#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2giz n GLU 7 N 0.00 3.07 -1.88 4.33 -0.58 -1.26 -4.97 120.64 119.35 2giz n GLU 7 Ca 0.00 -2.58 -0.42 0.00 -0.42 0.00 0.00 57.16 53.75 2giz n GLU 7 Cb 0.00 -1.70 -0.02 0.00 -0.57 0.00 0.00 31.44 29.15 2giz n GLU 7 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 2giz s SER 8 N -0.93 6.51 0.00 1.62 0.15 -1.26 -4.79 113.70 115.00 2giz s SER 8 Ca 0.47 2.78 0.07 0.00 0.70 0.00 0.00 55.95 59.97 2giz s SER 8 Cb 0.27 -2.62 0.27 0.00 -1.71 0.00 0.00 66.02 62.24 2giz s SER 8 CO 0.27 -0.83 1.20 0.35 1.20 0.00 0.00 173.24 175.43 2giz n THR 9 N 2.82 0.20 1.18 6.45 -2.24 -1.26 -2.92 114.28 118.50 2giz n THR 9 Ca 0.10 -0.21 0.14 0.00 -2.27 0.00 0.00 64.05 61.81 2giz n THR 9 Cb 0.38 0.09 0.53 0.00 -2.10 0.00 0.00 70.33 69.23 2giz n THR 9 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2giz n ARG 10 N -0.07 0.30 -3.37 -0.78 1.74 -1.26 -4.64 116.66 108.58 2giz n ARG 10 Ca 0.07 -0.10 -0.38 0.00 -0.77 0.00 0.00 57.85 56.67 2giz n ARG 10 Cb 0.14 -1.50 -0.07 0.00 -1.02 0.00 0.00 32.46 30.02 2giz n ARG 10 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2giz s ARG 11 N -2.77 4.25 0.56 5.56 0.52 -1.15 -4.96 118.95 120.96 2giz s ARG 11 Ca 0.20 0.30 0.24 0.00 -0.52 0.00 0.00 55.73 55.94 2giz s ARG 11 Cb 0.19 -3.48 1.57 0.00 0.52 0.00 0.00 34.95 33.75 2giz s ARG 11 CO 0.55 0.07 2.20 0.87 0.02 0.00 0.00 175.30 179.01 2giz h LYS 12 N 7.01 0.00 -0.70 3.54 6.56 -1.91 -1.15 116.57 129.92 2giz h LYS 12 Ca -0.39 0.00 -0.07 0.00 -1.06 0.00 0.00 60.65 59.13 2giz h LYS 12 Cb 1.17 0.00 -0.03 0.00 -0.57 0.00 0.00 32.23 32.80 2giz h LYS 12 CO 0.74 0.00 0.15 -0.22 -2.06 0.00 0.00 179.45 178.06 2giz h LYS 13 N 0.00 1.13 -0.36 3.15 3.64 -1.95 -1.83 116.57 120.35 2giz h LYS 13 Ca 0.01 -0.29 -0.14 0.00 -1.27 0.00 0.00 60.65 58.97 2giz h LYS 13 Cb 0.04 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.71 2giz h LYS 13 CO -0.00 1.01 -0.32 -0.22 -2.27 0.00 0.00 179.45 177.65 2giz h LYS 14 N 1.07 0.81 -0.26 1.90 1.63 -1.52 -1.83 116.57 118.37 2giz h LYS 14 Ca 0.22 -0.38 0.01 0.00 -0.85 0.00 0.00 60.65 59.65 2giz h LYS 14 Cb 0.40 -0.01 -0.02 0.00 -0.60 0.00 0.00 32.23 32.01 2giz h LYS 14 CO 0.01 1.01 0.13 1.96 -3.45 0.00 0.00 179.45 179.12 2giz h GLN 15 N 0.68 0.27 -0.67 1.90 4.20 -1.14 -0.31 115.11 120.04 2giz h GLN 15 Ca 0.07 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.74 2giz h GLN 15 Cb 0.87 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.56 2giz h GLN 15 CO 0.08 0.18 0.34 -0.22 -0.67 0.00 0.00 178.83 178.53 2giz h LYS 16 N 0.28 0.96 -0.43 1.46 3.64 -1.19 -1.24 116.57 120.04 