#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3imo s LEU 3 N 0.00 3.43 -0.20 0.00 2.96 -0.73 -4.97 118.68 119.16 3imo s LEU 3 Ca 0.00 -0.59 -0.24 0.00 -0.22 0.00 0.00 54.13 53.08 3imo s LEU 3 Cb 0.00 -1.81 -0.01 0.00 0.50 0.00 0.00 46.19 44.87 3imo s LEU 3 CO 0.00 -0.12 0.77 -0.89 -1.32 0.00 0.00 176.35 174.79 3imo s THR 4 N 1.48 4.91 -0.89 3.68 2.01 -1.26 -1.18 115.64 124.37 3imo s THR 4 Ca 0.03 1.47 -0.10 0.00 0.31 0.00 0.00 61.69 63.40 3imo s THR 4 Cb -0.16 -4.07 0.23 0.00 0.01 0.00 0.00 72.50 68.51 3imo s THR 4 CO -0.00 0.01 0.83 -0.69 -0.69 0.00 0.00 174.62 174.08 3imo s VAL 5 N 2.34 5.40 -0.21 3.82 1.01 -0.46 -4.79 120.40 127.51 3imo s VAL 5 Ca 0.34 -2.93 0.06 0.00 0.00 0.00 0.00 61.98 59.45 3imo s VAL 5 Cb -0.16 -4.32 -0.17 0.00 0.00 0.00 0.00 36.38 31.73 3imo s VAL 5 CO 0.10 -1.06 -0.13 1.17 0.00 0.00 0.00 175.10 175.18 3imo n LYS 6 N 3.40 0.72 -4.05 2.72 4.81 -1.26 -3.98 118.16 120.52 3imo n LYS 6 Ca 0.17 0.09 -0.25 0.00 -0.87 0.00 0.00 58.31 57.44 3imo n LYS 6 Cb 0.43 -1.46 -0.05 0.00 0.02 0.00 0.00 35.03 33.98 3imo n LYS 6 CO 0.00 0.00 0.00 0.16 1.17 0.00 0.00 177.40 178.73 3imo s ASP 7 N -5.92 5.76 0.29 3.14 1.47 -1.26 -5.02 116.67 115.13 3imo s ASP 7 Ca -0.24 -0.06 0.06 0.00 1.18 0.00 0.00 52.55 53.48 3imo s ASP 7 Cb 0.07 -1.57 0.42 0.00 -0.34 0.00 0.00 42.92 41.50 3imo s ASP 7 CO 0.58 0.04 1.69 0.58 0.68 0.00 0.00 175.17 178.74 3imo h VAL 8 N 1.84 1.31 -0.41 2.11 2.07 -1.99 -2.47 116.25 118.70 3imo h VAL 8 Ca -0.48 -1.54 -0.09 0.00 0.82 0.00 0.00 66.70 65.41 3imo h VAL 8 Cb 1.20 1.68 -0.02 0.00 -1.52 0.00 0.00 31.29 32.64 3imo h VAL 8 CO 0.64 0.46 -0.12 0.78 0.02 0.00 0.00 177.57 179.36 3imo h ASN 9 N 0.23 0.72 -0.25 0.57 2.35 -1.99 0.45 115.58 117.66 3imo h ASN 9 Ca 0.02 -0.21 -0.13 0.00 -0.55 0.00 0.00 56.30 55.42 3imo h ASN 9 Cb 0.83 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 39.00 3imo h ASN 9 CO 0.07 0.86 -0.33 0.40 -1.65 0.00 0.00 177.43 176.78 3imo h ILE 10 N 0.67 1.28 -0.42 2.81 1.08 -1.89 -1.94 117.51 119.09 3imo h ILE 10 Ca 0.11 -1.48 -0.02 0.00 -0.39 0.00 0.00 64.86 63.09 3imo h ILE 10 Cb 0.58 1.36 -0.02 0.00 -3.07 0.00 0.00 36.82 35.67 3imo h ILE 10 CO 0.04 0.49 0.19 0.25 -0.69 0.00 0.00 178.15 178.43 3imo h LEU 11 N 0.64 0.56 -0.87 1.44 5.85 -0.99 -1.02 115.31 120.92 3imo h LEU 11 Ca 0.07 -0.14 0.02 0.00 0.84 0.00 0.00 57.88 58.66 3imo h LEU 11 Cb 0.86 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 41.70 3imo h LEU 11 CO 0.08 0.54 0.58 0.28 -0.34 0.00 0.00 178.44 179.58 3imo h SER 12 N 0.54 0.99 -0.66 1.25 0.02 -0.76 -0.65 113.55 114.28 3imo h SER 12 Ca 0.14 -0.02 -0.05 0.00 -0.84 0.00 0.00 61.79 61.03 3imo h SER 12 Cb 0.14 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.41 3imo h SER 12 CO -0.02 0.71 0.24 1.56 -1.14 0.00 0.00 176.83 178.18 3imo h GLN 13 N 1.16 1.01 -0.03 3.45 4.20 -1.05 0.16 115.11 124.02 3imo h GLN 13 Ca 0.33 -0.20 -0.00 0.00 0.06 0.00 0.00 58.65 58.84 3imo h GLN 13 Cb -0.10 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 27.52 3imo h GLN 13 CO -0.08 0.86 0.01 -0.92 -0.67 0.00 0.00 178.83 178.03 3imo h TYR 14 N 0.95 0.04 -0.95 2.96 3.20 -0.55 -1.66 116.97 120.95 3imo h TYR 14 Ca 0.22 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.08 3imo h TYR 14 Cb 0.25 -0.01 -0.05 0.00 1.54 0.00 0.00 36.73 38.46 3imo h TYR 14 CO 0.02 0.14 0.58 0.82 -1.64 0.00 0.00 178.16 178.07 3imo h ILE 15 N -0.08 1.26 -0.88 1.81 2.04 -0.98 -1.54 117.51 119.15 3imo h ILE 15 Ca 0.01 -0.55 -0.02 0.00 1.00 0.00 0.00 64.86 65.30 3imo h ILE 15 Cb 0.11 -0.09 -0.04 0.00 -0.74 0.00 0.00 36.82 36.06 3imo h ILE 15 CO -0.00 0.27 0.47 0.28 0.00 0.00 0.00 178.15 179.17 3imo h SER 16 N 1.31 1.10 -0.67 1.72 0.02 -0.73 -0.62 113.55 115.68 3imo h SER 16 Ca 0.34 -0.10 -0.07 0.00 -0.84 0.00 0.00 