 0.08 -0.65 1.25 5.08 -1.38 0.54 114.58 119.41 2gsl h GLU 103 Ca 0.03 -0.00 0.09 0.00 -1.00 0.00 0.00 59.36 58.47 2gsl h GLU 103 Cb 0.30 -0.02 -0.07 0.00 0.50 0.00 0.00 28.75 29.46 2gsl h GLU 103 CO 0.00 0.05 0.29 0.00 -1.00 0.00 0.00 179.01 178.36 2gsl h ALA 104 N 1.08 0.87 -0.21 3.43 0.00 -0.91 0.98 119.26 124.49 2gsl h ALA 104 Ca 0.05 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2gsl h ALA 104 Cb 0.03 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2gsl h ALA 104 CO -0.06 -0.12 0.07 0.82 0.00 0.00 0.00 179.25 179.97 2gsl h ILE 105 N 0.50 1.18 0.18 0.00 2.04 -0.46 -0.58 117.51 120.38 2gsl h ILE 105 Ca 0.32 -0.56 0.01 0.00 1.00 0.00 0.00 64.86 65.64 2gsl h ILE 105 Cb 0.36 1.16 -0.04 0.00 -0.74 0.00 0.00 36.82 37.55 2gsl h ILE 105 CO -0.28 0.18 -0.46 0.40 0.00 0.00 0.00 178.15 177.99 2gsl h ILE 106 N 0.18 0.10 -0.84 -0.67 1.08 0.24 -1.54 117.51 116.06 2gsl h ILE 106 Ca 0.07 0.00 0.18 0.00 -0.39 0.00 0.00 64.86 64.72 2gsl h ILE 106 Cb 0.21 0.10 -0.11 0.00 -3.07 0.00 0.00 36.82 33.95 2gsl h ILE 106 CO -0.00 0.00 0.35 1.23 -0.69 0.00 0.00 178.15 179.03 2gsl h GLY 107 N -0.73 1.36 -1.50 5.37 0.00 0.99 -0.59 103.07 107.97 2gsl h GLY 107 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.18 2gsl h GLY 107 CO -0.22 -0.19 0.00 0.00 0.00 0.00 0.00 176.54 176.13 2gsl n ALA 108 N -2.52 1.28 0.00 3.60 0.00 -0.23 -0.92 120.51 121.72 2gsl n ALA 108 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.63 2gsl n ALA 108 Cb 0.55 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.00 2gsl n ALA 108 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 2gsl n TYR 110 N 0.74 0.00 0.01 0.00 9.36 -0.23 -1.25 117.16 125.79 2gsl n TYR 110 Ca 0.00 0.00 0.22 0.00 3.32 0.00 0.00 57.90 61.44 2gsl n TYR 110 Cb 0.01 0.00 0.66 0.00 -0.63 0.00 0.00 39.34 39.38 2gsl n TYR 110 CO 0.00 0.00 0.00 -0.07 0.22 0.00 0.00 176.86 177.01 2gsl h LEU 111 N 0.00 0.00 -1.37 2.98 3.38 -1.29 1.12 115.31 120.12 2gsl h LEU 111 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2gsl h LEU 111 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2gsl h LEU 111 CO 0.00 0.00 0.00 0.18 0.09 0.00 0.00 178.44 178.71 2gsl n LEU 112 N -3.53 2.08 -1.47 1.67 4.77 -0.38 -4.91 117.00 115.22 2gsl n LEU 112 Ca 0.12 -0.83 -0.19 0.00 -0.03 0.00 0.00 56.01 55.07 2gsl n LEU 112 Cb 0.88 -0.10 -0.08 0.00 -2.33 0.00 0.00 43.42 41.79 2gsl n LEU 112 CO 0.25 0.42 -0.18 0.29 -1.33 0.00 0.00 177.39 176.84 2gsl n LYS 113 N 0.60 -1.39 -0.99 3.23 5.02 0.39 -4.82 118.16 120.19 2gsl n LYS 113 Ca 0.17 1.18 -0.17 0.00 -2.02 0.00 0.00 58.31 57.47 2gsl n LYS 113 Cb 0.41 -5.52 0.00 0.00 -0.02 0.00 0.00 35.03 29.90 2gsl n LYS 113 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2gsl n LYS 114 N -2.33 1.86 0.27 1.97 4.01 -1.26 -4.55 118.16 118.13 2gsl n LYS 114 Ca -0.19 -1.54 0.12 0.00 -0.51 0.00 0.00 58.31 56.19 2gsl n LYS 114 Cb 0.65 -1.69 0.78 