2giz h LYS 16 Ca 0.10 -0.13 -0.00 0.00 -1.27 0.00 0.00 60.65 59.35 2giz h LYS 16 Cb 0.02 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 31.64 2giz h LYS 16 CO -0.06 0.75 0.26 0.93 -2.27 0.00 0.00 179.45 179.06 2giz h GLU 17 N 0.93 0.58 -0.38 1.90 5.08 -0.85 0.22 114.58 122.05 2giz h GLU 17 Ca 0.23 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.53 2giz h GLU 17 Cb 0.09 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 2giz h GLU 17 CO -0.03 0.43 0.18 0.82 -1.00 0.00 0.00 179.01 179.41 2giz h ILE 18 N 0.57 1.17 -0.12 3.13 2.04 -0.78 -0.33 117.51 123.20 2giz h ILE 18 Ca 0.16 -0.49 -0.02 0.00 1.00 0.00 0.00 64.86 65.50 2giz h ILE 18 Cb -0.01 0.79 -0.00 0.00 -0.74 0.00 0.00 36.82 36.86 2giz h ILE 18 CO -0.03 0.18 -0.02 0.58 0.00 0.00 0.00 178.15 178.87 2giz h VAL 19 N 0.48 1.28 -0.80 1.67 2.07 -1.05 -2.38 116.25 117.52 2giz h VAL 19 Ca 0.13 -0.90 0.04 0.00 0.82 0.00 0.00 66.70 66.79 2giz h VAL 19 Cb 0.13 1.65 -0.05 0.00 -1.52 0.00 0.00 31.29 31.49 2giz h VAL 19 CO -0.02 0.26 0.50 0.44 0.02 0.00 0.00 177.57 178.77 2giz h ASP 20 N -0.08 0.80 -0.43 0.57 3.32 -0.46 -0.26 116.42 119.88 2giz h ASP 20 Ca 0.03 0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.03 2giz h ASP 20 Cb 0.41 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.78 2giz h ASP 20 CO 0.01 0.53 0.06 0.25 -1.72 0.00 0.00 179.24 178.38 2giz h LEU 21 N 0.94 0.69 -0.23 1.55 5.85 -1.03 0.18 115.31 123.27 2giz h LEU 21 Ca 0.33 -0.27 0.03 0.00 0.84 0.00 0.00 57.88 58.82 2giz h LEU 21 Cb 0.09 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 40.90 2giz h LEU 21 CO -0.14 0.78 0.04 0.45 -0.34 0.00 0.00 178.44 179.23 2giz h HIS 22 N 0.58 0.07 -0.33 1.25 3.86 -0.95 -0.21 115.15 119.42 2giz h HIS 22 Ca 0.13 0.01 -0.04 0.00 -1.16 0.00 0.00 60.37 59.31 2giz h HIS 22 Cb 0.39 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.85 2giz h HIS 22 CO 0.03 0.02 0.02 -0.91 0.86 0.00 0.00 177.93 177.94 2giz h ASN 23 N 0.13 0.46 -0.44 2.45 2.35 -0.75 -0.48 115.58 119.30 2giz h ASN 23 Ca 0.11 -0.08 -0.06 0.00 -0.55 0.00 0.00 56.30 55.72 2giz h ASN 23 Cb 0.11 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 38.34 2giz h ASN 23 CO -0.14 0.51 0.05 -1.28 -1.65 0.00 0.00 177.43 174.92 2giz h SER 24 N 0.48 0.71 -0.15 5.81 0.87 0.07 -0.88 113.55 120.46 2giz h SER 24 Ca 0.11 -0.27 -0.08 0.00 -1.23 0.00 0.00 61.79 60.31 2giz h SER 24 Cb 0.28 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.04 2giz h SER 24 CO 0.01 0.80 -0.17 -0.07 -0.53 0.00 0.00 176.83 176.88 2giz h LEU 25 N 0.59 0.54 -0.94 2.23 3.38 -0.53 -2.17 115.31 118.42 2giz h LEU 25 Ca 0.13 -0.16 -0.11 