61.79 61.12 3imo h SER 16 Cb -0.07 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 62.17 3imo h SER 16 CO -0.07 0.89 0.14 1.23 -1.14 0.00 0.00 176.83 177.89 3imo h GLY 17 N 1.24 1.17 1.01 -3.77 0.00 -0.67 -1.02 103.07 101.03 3imo h GLY 17 Ca 0.31 -0.75 -0.05 0.00 0.00 0.00 0.00 47.33 46.84 3imo h GLY 17 CO -0.05 0.70 0.18 -2.08 0.00 0.00 0.00 176.54 175.29 3imo h VAL 18 N 1.01 1.25 -0.06 4.60 2.07 -0.74 -1.87 116.25 122.50 3imo h VAL 18 Ca 0.21 -0.85 -0.19 0.00 0.82 0.00 0.00 66.70 66.69 3imo h VAL 18 Cb 0.39 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 30.79 3imo h VAL 18 CO 0.01 0.32 -0.75 0.24 0.02 0.00 0.00 177.57 177.41 3imo h MET 19 N 0.88 0.38 -0.32 1.57 2.86 -0.92 -1.68 114.93 117.69 3imo h MET 19 Ca 0.20 -0.32 -0.05 0.00 -2.06 0.00 0.00 59.70 57.47 3imo h MET 19 Cb 0.30 0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.02 3imo h MET 19 CO -0.00 0.97 0.02 0.00 1.06 0.00 0.00 176.91 178.96 3imo h ALA 20 N 0.94 0.43 -0.54 6.32 0.00 -1.08 0.02 119.26 125.36 3imo h ALA 20 Ca -0.03 -0.22 0.02 0.00 0.00 0.00 0.00 54.91 54.67 3imo h ALA 20 Cb 1.34 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 3imo h ALA 20 CO 0.13 0.16 0.33 0.00 0.00 0.00 0.00 179.25 179.87 3imo h ARG 21 N 0.37 0.64 -0.48 0.00 3.08 -1.32 -2.17 114.38 114.50 3imo h ARG 21 Ca 0.09 -0.04 -0.09 0.00 0.07 0.00 0.00 59.98 60.01 3imo h ARG 21 Cb 0.40 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.29 3imo h ARG 21 CO 0.01 0.42 -0.08 0.00 -1.07 0.00 0.00 179.97 179.26 3imo h ALA 22 N 1.23 0.97 -0.75 0.04 0.00 -1.05 0.26 119.26 119.96 3imo h ALA 22 Ca 0.21 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 3imo h ALA 22 Cb -0.00 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 3imo h ALA 22 CO -0.08 0.61 0.30 0.22 0.00 0.00 0.00 179.25 180.31 3imo h ASP 23 N 0.77 1.01 0.41 0.00 3.58 -0.76 0.21 116.42 121.64 3imo h ASP 23 Ca 0.13 -0.15 -0.31 0.00 0.42 0.00 0.00 57.03 57.13 3imo h ASP 23 Cb 0.57 -0.26 -0.03 0.00 1.72 0.00 0.00 39.33 41.33 3imo h ASP 23 CO 0.03 0.90 -1.72 0.45 -2.88 0.00 0.00 179.24 176.02 3imo h HIS 24 N 1.08 0.20 0.00 0.28 3.86 -0.97 -3.43 115.15 116.17 3imo h HIS 24 Ca 0.25 -0.15 0.00 0.00 -1.16 0.00 0.00 60.37 59.31 3imo h HIS 24 Cb 0.19 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 28.66 3imo h HIS 24 CO 0.02 1.27 -0.59 0.72 0.86 0.00 0.00 177.93 180.21 3imo n HIS 25 N -3.24 0.00 -3.12 2.45 8.25 0.89 -4.93 115.22 115.51 3imo n HIS 25 Ca -0.20 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.07 3imo n HIS 25 Cb 1.04 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 32.12 3imo n HIS 25 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3imo n ALA 26 N -0.99 1.70 0.41 -1.41 0.00 -0.41 -4.93 120.51 114.88 3imo n ALA 26 Ca 0.00 -3.08 0.08 0.00 0.00 0.00 0.00 53.44 50.44 3imo n ALA 26 Cb 0.06 -0.93 0.37 0.00 0.00 0.00 0.00 19.45 18.95 3imo n ALA 26 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3imo n GLY 27 N 0.95 -1.06 0.08 0.00 0.00 -0.07 -2.59 105.19 102.51 3imo n GLY 27 Ca 0.20 0.02 0.10 0.00 0.00 0.00 0.00 46.02 46.34 3imo n GLY 27 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3imo n ASN 28 N -1.81 0.43 0.00 1.61 5.15 -1.26 -3.23 115.26 116.15 3imo n ASN 28 Ca 0.02 0.60 0.00 0.00 -0.60 0.00 0.00 54.58 54.61 3imo n ASN 28 Cb 0.17 -0.69 0.00 0.00 -0.53 0.00 0.00 39.78 38.73 3imo n ASN 28 CO 0.00 0.00 0.00 1.33 1.40 0.00 0.00 177.26 179.99 3imo n VAL 29 N -1.97 0.32 -0.26 3.44 0.24 -1.07 -0.24 118.33 118.79 3imo n VAL 29 Ca 0.03 -0.39 -0.00 0.00 -2.04 0.00 0.00 64.34 61.94 3imo n VAL 29 Cb 0.21 1.01 0.12 0.00 -1.47 0.00 0.00 33.84 33.71 3imo n VAL 29 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 3imo h GLU 30 N 0.00 0.73 -0.02 7.34 4.81 -1.60 -2.01 114.58 123.84 3imo h GLU 30 Ca 0.00 