0.00 -0.51 0.00 0.00 35.03 34.26 2gsl n LYS 114 CO 0.00 0.00 0.00 0.93 -1.11 0.00 0.00 177.40 177.22 2gsl h GLU 115 N 1.84 0.00 0.00 1.97 5.08 -1.87 -0.95 114.58 120.65 2gsl h GLU 115 Ca 0.28 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.61 2gsl h GLU 115 Cb 0.92 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.16 2gsl h GLU 115 CO 0.68 0.00 -0.12 1.49 -1.00 0.00 0.00 179.01 180.06 2gsl h GLU 116 N 0.00 0.00 0.00 2.33 4.57 -2.01 -0.98 114.58 118.50 2gsl h GLU 116 Ca 0.01 0.00 -0.21 0.00 -1.18 0.00 0.00 59.36 57.98 2gsl h GLU 116 Cb 0.06 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 28.62 2gsl h GLU 116 CO -0.00 0.12 -1.01 0.93 -1.18 0.00 0.00 179.01 177.86 2gsl h GLU 117 N 0.00 0.01 -0.31 1.92 4.39 -1.55 -3.18 114.58 115.86 2gsl h GLU 117 Ca -0.00 -0.02 -0.12 0.00 0.34 0.00 0.00 59.36 59.56 2gsl h GLU 117 Cb 0.25 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.89 2gsl h GLU 117 CO 0.02 1.00 -0.31 0.82 -1.16 0.00 0.00 179.01 179.38 2gsl h ILE 118 N 0.00 1.28 -0.45 3.13 2.04 -1.16 -2.59 117.51 119.75 2gsl h ILE 118 Ca -0.02 -1.43 -0.04 0.00 1.00 0.00 0.00 64.86 64.37 2gsl h ILE 118 Cb 1.78 1.37 -0.02 0.00 -0.74 0.00 0.00 36.82 39.21 2gsl h ILE 118 CO 0.13 0.46 0.11 0.50 0.00 0.00 0.00 178.15 179.35 2gsl h LYS 119 N 0.56 0.68 -0.47 2.37 3.64 -1.33 -2.01 116.57 120.01 2gsl h LYS 119 Ca 0.07 -0.13 -0.00 0.00 -1.27 0.00 0.00 60.65 59.32 2gsl h LYS 119 Cb 0.80 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.49 2gsl h LYS 119 CO 0.07 0.62 0.27 0.87 -2.27 0.00 0.00 179.45 179.01 2gsl h LYS 120 N 0.66 0.64 -0.37 1.90 1.57 -1.44 0.35 116.57 119.88 2gsl h LYS 120 Ca 0.15 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.86 2gsl h LYS 120 Cb 0.25 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.41 2gsl h LYS 120 CO -0.00 0.48 0.19 0.82 -0.57 0.00 0.00 179.45 180.37 2gsl h ILE 121 N 0.62 1.15 -0.11 1.86 2.04 -1.22 -2.22 117.51 119.64 2gsl h ILE 121 Ca 0.17 -0.42 -0.05 0.00 1.00 0.00 0.00 64.86 65.56 2gsl h ILE 121 Cb 0.01 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 36.84 2gsl h ILE 121 CO -0.03 0.16 -0.17 0.40 0.00 0.00 0.00 178.15 178.51 2gsl h ILE 122 N 0.47 1.18 -0.54 -0.67 1.08 -1.09 -2.62 117.51 115.31 2gsl h ILE 122 Ca 0.13 -0.83 -0.11 0.00 -0.39 0.00 0.00 64.86 63.66 2gsl h ILE 122 Cb 0.08 1.29 -0.02 0.00 -3.07 0.00 0.00 36.82 35.11 2gsl h ILE 122 CO -0.02 0.25 -0.11 0.78 -0.69 0.00 0.00 178.15 178.36 2gsl h ASN 123 N 0.17 1.03 0.42 1.72 2.35 -0.42 0.12 115.58 120.97 2gsl h ASN 123 Ca 0.03 -0.35 -0.05 0.00 -0.55 0.00 0.00 56.30 55.37 2gsl h ASN 123 Cb 0.41 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.49 2gsl h ASN 123 CO 0.03 1.14 -0.26 0.16 -1.65 0.00 0.00 177.43 176.85 2gsl h ILE 124 N 0.90 0.96 0.22 2.81 -0.00 -1.06 0.40 117.51 121.73 2gsl h ILE 124 Ca 0.14 -0.97 -0.01 0.00 -0.00 0.00 0.00 64.86 64.01 2gsl h ILE 124 Cb 0.68 