0.00 0.09 0.00 0.00 57.88 57.83 2giz h LEU 25 Cb 0.41 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 2giz h LEU 25 CO 0.01 0.72 -0.50 0.03 0.09 0.00 0.00 178.44 178.80 2giz h ARG 26 N 0.50 0.08 0.00 1.13 3.08 -0.79 -2.70 114.38 115.68 2giz h ARG 26 Ca 0.08 -0.05 -0.10 0.00 0.07 0.00 0.00 59.98 59.99 2giz h ARG 26 Cb 0.57 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.61 2giz h ARG 26 CO 0.04 0.56 -0.48 0.00 -1.07 0.00 0.00 179.97 179.02 2giz h ARG 27 N 0.07 0.00 -0.58 0.04 3.08 -0.77 -3.23 114.38 113.00 2giz h ARG 27 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2giz h ARG 27 Cb 0.91 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.96 2giz h ARG 27 CO 0.07 0.48 0.00 0.54 -1.07 0.00 0.00 179.97 179.99 2giz n ARG 28 N -3.52 2.57 -1.65 0.04 1.74 -0.85 -4.99 116.66 110.00 2giz n ARG 28 Ca -0.00 -2.04 -0.37 0.00 -0.77 0.00 0.00 57.85 54.67 2giz n ARG 28 Cb 0.59 -1.54 0.07 0.00 -1.02 0.00 0.00 32.46 30.56 2giz n ARG 28 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 2giz n VAL 29 N 0.99 4.42 -3.67 1.55 0.24 -1.15 -5.02 118.33 115.69 2giz n VAL 29 Ca 0.19 -0.48 -0.15 0.00 -2.04 0.00 0.00 64.34 61.86 2giz n VAL 29 Cb 0.55 -1.37 -0.15 0.00 -1.47 0.00 0.00 33.84 31.41 2giz n VAL 29 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2giz s SER 30 N -1.41 0.54 0.97 -1.34 0.15 -1.26 -3.80 113.70 107.56 2giz s SER 30 Ca 0.80 0.42 -0.12 0.00 0.70 0.00 0.00 55.95 57.76 2giz s SER 30 Cb -0.38 0.41 0.18 0.00 -1.71 0.00 0.00 66.02 64.51 2giz s SER 30 CO 0.43 -0.23 1.09 -2.16 1.20 0.00 0.00 173.24 173.56 2giz s PRO 31 N 2.23 0.60 0.61 5.44 0.04 -1.26 -4.94 135.00 137.72 2giz s PRO 31 Ca 0.01 0.99 -0.17 0.00 0.04 0.00 0.00 61.00 61.87 2giz s PRO 31 Cb -0.12 -1.72 -0.02 0.00 0.04 0.00 0.00 34.50 32.68 2giz s PRO 31 CO -0.07 -2.74 1.11 0.95 0.04 0.00 0.00 177.00 176.30 2giz s THR 32 N -2.74 3.25 -0.06 1.26 -4.23 -1.25 -4.99 115.64 106.87 2giz s THR 32 Ca 0.66 0.65 0.02 0.00 -1.18 0.00 0.00 61.69 61.84 2giz s THR 32 Cb -0.21 -3.19 -0.03 0.00 1.34 0.00 0.00 72.50 70.41 2giz s THR 32 CO 0.59 -0.29 -0.10 0.00 -0.54 0.00 0.00 174.62 174.28 2giz s ALA 33 N -2.13 2.83 -1.13 3.99 0.00 -1.20 -2.40 121.76 121.71 2giz s ALA 33 Ca 0.69 -0.93 0.22 0.00 0.00 0.00 0.00 51.96 51.94 2giz s ALA 33 Cb -0.21 -1.12 -0.10 0.00 0.00 0.00 0.00 23.12 21.69 2giz s ALA 33 CO 0.36 0.54 1.00 -1.13 0.00 0.00 0.00 175.76 176.53 2giz n SER 34 N 2.34 1.06 -1.31 0.00 3.41 -0.42 -3.35 113.62 115.35 2giz n SER 34 Ca -0.18 -0.97 0.04 0.00 -0.26 0.00 0.00 58.87 57.51 2giz n SER 34 Cb 0.53 0.84 0.07 0.00 -0.26 0.00 0.00 64.21 65.38 2giz n SER 