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.16 3imo h GLU 30 Cb 0.62 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.84 3imo h GLU 30 CO 0.00 0.48 -0.10 0.93 -0.73 0.00 0.00 179.01 179.59 3imo h GLU 31 N 0.75 0.10 0.00 1.92 5.08 -1.88 -3.28 114.58 117.27 3imo h GLU 31 Ca 0.33 -0.08 -0.05 0.00 -1.00 0.00 0.00 59.36 58.56 3imo h GLU 31 Cb 0.22 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 3imo h GLU 31 CO -0.20 0.77 -0.22 0.97 -1.00 0.00 0.00 179.01 179.33 3imo h ILE 32 N -0.55 0.82 -0.83 3.13 6.09 -1.80 -2.71 117.51 121.66 3imo h ILE 32 Ca -0.01 -0.85 0.04 0.00 -1.37 0.00 0.00 64.86 62.67 3imo h ILE 32 Cb 0.79 1.51 -0.05 0.00 0.47 0.00 0.00 36.82 39.54 3imo h ILE 32 CO 0.02 0.21 0.55 0.00 -3.07 0.00 0.00 178.15 175.86 3imo h ALA 33 N 1.78 1.50 -0.46 0.18 0.00 -1.42 0.34 119.26 121.17 3imo h ALA 33 Ca -0.00 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.76 3imo h ALA 33 Cb 0.49 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3imo h ALA 33 CO 0.03 0.42 -0.12 -0.07 0.00 0.00 0.00 179.25 179.50 3imo h LEU 34 N 1.02 0.91 -0.59 0.00 3.38 -1.62 -0.90 115.31 117.52 3imo h LEU 34 Ca 0.33 -0.37 -0.14 0.00 0.09 0.00 0.00 57.88 57.80 3imo h LEU 34 Cb 0.05 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 3imo h LEU 34 CO -0.10 1.07 -0.39 0.00 0.09 0.00 0.00 178.44 179.10 3imo h ALA 35 N 0.87 0.77 -0.92 1.53 0.00 -1.46 -2.53 119.26 117.51 3imo h ALA 35 Ca 0.12 -0.44 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 3imo h ALA 35 Cb 0.68 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.31 3imo h ALA 35 CO 0.05 0.66 0.55 -0.07 0.00 0.00 0.00 179.25 180.44 3imo h LEU 36 N 0.56 1.10 -0.11 0.00 3.38 -0.82 0.80 115.31 120.23 3imo h LEU 36 Ca 0.05 -0.07 0.03 0.00 0.09 0.00 0.00 57.88 57.98 3imo h LEU 36 Cb 0.93 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.36 3imo h LEU 36 CO 0.08 0.85 -0.11 0.00 0.09 0.00 0.00 178.44 179.36 3imo h ALA 37 N 1.30 -0.03 -0.30 1.53 0.00 -0.94 0.13 119.26 120.95 3imo h ALA 37 Ca 0.33 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.27 3imo h ALA 37 Cb -0.05 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3imo h ALA 37 CO -0.06 -0.56 0.14 0.78 0.00 0.00 0.00 179.25 179.55 3imo h GLY 38 N -0.13 0.47 1.28 0.00 0.00 -1.02 -1.92 103.07 101.75 3imo h GLY 38 Ca 0.08 -0.24 -0.05 0.00 0.00 0.00 0.00 47.33 47.11 3imo h GLY 38 CO -0.18 0.23 0.15 0.00 0.00 0.00 0.00 176.54 176.73 3imo h ALA 39 N 1.00 1.16 -0.31 3.60 0.00 -0.61 0.11 119.26 124.20 3imo h ALA 39 Ca 0.10 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 3imo h ALA 39 Cb 0.13 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3imo h ALA 39 CO -0.01 0.57 0.03 0.82 0.00 0.00 0.00 179.25 180.66 3imo h ILE 40 N 0.87 1.24 -0.33 0.00 2.04 -0.65 -2.34 117.51 118.34 3imo h ILE 40 Ca 0.19 -0.86 -0.07 0.00 1.00 0.00 0.00 64.86 65.13 3imo h ILE 40 Cb 0.30 1.20 -0.02 0.00 -0.74 0.00 0.00 36.82 37.56 3imo h ILE 40 CO -0.00 0.28 -0.09 -0.07 0.00 0.00 0.00 178.15 178.27 3imo h LEU 41 N 0.34 0.53 0.33 1.44 3.38 -0.97 -2.51 115.31 117.85 3imo h LEU 41 Ca 0.09 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 3imo h LEU 41 Cb 0.38 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 3imo h LEU 41 CO 0.01 0.66 -0.20 -0.25 0.09 0.00 0.00 178.44 178.75 3imo h TRP 42 N 0.52 -0.53 -0.01 1.13 7.01 -0.56 -3.33 115.95 120.18 3imo h TRP 42 Ca 0.10 -0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.09 3imo h TRP 42 Cb 0.47 0.19 0.00 0.00 -2.10 0.00 0.00 29.16 27.72 3imo h TRP 42 CO 0.02 -0.32 -0.59 0.54 -2.79 0.00 0.00 178.44 175.30 3imo n ARG 43 N -5.33 0.65 -2.00 2.65 5.12 -0.90 -4.96 116.66 111.90 3imo n ARG 43 Ca -0.10 -0.50 -0.38 0.00 -1.93 0.00 0.00 57.85 54.94 3imo n ARG 43 Cb 0.24 -1.49 0.02 0.00 -1.16 0.00 0.00 32.46 30.07 