1.56 0.00 0.00 -0.00 0.00 0.00 36.82 39.07 2gsl h ILE 124 CO 0.05 0.26 -0.10 0.58 -0.00 0.00 0.00 178.15 178.93 2gsl h VAL 125 N 0.00 0.65 -0.01 0.16 2.07 -1.11 -3.20 116.25 114.81 2gsl h VAL 125 Ca -0.00 -0.99 -0.00 0.00 0.82 0.00 0.00 66.70 66.52 2gsl h VAL 125 Cb 0.54 1.09 -0.00 0.00 -1.52 0.00 0.00 31.29 31.40 2gsl h VAL 125 CO 0.03 0.17 -0.00 0.16 0.02 0.00 0.00 177.57 177.95 2gsl h ILE 126 N -0.92 1.31 -0.09 4.57 3.07 -0.85 -2.88 117.51 121.74 2gsl h ILE 126 Ca -0.03 -0.93 0.02 0.00 1.55 0.00 0.00 64.86 65.47 2gsl h ILE 126 Cb 0.49 1.92 -0.00 0.00 -0.27 0.00 0.00 36.82 38.96 2gsl h ILE 126 CO 0.05 0.25 0.42 0.11 -1.05 0.00 0.00 178.15 177.93 2gsl h LYS 127 N -0.36 0.00 0.00 0.16 1.57 -0.36 2.32 116.57 119.89 2gsl h LYS 127 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2gsl h LYS 127 Cb 0.40 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.71 2gsl h LYS 127 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 179.29 2gsl n GLY 128 N -1.30 -1.31 0.20 3.86 0.00 -1.08 -1.97 105.19 103.58 2gsl n GLY 128 Ca 0.00 0.07 -0.14 0.00 0.00 0.00 0.00 46.02 45.96 2gsl n GLY 128 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2gsl n GLU 129 N -2.22 0.40 0.08 1.61 1.02 0.77 -4.42 120.64 117.88 2gsl n GLU 129 Ca 0.02 0.12 0.08 0.00 -0.02 0.00 0.00 57.16 57.36 2gsl n GLU 129 Cb 0.25 -1.27 0.38 0.00 -0.02 0.00 0.00 31.44 30.78 2gsl n GLU 129 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2gsl n LEU 130 N -3.24 0.35 -0.10 -4.62 7.99 -0.48 -2.10 117.00 114.80 2gsl n LEU 130 Ca -0.31 0.61 -0.13 0.00 -0.01 0.00 0.00 56.01 56.18 2gsl n LEU 130 Cb 0.79 -0.59 -0.04 0.00 -0.11 0.00 0.00 43.42 43.47 2gsl n LEU 130 CO 0.12 -0.54 0.62 -0.08 -1.51 0.00 0.00 177.39 176.00 2gsl h GLU 131 N 0.00 0.67 0.00 3.23 4.81 -1.61 -2.74 114.58 118.94 2gsl h GLU 131 Ca 0.00 -0.32 0.00 0.00 -0.13 0.00 0.00 59.36 58.91 2gsl h GLU 131 Cb 0.20 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.57 2gsl h GLU 131 CO 0.00 0.92 0.00 0.72 -0.73 0.00 0.00 179.01 179.92 2gsl n HIS 132 N -4.34 0.00 -1.12 0.92 8.25 -0.89 -4.89 115.22 113.15 2gsl n HIS 132 Ca -0.03 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.39 2gsl n HIS 132 Cb 0.42 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.51 2gsl n HIS 132 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2gsl n HIS 133 N -0.82 0.00 -2.61 4.41 8.25 -1.04 -5.00 115.22 118.42 2gsl n HIS 133 Ca 0.15 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.34 2gsl n HIS 133 Cb 0.07 -1.91 0.01 0.00 1.12 0.00 0.00 29.99 29.29 2gsl n HIS 133 CO 0.00 0.00 0.00 -3.38 0.64 0.00 0.00 176.34 173.60 2gsl s HIS 134 N -1.55 3.38 0.00 4.41 -3.43 -1.26 -5.06 115.29 111.79 2gsl s HIS 134 Ca 0.00 0.64 0.00 0.00 -0.80 0.00 0.00 55.06 54.90 2gsl s HIS 134 Cb 0.00 -2.47 0.00 0.00 -1.43 0.00 0.00 32.58 28.68 2gsl s HIS 134 CO 0.00 -0.51 0.00 0.72 -2.00 0.00 0.00 174.74 172.95