34 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 2giz n ASN 35 N -1.32 1.24 -4.60 4.04 6.94 -1.26 -1.07 115.26 119.23 2giz n ASN 35 Ca 0.05 -2.51 -0.43 0.00 -0.02 0.00 0.00 54.58 51.66 2giz n ASN 35 Cb 0.35 -0.36 -0.02 0.00 -2.36 0.00 0.00 39.78 37.38 2giz n ASN 35 CO 0.00 0.00 0.00 -0.32 -1.03 0.00 0.00 177.26 175.91 2giz s MET 36 N -0.98 3.60 0.46 -3.83 1.75 -1.26 -4.74 119.30 114.31 2giz s MET 36 Ca 0.35 0.82 -0.23 0.00 -1.25 0.00 0.00 55.69 55.38 2giz s MET 36 Cb 0.38 -4.00 -0.07 0.00 2.84 0.00 0.00 34.83 33.98 2giz s MET 36 CO -0.14 -1.53 1.18 -0.51 -0.65 0.00 0.00 175.02 173.37 2giz s LEU 37 N 5.19 4.02 0.18 4.11 1.43 -1.04 -0.06 118.68 132.52 2giz s LEU 37 Ca 0.57 2.34 -0.30 0.00 -1.03 0.00 0.00 54.13 55.71 2giz s LEU 37 Cb -0.12 -4.22 -0.07 0.00 0.03 0.00 0.00 46.19 41.81 2giz s LEU 37 CO 0.32 -0.93 1.00 -0.75 0.23 0.00 0.00 176.35 176.23 2giz s LYS 38 N -2.67 4.71 0.37 1.70 2.20 0.24 -4.71 119.74 121.59 2giz s LYS 38 Ca 0.63 1.56 -0.07 0.00 -0.36 0.00 0.00 55.97 57.73 2giz s LYS 38 Cb -0.29 -3.31 -0.05 0.00 -1.51 0.00 0.00 37.83 32.66 2giz s LYS 38 CO 0.36 0.27 0.68 -1.64 -0.36 0.00 0.00 175.35 174.66 2giz s MET 39 N -0.56 3.67 0.04 4.03 -1.94 -1.26 -4.70 119.30 118.58 2giz s MET 39 Ca 0.46 0.21 -0.02 0.00 -1.71 0.00 0.00 55.69 54.63 2giz s MET 39 Cb -0.26 -2.50 -0.03 0.00 2.01 0.00 0.00 34.83 34.05 2giz s MET 39 CO 0.33 0.04 -0.00 -1.83 -0.01 0.00 0.00 175.02 173.54 2giz s GLU 40 N -3.91 0.55 0.36 2.03 -1.05 0.27 -4.97 118.70 111.98 2giz s GLU 40 Ca 0.47 -1.00 -0.27 0.00 -0.15 0.00 0.00 54.97 54.02 2giz s GLU 40 Cb -0.10 0.20 -0.09 0.00 -0.44 0.00 0.00 34.13 33.69 2giz s GLU 40 CO 0.33 -0.11 1.21 -0.46 0.95 0.00 0.00 175.26 177.18 2giz s TRP 41 N -3.16 3.14 -0.33 4.83 -0.11 -1.26 -1.55 118.94 120.51 2giz s TRP 41 Ca -0.00 1.53 0.01 0.00 1.22 0.00 0.00 56.10 58.86 2giz s TRP 41 Cb 0.02 -3.48 0.10 0.00 -1.50 0.00 0.00 33.47 28.61 2giz s TRP 41 CO -0.07 -1.40 0.09 -0.47 -4.62 0.00 0.00 176.95 170.48 2giz s TYR 42 N -1.27 2.33 0.29 5.86 5.04 0.10 -4.79 117.35 124.92 2giz s TYR 42 Ca 0.52 -2.14 0.03 0.00 -2.44 0.00 0.00 57.07 53.04 2giz s TYR 42 Cb -0.34 -2.08 0.73 0.00 0.35 0.00 0.00 41.96 40.61 2giz s TYR 42 CO 0.44 -0.89 1.67 -1.35 -1.34 0.00 0.00 175.55 174.07 2giz h PRO 43 N 7.89 0.27 -0.80 4.97 0.11 -1.95 -0.83 132.00 141.66 2giz h PRO 43 Ca -0.10 -0.02 0.03 0.00 0.11 0.00 0.00 66.00 66.03 2giz h PRO 43 Cb 1.01 -0.06 -0.05 0.00 0.11 0.00 0.00 31.00 32.01 2giz h PRO 43 CO 0.49 0.18 0.51 0.93 -0.21 0.00 0.00 178.00 179.90 2giz h GLU 44 N 0.28 0.96 -0.11 1.05 3.07 -1.97 0.34 114.58 118.20 2giz h GLU 44 