3imo n ARG 43 CO 0.00 0.00 0.00 -1.59 -1.93 0.00 0.00 177.63 174.11 3imo s LYS 44 N -2.69 3.46 0.00 5.56 -2.85 -0.95 -4.47 119.74 117.80 3imo s LYS 44 Ca 0.16 2.04 0.00 0.00 -1.00 0.00 0.00 55.97 57.17 3imo s LYS 44 Cb 0.18 -2.36 0.00 0.00 -2.06 0.00 0.00 37.83 33.59 3imo s LYS 44 CO 0.66 -0.88 0.00 -0.40 0.10 0.00 0.00 175.35 174.84 3imo n ASP 45 N -0.71 0.00 -0.06 0.03 5.68 -0.42 -4.95 116.55 116.11 3imo n ASP 45 Ca 0.09 0.00 0.14 0.00 -0.50 0.00 0.00 54.79 54.51 3imo n ASP 45 Cb 0.46 0.00 0.56 0.00 -1.14 0.00 0.00 41.12 41.00 3imo n ASP 45 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 3imo n ASP 46 N 0.00 0.35 -4.73 -1.12 9.92 -1.26 -4.84 116.55 114.86 3imo n ASP 46 Ca 0.00 -0.25 -0.42 0.00 -0.53 0.00 0.00 54.79 53.59 3imo n ASP 46 Cb 0.00 -0.12 -0.03 0.00 -0.64 0.00 0.00 41.12 40.33 3imo n ASP 46 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 3imo s THR 47 N -2.69 2.21 0.36 -3.53 2.01 -1.26 -4.95 115.64 107.79 3imo s THR 47 Ca 0.22 0.16 -0.28 0.00 0.31 0.00 0.00 61.69 62.10 3imo s THR 47 Cb 0.19 -3.10 -0.11 0.00 0.01 0.00 0.00 72.50 69.49 3imo s THR 47 CO 0.53 0.02 1.42 0.20 -0.69 0.00 0.00 174.62 176.09 3imo s ASN 48 N 0.90 6.50 0.41 3.53 0.01 -1.26 -4.75 114.94 120.28 3imo s ASN 48 Ca 0.69 2.91 -0.26 0.00 -0.71 0.00 0.00 52.86 55.49 3imo s ASN 48 Cb -0.47 -2.66 -0.09 0.00 0.41 0.00 0.00 41.25 38.44 3imo s ASN 48 CO 0.38 -0.75 1.39 -0.63 -1.51 0.00 0.00 177.10 175.98 3imo s ILE 49 N -1.13 2.28 -0.01 0.60 1.01 -1.26 -4.89 121.20 117.80 3imo s ILE 49 Ca 0.51 0.25 0.04 0.00 0.00 0.00 0.00 60.65 61.46 3imo s ILE 49 Cb -0.44 -3.15 -0.01 0.00 0.01 0.00 0.00 42.46 38.87 3imo s ILE 49 CO 0.59 0.04 -0.13 -0.54 0.00 0.00 0.00 174.94 174.91 3imo s LYS 50 N -2.27 1.04 -0.32 2.79 1.02 -0.84 -1.35 119.74 119.80 3imo s LYS 50 Ca 0.57 -0.49 -0.02 0.00 0.02 0.00 0.00 55.97 56.06 3imo s LYS 50 Cb -0.42 -1.01 0.06 0.00 -0.52 0.00 0.00 37.83 35.95 3imo s LYS 50 CO 0.55 0.27 0.04 0.08 -0.92 0.00 0.00 175.35 175.38 3imo s VAL 51 N -0.35 3.00 -0.27 3.17 1.01 -0.33 0.07 120.40 126.70 3imo s VAL 51 Ca 0.05 -1.57 -0.25 0.00 0.00 0.00 0.00 61.98 60.21 3imo s VAL 51 Cb -0.05 -2.82 -0.00 0.00 0.00 0.00 0.00 36.38 33.51 3imo s VAL 51 CO -0.00 -0.25 0.84 -0.04 0.00 0.00 0.00 175.10 175.65 3imo s MET 52 N 1.21 4.10 -0.16 2.72 -1.94 0.15 -1.77 119.30 123.61 3imo s MET 52 Ca -0.02 0.84 -0.08 0.00 -1.71 0.00 0.00 55.69 54.73 3imo s MET 52 Cb -0.20 -3.68 -0.04 0.00 2.01 0.00 0.00 34.83 32.91 3imo s MET 52 CO -0.02 -0.61 0.10 0.00 -0.01 0.00 0.00 175.02 174.48 3imo s ALA 53 N 2.96 3.63 -0.67 3.03 0.00 -1.26 -0.65 121.76 128.80 3imo s ALA 53 Ca 0.35 -0.70 0.04 0.00 0.00 0.00 0.00 51.96 51.65 3imo s ALA 53 Cb -0.15 -1.99 0.32 0.00 0.00 0.00 0.00 23.12 21.30 3imo s ALA 53 CO 0.10 0.32 1.03 0.72 0.00 0.00 0.00 175.76 177.93 3imo n HIS 54 N 3.00 3.76 0.00 0.00 -0.00 0.03 -4.79 115.22 117.23 3imo n HIS 54 Ca -0.17 -3.81 0.00 0.00 -0.00 0.00 0.00 57.72 53.74 3imo n HIS 54 Cb 0.53 -0.62 0.00 0.00 -0.00 0.00 0.00 29.99 29.90 3imo n HIS 54 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 3imo n GLY 55 N 0.07 2.93 3.24 -1.41 0.00 -1.26 -4.81 105.19 103.95 3imo n GLY 55 Ca 0.32 -0.63 -0.16 0.00 0.00 0.00 0.00 46.02 45.55 3imo n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3imo s ALA 56 N -1.41 1.44 -0.23 4.61 0.00 -1.26 -5.01 121.76 119.90 3imo s ALA 56 Ca 0.00 -1.38 0.25 0.00 0.00 0.00 0.00 51.96 50.83 3imo s ALA 56 Cb 0.00 -0.00 1.20 0.00 0.00 0.00 0.00 23.12 24.31 3imo s ALA 56 CO 0.00 -0.01 1.75 0.22 0.00 0.00 0.00 175.76 177.72 3imo h ASP 57 N 3.15 0.00 -0.24 0.00 3.58 -2.00 -1.87 116.42 119.04 3imo h ASP 57 Ca -0.38 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.07 3imo h ASP 57 Cb 1.19 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.24 