Ca 0.56 -0.06 -0.18 0.00 -0.50 0.00 0.00 59.36 59.19 2giz h GLU 44 Cb 1.11 -0.22 -0.00 0.00 -0.84 0.00 0.00 28.75 28.80 2giz h GLU 44 CO -0.60 0.63 -0.67 0.00 -1.40 0.00 0.00 179.01 176.97 2giz h ALA 45 N 1.34 0.63 -0.68 3.43 0.00 -1.54 -1.93 119.26 120.51 2giz h ALA 45 Ca 0.32 -0.57 -0.05 0.00 0.00 0.00 0.00 54.91 54.61 2giz h ALA 45 Cb 0.02 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 2giz h ALA 45 CO -0.12 0.73 0.21 0.00 0.00 0.00 0.00 179.25 180.08 2giz h ALA 46 N 0.95 0.89 -0.43 0.00 0.00 -0.61 0.17 119.26 120.23 2giz h ALA 46 Ca -0.02 -0.22 -0.13 0.00 0.00 0.00 0.00 54.91 54.54 2giz h ALA 46 Cb 1.23 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 2giz h ALA 46 CO 0.12 0.57 -0.26 0.77 0.00 0.00 0.00 179.25 180.45 2giz h SER 47 N 0.99 0.94 -0.47 0.00 0.02 -0.89 -0.43 113.55 113.71 2giz h SER 47 Ca 0.22 -0.37 -0.12 0.00 -0.84 0.00 0.00 61.79 60.68 2giz h SER 47 Cb 0.30 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.56 2giz h SER 47 CO -0.01 1.14 -0.18 -1.13 -1.14 0.00 0.00 176.83 175.51 2giz h ASN 48 N 0.78 0.98 -0.37 3.07 -1.24 -1.05 -1.11 115.58 116.64 2giz h ASN 48 Ca 0.09 -0.35 -0.10 0.00 0.71 0.00 0.00 56.30 56.65 2giz h ASN 48 Cb 0.82 -0.27 -0.02 0.00 0.73 0.00 0.00 38.32 39.58 2giz h ASN 48 CO 0.07 1.13 -0.14 0.00 -1.29 0.00 0.00 177.43 177.21 2giz h ALA 49 N 0.94 0.91 -0.37 1.57 0.00 -0.52 -1.98 119.26 119.82 2giz h ALA 49 Ca 0.12 -0.34 -0.05 0.00 0.00 0.00 0.00 54.91 54.64 2giz h ALA 49 Cb 0.74 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 2giz h ALA 49 CO 0.06 0.63 0.02 1.49 0.00 0.00 0.00 179.25 181.44 2giz h GLU 50 N 0.74 0.64 -0.39 0.00 4.81 -0.87 0.14 114.58 119.65 2giz h GLU 50 Ca 0.12 -0.19 0.02 0.00 -0.13 0.00 0.00 59.36 59.17 2giz h GLU 50 Cb 0.65 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.94 2giz h GLU 50 CO 0.05 0.73 0.21 0.00 -0.73 0.00 0.00 179.01 179.27 2giz h ARG 51 N 0.46 0.42 -0.28 1.92 3.08 -1.03 -0.80 114.38 118.15 2giz h ARG 51 Ca 0.11 -0.03 -0.05 0.00 0.07 0.00 0.00 59.98 60.08 2giz h ARG 51 Cb 0.43 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.38 2giz h ARG 51 CO 0.02 0.28 -0.01 2.35 -1.07 0.00 0.00 179.97 181.53 2giz h TRP 52 N 0.43 0.55 -0.98 3.04 2.91 -1.14 -3.05 115.95 117.71 2giz h TRP 52 Ca 0.16 -0.10 0.02 0.00 1.13 0.00 0.00 58.89 60.09 2giz h TRP 52 Cb 0.03 -0.14 -0.05 0.00 -0.51 0.00 0.00 29.16 28.49 2giz h TRP 52 CO -0.08 0.66 0.65 0.00 -1.03 0.00 0.00 178.44 178.64 2giz h ALA 53 N 0.82 1.31 0.00 2.65 0.00 -0.55 -1.71 119.26 121.78 2giz h ALA 53 Ca 0.08 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2giz h ALA 53 Cb 0.45 -0.39 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2giz h ALA 53 CO 0.02 0.63 0.00 0.09 0.00 0.00 0.00 179.25 179.98 2giz n ASN 54 N -4.40 0.09 0.14 0.00 3.02 -0.32 -1.36 115.26 112.43 2giz n ASN 54 Ca 0.12 0.53 0.13 0.00 -0.03 0.00 0.00 54.58 55.32 2giz n ASN 54 Cb 0.03 -0.54 0.33 0.00 -0.61 0.00 0.00 39.78 38.98 2giz n ASN 54 CO 0.00 0.00 0.00 0.71 -2.62 0.00 0.00 177.26 175.35 2giz h THR 55 N 0.00 0.00 -4.10 3.41 1.35 -1.27 -3.47 112.91 108.82 2giz h THR 55 Ca 0.00 -0.64 -0.38 0.00 -0.55 0.00 0.00 66.41 64.84 2giz h THR 55 Cb 0.17 1.63 0.01 0.00 -1.73 0.00 0.00 68.15 68.23 2giz h THR 55 CO 0.00 0.00 -0.54 0.00 -0.25 0.00 0.00 175.52 174.73 2giz h SER 57 N -0.72 0.00 -4.26 0.00 4.64 -1.81 -3.46 113.55 107.93 2giz h SER 57 Ca -0.47 0.00 -0.41 0.00 -0.47 0.00 0.00 61.79 60.44 2giz h SER 57 Cb 1.33 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 63.46 2giz h SER 57 CO 0.54 0.28 -0.59 0.18 -0.87 0.00 0.00 176.83 176.36 2giz n LEU 58 N -4.16 -2.50 -4.04 5.97 4.77 -1.26 -4.95 117.00 110.84 2giz n LEU 58 Ca -0.02 -0.24 -0.11 0.00 -0.03 0.00 0.00 56.01 55.61 2giz n LEU 58 Cb 0.33 -2.94 -0.05 0.00 -2.33 0.00 0.00 43.42 38.44 2giz n LEU 58 CO 0.37 0.15 0.15 0.21 -1.33 0.00 0.00 177.39 176.94 2giz s ASN 59 N -2.59 0.30 0.43 -1.43 2.47 -1.26 -5.08 114.94 107.78 2giz s ASN 59 Ca 0.25 -1.18 -0.22 0.00 0.42 0.00 0.00 52.86 52.13 2giz s ASN 59 Cb -0.11 0.61 -0.10 0.00 -1.45 0.00 0.00 41.25 40.20 2giz s ASN 59 CO 0.31 -1.21 0.97 -1.00 -3.72 0.00 0.00 177.10 172.46 2giz s HIS 60 N -3.57 3.29 0.49 0.43 3.76 -1.26 -5.04 115.29 113.39 2giz s HIS 60 Ca 0.26 1.63 -0.08 0.00 -0.15 0.00 0.00 55.06 56.72 2giz s HIS 60 Cb -0.00 -2.92 -0.05 0.00 1.11 0.00 0.00 32.58 30.72 2giz s HIS 60 CO 0.13 -0.24 0.84 -1.54 -0.85 0.00 0.00 174.74 173.08 2giz s SER 61 N -2.04 6.34 0.55 1.40 1.04 -1.26 -5.03 113.70 114.70 2giz s SER 61 Ca 0.61 1.11 -0.20 0.00 0.48 0.00 0.00 55.95 57.95 2giz s SER 61 Cb -0.12 -2.32 -0.05 0.00 0.10 0.00 0.00 66.02 63.63 2giz s SER 61 CO 0.16 -0.59 1.21 -2.84 0.98 0.00 0.00 173.24 172.17 2giz s PRO 62 N -4.56 3.20 0.27 4.02 0.02 -1.26 -4.91 135.00 131.79 2giz s PRO 62 Ca 0.50 1.84 -0.00 0.00 0.02 0.00 0.00 61.00 63.36 2giz s PRO 62 Cb -0.10 -2.07 0.53 0.00 0.02 0.00 0.00 34.50 32.87 2giz s PRO 62 CO 0.42 -1.03 1.81 -0.44 -0.33 0.00 0.00 177.00 177.43 2giz h ASP 63 N 1.23 0.76 0.18 2.53 3.32 -1.96 -1.26 116.42 121.21 2giz h ASP 63 Ca -0.50 0.06 0.00 0.00 0.02 0.00 0.00 57.03 56.61 2giz h ASP 63 Cb 1.28 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.75 2giz h ASP 63 CO 0.57 0.38 0.00 -0.55 -1.72 0.00 0.00 179.24 