3imo h ASP 57 CO 0.57 0.00 0.00 0.35 -2.88 0.00 0.00 179.24 177.28 3imo n THR 58 N -2.36 0.52 -2.32 2.25 -2.24 -1.26 -4.37 114.28 104.50 3imo n THR 58 Ca -0.00 -0.76 -0.38 0.00 -2.27 0.00 0.00 64.05 60.64 3imo n THR 58 Cb 0.13 0.88 0.02 0.00 -2.10 0.00 0.00 70.33 69.27 3imo n THR 58 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3imo n LYS 59 N 0.80 3.85 -3.68 -0.78 5.02 -0.70 -4.97 118.16 117.70 3imo n LYS 59 Ca 0.12 -4.14 -0.37 0.00 -2.02 0.00 0.00 58.31 51.89 3imo n LYS 59 Cb 0.42 -2.34 -0.06 0.00 -0.02 0.00 0.00 35.03 33.03 3imo n LYS 59 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 3imo s ASN 60 N -1.59 6.60 -0.14 4.39 0.01 -1.26 -0.79 114.94 122.16 3imo s ASN 60 Ca 0.47 0.72 0.02 0.00 -0.71 0.00 0.00 52.86 53.35 3imo s ASN 60 Cb 0.33 -2.16 0.01 0.00 0.41 0.00 0.00 41.25 39.83 3imo s ASN 60 CO -0.27 0.36 -0.20 -0.69 -1.51 0.00 0.00 177.10 174.79 3imo s VAL 61 N -1.03 2.24 -0.19 1.60 1.01 0.18 -4.67 120.40 119.54 3imo s VAL 61 Ca 0.19 -0.92 -0.17 0.00 0.00 0.00 0.00 61.98 61.08 3imo s VAL 61 Cb -0.14 -1.91 -0.04 0.00 0.00 0.00 0.00 36.38 34.29 3imo s VAL 61 CO 0.09 0.54 0.47 -0.22 0.00 0.00 0.00 175.10 175.98 3imo s LEU 62 N 0.82 4.16 -0.11 3.92 0.20 -0.56 -0.67 118.68 126.44 3imo s LEU 62 Ca -0.06 0.63 -0.01 0.00 0.69 0.00 0.00 54.13 55.38 3imo s LEU 62 Cb -0.15 -2.64 -0.03 0.00 -0.43 0.00 0.00 46.19 42.94 3imo s LEU 62 CO -0.01 -0.12 -0.05 0.26 -0.29 0.00 0.00 176.35 176.13 3imo s TRP 63 N 1.41 2.99 0.02 5.38 0.52 0.11 -1.00 118.94 128.37 3imo s TRP 63 Ca 0.22 -0.11 -0.06 0.00 0.02 0.00 0.00 56.10 56.18 3imo s TRP 63 Cb -0.15 -1.82 -0.01 0.00 -1.15 0.00 0.00 33.47 30.34 3imo s TRP 63 CO 0.09 0.19 0.10 0.54 0.02 0.00 0.00 176.95 177.89 3imo s VAL 64 N -0.33 0.11 -0.20 4.03 0.11 -0.78 -1.99 120.40 121.35 3imo s VAL 64 Ca 0.05 -0.90 -0.06 0.00 -2.93 0.00 0.00 61.98 58.14 3imo s VAL 64 Cb -0.12 -0.63 -0.03 0.00 -1.53 0.00 0.00 36.38 34.06 3imo s VAL 64 CO 0.02 -0.49 0.03 -0.89 -3.33 0.00 0.00 175.10 170.44 3imo s THR 65 N -1.96 4.27 -0.20 5.04 2.01 -1.26 -0.82 115.64 122.71 3imo s THR 65 Ca -0.10 -0.21 0.01 0.00 0.31 0.00 0.00 61.69 61.70 3imo s THR 65 Cb -0.05 -2.94 0.04 0.00 0.01 0.00 0.00 72.50 69.57 3imo s THR 65 CO -0.02 0.43 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.60 3imo s ILE 66 N 0.86 1.72 -1.25 1.82 1.01 0.30 -1.30 121.20 124.36 3imo s ILE 66 Ca 0.02 -1.06 -0.02 0.00 0.00 0.00 0.00 60.65 59.60 3imo s ILE 66 Cb -0.14 -1.78 -0.01 0.00 0.01 0.00 0.00 42.46 40.55 3imo s ILE 66 CO 0.02 0.18 0.79 -3.20 0.00 0.00 0.00 174.94 172.74 3imo n ASN 67 N 4.66 -2.06 0.00 3.58 2.85 -1.26 -2.08 115.26 120.95 3imo n ASN 67 Ca -0.15 -0.78 0.00 0.00 -0.11 0.00 0.00 54.58 53.54 3imo n ASN 67 Cb 0.46 -4.36 0.00 0.00 1.24 0.00 0.00 39.78 37.13 3imo n ASN 67 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3imo n GLY 68 N -1.45 3.02 3.91 8.20 0.00 -1.26 -4.99 105.19 112.62 3imo n GLY 68 Ca -0.27 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.44 3imo n GLY 68 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3imo s GLU 69 N -0.13 3.52 -0.17 1.61 0.41 -0.88 -5.09 118.70 117.96 3imo s GLU 69 Ca 0.00 -0.27 -0.06 0.00 -0.41 0.00 0.00 54.97 54.23 3imo s GLU 69 Cb 0.00 -2.99 -0.04 0.00 -1.78 0.00 0.00 34.13 29.33 3imo s GLU 69 CO 0.00 0.57 0.03 0.50 -0.49 0.00 0.00 175.26 175.88 3imo s ARG 70 N -2.42 3.89 -0.03 1.61 3.52 -1.26 -0.53 118.95 123.72 3imo s ARG 70 Ca 0.35 -0.39 0.06 0.00 -0.13 0.00 0.00 55.73 55.62 3imo s ARG 70 Cb -0.13 -3.13 -0.01 0.00 -1.56 0.00 0.00 34.95 30.12 3imo s ARG 70 CO 0.25 0.27 -0.21 0.71 -0.81 0.00 0.00 175.30 175.51 3imo s TYR 71 N 0.35 1.94 -0.12 5.12 2.02 -0.00 -1.36 117.35 125.29 3imo s TYR 71 Ca 0.01 -0.44 -0.01 0.00 -0.37 0.00 0.00 57.07 56.26 3imo s TYR 71 Cb -0.13 -1.26 -0.02 0.00 -0.40 0.00 0.00 41.96 40.14 3imo s TYR 71 CO 0.01 -0.09 -0.09 0.00 -1.57 0.00 0.00 175.55 173.81 3imo s ALA 72 N -0.34 2.83 -0.09 3.71 0.00 -0.09 -1.86 121.76 125.93 3imo s ALA 72 Ca 0.04 -0.87 0.03 0.00 0.00 0.00 0.00 51.96 51.16 3imo s ALA 72 Cb -0.10 -1.32 -0.01 0.00 0.00 0.00 0.00 23.12 21.69 3imo s ALA 72 CO 0.00 0.32 -0.20 -0.06 0.00 0.00 0.00 175.76 175.83 3imo s PHE 73 N 0.04 2.61 0.25 0.00 0.08 -0.17 -1.09 117.98 119.70 3imo s PHE 73 Ca -0.02 -0.70 -0.17 0.00 0.12 0.00 0.00 56.93 56.15 3imo s PHE 73 Cb -0.14 -1.70 0.01 0.00 -0.57 0.00 0.00 43.02 40.62 3imo s PHE 73 CO 0.04 -0.21 0.59 -1.54 -0.10 0.00 0.00 175.22 173.99 3imo s SER 74 N 0.03 -0.19 -0.16 1.36 1.04 -0.78 -1.50 113.70 113.49 3imo s SER 74 Ca -0.07 -0.73 -0.06 0.00 0.48 0.00 0.00 55.95 55.57 3imo s SER 74 Cb -0.15 0.65 -0.04 0.00 0.10 0.00 0.00 66.02 66.58 3imo s SER 74 CO 0.05 -1.21 0.04 -0.47 0.98 0.00 0.00 173.24 172.63 3imo s TYR 75 N -3.96 3.21 -0.39 5.02 5.04 -1.26 0.35 117.35 125.37 3imo s TYR 75 Ca 0.16 0.03 -0.14 0.00 -2.44 0.00 0.00 57.07 54.69 3imo s TYR 75 Cb -0.03 -2.02 0.01 0.00 0.35 0.00 0.00 41.96 40.28 3imo s TYR 75 CO 0.06 0.18 0.26 1.21 -1.34 0.00 0.00 175.55 175.92 3imo s ASN 76 N 0.18 6.00 0.00 4.32 3.84 -0.03 -4.94 114.94 124.30 3imo s ASN 76 Ca 0.03 -0.82 0.28 0.00 0.21 0.00 0.00 52.86 52.56 3imo s ASN 76 Cb -0.13 -2.12 1.49 0.00 -0.55 0.00 0.00 41.25 39.94 3imo s ASN 76 CO 0.01 -0.39 1.99 0.00 -2.79 0.00 0.00 177.10 175.92 3imo n HIS 77 N 5.11 0.00 -0.08 0.43 1.44 -1.26 -0.65 115.22 120.20 3imo n HIS 77 Ca -0.12 0.00 -0.14 0.00 -2.01 0.00 0.00 57.72 55.46 3imo n HIS 77 Cb 0.47 -0.22 -0.08 0.00 0.12 0.00 0.00 29.99 30.29 3imo n HIS 77 CO 0.00 0.00 0.00 0.77 -2.81 0.00 0.00 176.34 174.30 3imo h SER 78 N 0.00 0.00 1.49 4.39 0.02 -1.96 -3.37 113.55 114.12 3imo h SER 78 Ca 0.00 -0.44 0.00 0.00 -0.84 0.00 0.00 61.79 60.51 3imo h SER 78 Cb 0.20 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.74 3imo h SER 78 CO 0.00 1.10 0.00 0.77 -1.14 0.00 0.00 176.83 177.56 3imo h SER 79 N -1.00 0.00 -5.90 3.07 4.64 -1.99 -3.47 113.55 108.90 3imo h SER 79 Ca -0.15 0.00 -0.39 0.00 -0.47 0.00 0.00 61.79 60.78 3imo h SER 79 Cb 0.90 0.00 0.11 0.00 -0.31 0.00 0.00 62.40 63.09 3imo h SER 79 CO -0.09 0.00 -0.75 -0.62 -0.87 0.00 0.00 176.83 174.50 3imo n GLU 80 N -2.47 -6.52 -4.23 4.77 1.02 0.17 -5.03 120.64 108.35 3imo n GLU 80 Ca 0.05 0.76 -0.21 0.00 -0.02 0.00 0.00 57.16 57.74 3imo n GLU 80 Cb 0.42 -5.68 -0.12 0.00 -0.02 0.00 0.00 31.44 26.05 3imo n GLU 80 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 3imo s LYS 81 N -5.97 0.98 -0.18 3.49 -0.14 -1.13 -4.82 119.74 111.97 3imo s LYS 81 Ca 0.28 -1.08 -0.28 0.00 -1.36 0.00 0.00 55.97 53.53 3imo s LYS 81 Cb -0.13 -1.10 -0.00 0.00 -1.68 0.00 0.00 37.83 34.92 3imo s LYS 81 CO 0.76 0.25 0.96 0.42 -0.76 0.00 0.00 175.35 176.98 3imo s ILE 82 N -1.30 4.77 -0.10 2.17 1.01 -0.28 -0.85 121.20 126.62 3imo s ILE 82 Ca 0.03 1.89 -0.14 0.00 0.00 0.00 0.00 60.65 62.43 3imo s ILE 82 Cb -0.10 -4.25 -0.05 0.00 0.01 0.00 0.00 42.46 38.08 3imo s ILE 82 CO 0.03 -0.07 0.33 -1.61 0.00 0.00 0.00 174.94 173.63 3imo s GLU 83 N 2.58 4.05 -0.33 2.79 2.02 0.16 -0.81 118.70 129.16 3imo s GLU 83 Ca 0.43 0.21 -0.06 0.00 0.02 0.00 0.00 54.97 55.57 3imo s GLU 83 Cb -0.16 -3.33 0.04 0.00 0.10 0.00 0.00 34.13 30.78 3imo s GLU 83 CO 0.11 0.44 0.08 1.41 0.02 0.00 0.00 175.26 177.33 3imo s MET 84 N -0.19 2.60 -0.08 1.61 -2.45 -0.05 -1.87 119.30 118.87 3imo s MET 84 Ca 0.20 -1.18 -0.00 0.00 -1.25 0.00 0.00 55.69 53.45 3imo s MET 84 Cb -0.14 -3.40 -0.03 0.00 1.25 0.00 0.00 34.83 32.50 3imo s MET 84 CO 0.08 -0.65 -0.04 1.03 1.05 0.00 0.00 175.02 176.49 3imo s ARG 85 N 1.38 2.86 0.11 4.11 0.52 -0.25 -0.92 118.95 126.77 3imo s ARG 85 Ca -0.02 -0.49 0.03 