177.92 2giz h ASN 64 N 0.83 0.00 -0.23 6.45 7.08 -1.98 -0.44 115.58 127.29 2giz h ASN 64 Ca 0.47 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.69 2giz h ASN 64 Cb 0.54 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.78 2giz h ASN 64 CO -0.29 0.00 0.00 0.18 -2.08 0.00 0.00 177.43 175.24 2giz n LEU 65 N -2.97 2.28 -0.58 6.14 7.99 -0.48 -4.07 117.00 125.32 2giz n LEU 65 Ca -0.02 -0.95 0.06 0.00 -0.01 0.00 0.00 56.01 55.09 2giz n LEU 65 Cb 0.11 -0.15 0.18 0.00 -0.11 0.00 0.00 43.42 43.45 2giz n LEU 65 CO 0.20 0.48 0.37 0.54 -1.51 0.00 0.00 177.39 177.47 2giz n ARG 66 N 0.73 1.40 -3.37 3.23 1.74 -0.18 -4.94 116.66 115.29 2giz n ARG 66 Ca 0.17 -3.07 -0.44 0.00 -0.77 0.00 0.00 57.85 53.74 2giz n ARG 66 Cb 0.43 -1.47 -0.08 0.00 -1.02 0.00 0.00 32.46 30.32 2giz n ARG 66 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2giz s VAL 67 N -2.90 5.20 -0.21 1.55 1.01 -1.24 -0.46 120.40 123.34 2giz s VAL 67 Ca 0.36 -0.98 -0.05 0.00 0.00 0.00 0.00 61.98 61.31 2giz s VAL 67 Cb 0.35 -4.13 -0.02 0.00 0.00 0.00 0.00 36.38 32.58 2giz s VAL 67 CO -0.06 -0.59 -0.00 -0.76 0.00 0.00 0.00 175.10 173.69 2giz s LEU 68 N 1.75 3.22 -1.55 3.92 1.43 0.24 -4.52 118.68 123.16 2giz s LEU 68 Ca 0.05 -0.23 -0.12 0.00 -1.03 0.00 0.00 54.13 52.81 2giz s LEU 68 Cb -0.23 -1.82 0.09 0.00 0.03 0.00 0.00 46.19 44.26 2giz s LEU 68 CO 0.07 0.05 0.80 -0.62 0.23 0.00 0.00 176.35 176.88 2giz n GLU 69 N 4.35 -4.28 -0.13 1.70 1.02 -1.26 -1.16 120.64 120.88 2giz n GLU 69 Ca -0.17 0.49 0.00 0.00 -0.02 0.00 0.00 57.16 57.46 2giz n GLU 69 Cb 0.52 -5.17 0.00 0.00 -0.02 0.00 0.00 31.44 26.77 2giz n GLU 69 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2giz n GLY 70 N -1.63 2.15 3.62 0.62 0.00 -1.26 -5.03 105.19 103.67 2giz n GLY 70 Ca -0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.64 2giz n GLY 70 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2giz s ILE 71 N -2.93 4.55 -0.07 -0.61 1.01 -0.31 -5.02 121.20 117.83 2giz s ILE 71 Ca 0.00 -0.13 -0.30 0.00 0.00 0.00 0.00 60.65 60.23 2giz s ILE 71 Cb 0.00 -3.02 -0.04 0.00 0.01 0.00 0.00 42.46 39.41 2giz s ILE 71 CO 0.00 0.50 1.37 -1.58 0.00 0.00 0.00 174.94 175.22 2giz s GLN 72 N 0.12 4.26 0.20 2.79 2.00 -1.26 -0.59 119.66 127.18 2giz s GLN 72 Ca 0.03 1.86 0.07 0.00 -2.00 0.00 0.00 55.36 55.32 2giz s GLN 72 Cb -0.13 -3.70 -0.04 0.00 0.80 0.00 0.00 33.01 29.95 2giz s GLN 72 CO 0.01 -0.64 0.09 0.00 -0.50 0.00 0.00 175.29 174.26 2giz n GLY 74 N -0.55 1.14 3.63 0.00 0.00 0.25 -4.67 105.19 104.98 2giz n GLY 74 Ca -0.08 -2.06 -0.14 0.00 0.00 0.00 0.00 46.02 43.74 2giz n GLY 74 