0.00 -0.52 0.00 0.00 55.73 54.73 3imo s ARG 85 Cb -0.19 -2.68 -0.04 0.00 0.52 0.00 0.00 34.95 32.56 3imo s ARG 85 CO 0.02 0.67 0.16 0.21 0.02 0.00 0.00 175.30 176.38 3imo s LYS 86 N -0.81 3.09 0.00 3.54 2.20 -1.08 -0.91 119.74 125.76 3imo s LYS 86 Ca 0.12 -0.68 0.00 0.00 -0.36 0.00 0.00 55.97 55.05 3imo s LYS 86 Cb -0.11 -2.80 0.00 0.00 -1.51 0.00 0.00 37.83 33.41 3imo s LYS 86 CO 0.02 0.54 0.00 0.41 -0.36 0.00 0.00 175.35 175.96 3imo n GLY 87 N 0.02 1.27 2.86 5.54 0.00 -0.47 -2.99 105.19 111.43 3imo n GLY 87 Ca -0.08 -1.65 -0.22 0.00 0.00 0.00 0.00 46.02 44.07 3imo n GLY 87 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3imo s ASN 88 N -0.55 1.40 -0.08 1.61 4.22 -1.26 -4.32 114.94 115.96 3imo s ASN 88 Ca 0.00 -0.15 0.15 0.00 -2.14 0.00 0.00 52.86 50.72 3imo s ASN 88 Cb 0.00 -0.53 -0.23 0.00 1.28 0.00 0.00 41.25 41.77 3imo s ASN 88 CO 0.00 -0.10 0.49 2.30 -2.04 0.00 0.00 177.10 177.75 3imo n ILE 89 N 4.52 1.47 -1.54 0.54 -0.00 -1.26 -5.00 119.36 118.09 3imo n ILE 89 Ca -0.17 -0.80 -0.44 0.00 -0.00 0.00 0.00 62.75 61.34 3imo n ILE 89 Cb 0.50 -0.81 -0.05 0.00 -0.00 0.00 0.00 39.64 39.29 3imo n ILE 89 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 3imo n GLN 90 N -2.92 1.52 -4.02 6.28 6.02 -1.26 -4.92 117.38 118.07 3imo n GLN 90 Ca -0.21 0.37 -0.17 0.00 -0.01 0.00 0.00 57.00 56.98 3imo n GLN 90 Cb 1.06 -2.99 -0.16 0.00 1.02 0.00 0.00 30.24 29.16 3imo n GLN 90 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 3imo s GLY 91 N 8.62 0.28 0.07 1.08 0.00 -1.26 -4.50 107.32 111.62 3imo s GLY 91 Ca 1.04 0.06 0.08 0.00 0.00 0.00 0.00 44.72 45.89 3imo s GLY 91 CO 0.38 0.42 -0.17 -1.31 0.00 0.00 0.00 173.10 172.42 3imo s ASN 92 N 0.78 3.91 -0.01 1.64 0.01 -1.16 -4.81 114.94 115.30 3imo s ASN 92 Ca -0.09 -0.46 -0.30 0.00 -0.71 0.00 0.00 52.86 51.30 3imo s ASN 92 Cb -0.12 -0.62 -0.07 0.00 0.41 0.00 0.00 41.25 40.85 3imo s ASN 92 CO -0.01 0.22 1.78 -0.89 -1.51 0.00 0.00 177.10 176.69 3imo s THR 93 N -1.03 3.32 -0.15 1.60 2.01 -1.26 -2.65 115.64 117.48 3imo s THR 93 Ca 0.16 0.42 0.19 0.00 0.31 0.00 0.00 61.69 62.77 3imo s THR 93 Cb -0.11 -3.27 -0.27 0.00 0.01 0.00 0.00 72.50 68.87 3imo s THR 93 CO 0.08 -0.03 0.21 2.30 -0.69 0.00 0.00 174.62 176.48 3imo n ILE 94 N 5.46 1.07 -3.81 1.82 -5.35 -0.09 -4.97 119.36 113.49 3imo n ILE 94 Ca 0.18 -0.77 -0.12 0.00 -0.27 0.00 0.00 62.75 61.77 3imo n ILE 94 Cb 0.42 -0.38 -0.09 0.00 -1.74 0.00 0.00 39.64 37.85 3imo n ILE 94 CO 0.00 0.00 0.00 -1.00 -1.76 0.00 0.00 176.55 173.79 3imo s HIS 95 N -2.75 -0.08 -0.02 4.28 3.76 -1.13 -5.04 115.29 114.32 3imo s HIS 95 Ca -0.09 0.08 0.05 0.00 -0.15 0.00 0.00 55.06 54.95 3imo s HIS 95 Cb 0.08 0.03 -0.01 0.00 1.11 0.00 0.00 32.58 33.79 3imo s HIS 95 CO 0.85 -0.35 -0.18 -1.21 -0.85 0.00 0.00 174.74 173.00 3imo s GLU 96 N -1.38 1.46 0.05 1.40 2.02 -1.26 -0.87 118.70 120.12 3imo s GLU 96 Ca -0.14 -0.63 0.07 0.00 0.02 0.00 0.00 54.97 54.28 3imo s GLU 96 Cb -0.06 -1.40 -0.02 0.00 0.10 0.00 0.00 34.13 32.74 3imo s GLU 96 CO 0.03 0.38 -0.18 -0.06 0.02 0.00 0.00 175.26 175.44 3imo s PHE 97 N -0.39 1.61 0.00 1.61 0.08 0.01 -4.94 117.98 115.95 3imo s PHE 97 Ca 0.06 -0.37 0.00 0.00 0.12 0.00 0.00 56.93 56.74 3imo s PHE 97 Cb -0.07 -0.95 0.00 0.00 -0.57 0.00 0.00 43.02 41.43 3imo s PHE 97 CO -0.01 0.08 0.00 -0.40 -0.10 0.00 0.00 175.22 174.80 3imo n ASP 98 N 1.80 0.00 0.20 1.36 5.68 -1.26 -1.13 116.55 123.21 3imo n ASP 98 Ca -0.18 -0.70 0.15 0.00 -0.50 0.00 0.00 54.79 53.56 3imo n ASP 98 Cb 0.54 0.00 0.61 0.00 -1.14 0.00 0.00 41.12 41.12 3imo n ASP 98 CO 0.00 0.00 0.00 0.78 -1.33 0.00 0.00 177.20 176.65 3imo h ASN 99 N 0.00 0.00 1.23 -1.12 2.35 -0.94 -1.44 115.58 115.66 3imo h ASN 99 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3imo h ASN 99 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 3imo h ASN 99 CO 0.00 0.00 -0.11 -1.54 -1.65 0.00 0.00 177.43 174.13 3imo n SER 100 N -2.64 0.58 -4.61 5.81 3.41 -1.26 -4.79 113.62 110.12 3imo n SER 100 Ca 0.01 0.46 -0.43 0.00 -0.26 0.00 0.00 58.87 58.65 3imo n SER 100 Cb 0.25 -0.55 -0.03 0.00 -0.26 0.00 0.00 64.21 63.63 3imo n SER 100 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3imo s THR 101 N -3.08 3.36 0.27 6.66 2.01 -0.54 -4.94 115.64 119.38 3imo s THR 101 Ca 0.11 0.38 -0.30 0.00 0.31 0.00 0.00 61.69 62.19 3imo s THR 101 Cb 0.14 -3.42 -0.13 0.00 0.01 0.00 0.00 72.50 69.11 3imo s THR 101 CO 0.60 -0.23 1.43 -2.65 -0.69 0.00 0.00 174.62 173.09 3imo n PRO 102 N 8.23 2.22 -0.25 4.92 -0.02 -1.26 -4.87 135.00 143.97 3imo n PRO 102 Ca 0.23 0.79 0.04 0.00 -2.02 0.00 0.00 63.50 62.55 3imo n PRO 102 Cb 0.45 -2.46 0.28 0.00 -0.02 0.00 0.00 33.50 31.75 3imo n PRO 102 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3imo h LEU 103 N 4.00 0.81 -1.38 2.45 5.85 -1.95 -1.25 115.31 123.84 3imo h LEU 103 Ca -0.46 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.25 3imo h LEU 103 Cb 1.26 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 42.10 3imo h LEU 103 CO 0.74 0.53 0.21 0.77 -0.34 0.00 0.00 178.44 180.35 3imo h SER 104 N 0.93 0.57 0.08 1.25 4.64 -2.00 -0.99 113.55 118.04 3imo h SER 104 Ca 0.35 -0.05 -0.19 0.00 -0.47 0.00 0.00 61.79 61.42 3imo h SER 104 Cb 0.18 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.13 3imo h SER 104 CO -0.12 0.50 -0.72 0.50 -0.87 0.00 0.00 176.83 176.12 3imo h LYS 105 N 0.64 0.56 -0.45 4.77 3.64 -1.61 -1.88 116.57 122.24 3imo h LYS 105 Ca 0.16 -0.44 -0.03 0.00 -1.27 0.00 0.00 60.65 59.07 3imo h LYS 105 Cb 0.08 0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.97 3imo h LYS 105 CO -0.02 1.07 0.18 1.25 -2.27 0.00 0.00 179.45 179.65 3imo h LEU 106 N 0.39 0.63 -0.66 5.20 5.85 -0.76 -1.32 115.31 124.64 3imo h LEU 106 Ca -0.03 -0.17 -0.02 0.00 0.84 0.00 0.00 57.88 58.50 3imo h LEU 106 Cb 1.31 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 42.14 3imo h LEU 106 CO 0.13 0.63 0.33 0.58 -0.34 0.00 0.00 178.44 179.78 3imo h VAL 107 N 0.59 1.22 -0.66 1.05 2.07 -1.19 -1.92 116.25 117.41 3imo h VAL 107 Ca 0.15 -0.58 0.03 0.00 0.82 0.00 0.00 66.70 67.12 3imo h VAL 107 Cb 0.20 0.40 -0.04 0.00 -1.52 0.00 0.00 31.29 30.33 3imo h VAL 107 CO -0.01 0.25 0.40 -0.08 0.02 0.00 0.00 177.57 178.15 3imo h GLU 108 N 0.90 0.76 0.09 1.57 4.81 -1.06 0.45 114.58 122.10 3imo h GLU 108 Ca 0.23 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.41 3imo h GLU 108 Cb 0.09 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.30 3imo h GLU 108 CO -0.03 0.50 -0.04 0.82 -0.73 0.00 0.00 179.01 179.53 3imo h ILE 109 N 0.78 0.97 0.00 2.32 2.04 -0.92 -3.00 117.51 119.71 3imo h ILE 109 Ca 0.27 -0.21 -0.07 0.00 1.00 0.00 0.00 64.86 65.85 3imo h ILE 109 Cb 0.04 1.11 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 3imo h ILE 109 CO -0.12 0.05 -0.34 -0.26 0.00 0.00 0.00 178.15 177.49 3imo h PHE 110 N -0.22 0.00 -0.47 1.37 -1.00 -1.12 -2.80 116.94 112.70 3imo h PHE 110 Ca -0.01 0.00 -0.09 0.00 2.81 0.00 0.00 57.97 60.67 3imo h PHE 110 Cb 0.18 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.72 3imo h PHE 110 CO -0.04 0.34 -0.09 -0.22 -1.61 0.00 0.00 178.31 176.69 3imo h LYS 111 N 0.00 0.84 -0.01 1.51 3.64 -0.82 -3.09 116.57 118.64 3imo h LYS 111 Ca -0.00 -0.27 0.00 0.00 -1.27 0.00 0.00 60.65 59.10 3imo h LYS 111 Cb 0.86 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.61 3imo h LYS 111 CO 0.04 0.89 -0.15 0.41 -2.27 0.00 0.00 179.45 178.37 3imo n GLY 112 N -0.44 -0.55 0.00 5.01 0.00 -1.07 -5.11 105.19 103.03 3imo n GLY 112 Ca 0.02 -0.38 0.04 0.00 0.00 0.00 0.00 46.02 45.70 3imo n GLY 112 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36