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2giz s GLU 75 N -3.66 0.85 -0.02 1.61 2.12 -1.26 -1.43 118.70 116.90 2giz s GLU 75 Ca 0.34 0.96 0.04 0.00 0.36 0.00 0.00 54.97 56.67 2giz s GLU 75 Cb -0.02 0.41 -0.00 0.00 0.26 0.00 0.00 34.13 34.78 2giz s GLU 75 CO 0.22 -0.11 -0.13 -1.12 -0.54 0.00 0.00 175.26 173.58 2giz s SER 76 N 0.31 1.64 0.24 -1.70 0.01 -0.17 -5.00 113.70 109.02 2giz s SER 76 Ca -0.00 -0.26 0.07 0.00 1.31 0.00 0.00 55.95 57.07 2giz s SER 76 Cb -0.05 -0.33 -0.05 0.00 0.21 0.00 0.00 66.02 65.80 2giz s SER 76 CO 0.01 0.13 -0.10 0.27 0.41 0.00 0.00 173.24 173.97 2giz s ILE 77 N -0.07 1.65 -0.08 1.44 -4.36 -1.26 -1.39 121.20 117.13 2giz s ILE 77 Ca 0.00 -2.17 -0.15 0.00 -0.26 0.00 0.00 60.65 58.08 2giz s ILE 77 Cb -0.08 -2.22 0.03 0.00 1.25 0.00 0.00 42.46 41.44 2giz s ILE 77 CO 0.00 -0.46 0.36 -0.47 0.24 0.00 0.00 174.94 174.62 2giz s TYR 78 N -3.02 -0.33 0.02 1.37 5.04 -0.45 -4.99 117.35 114.99 2giz s TYR 78 Ca 0.26 0.70 0.03 0.00 -2.44 0.00 0.00 57.07 55.62 2giz s TYR 78 Cb 0.01 0.13 -0.01 0.00 0.35 0.00 0.00 41.96 42.44 2giz s TYR 78 CO 0.09 -0.30 -0.09 0.00 -1.34 0.00 0.00 175.55 173.91 2giz s MET 79 N -0.51 0.66 0.03 4.97 0.23 -1.26 -0.25 119.30 123.18 2giz s MET 79 Ca -0.06 -0.51 -0.09 0.00 -1.03 0.00 0.00 55.69 53.99 2giz s MET 79 Cb -0.04 -0.60 0.00 0.00 -1.53 0.00 0.00 34.83 32.67 2giz s MET 79 CO 0.03 0.15 0.19 0.45 -2.03 0.00 0.00 175.02 173.80 2giz s SER 80 N -0.77 0.03 0.11 -1.18 0.15 -0.05 -5.00 113.70 106.98 2giz s SER 80 Ca -0.01 -0.34 -0.04 0.00 0.70 0.00 0.00 55.95 56.26 2giz s SER 80 Cb -0.06 0.28 -0.18 0.00 -1.71 0.00 0.00 66.02 64.35 2giz s SER 80 CO 0.00 -0.53 1.23 0.28 1.20 0.00 0.00 173.24 175.42 2giz h SER 81 N 3.57 0.45 -2.00 5.45 0.02 -1.92 -0.61 113.55 118.51 2giz h SER 81 Ca -0.32 -0.42 -0.61 0.00 -0.84 0.00 0.00 61.79 59.60 2giz h SER 81 Cb 1.19 -0.14 -0.13 0.00 0.14 0.00 0.00 62.40 63.46 2giz h SER 81 CO 0.47 1.27 -0.69 0.20 -1.14 0.00 0.00 176.83 176.94 2giz s ASN 82 N -7.10 3.79 0.28 3.07 0.01 -1.26 -4.39 114.94 109.34 2giz s ASN 82 Ca -0.05 -1.12 -0.29 0.00 -0.71 0.00 0.00 52.86 50.69 2giz s ASN 82 Cb 0.08 -0.38 -0.10 0.00 0.41 0.00 0.00 41.25 41.26 2giz s ASN 82 CO 0.87 -0.15 1.34 0.00 -1.51 0.00 0.00 177.10 177.66 2giz s ALA 83 N -2.57 3.54 0.12 0.60 0.00 -1.26 -4.81 121.76 117.38 2giz s ALA 83 Ca 0.32 1.25 0.07 0.00 0.00 0.00 0.00 51.96 53.60 2giz s ALA 83 Cb 0.00 -3.50 -0.04 0.00 0.00 0.00 0.00 23.12 19.58 2giz s ALA 83 CO 0.17 -0.65 -0.17 1.03 0.00 0.00 0.00 175.76 176.14 2giz s ARG 84 N -1.10 1.08 0.51 0.00 1.81 -1.26 -5.14 118.95 114.85 2giz s ARG 84 Ca 0.53 -1.23 -0.17 0.00 -1.72 0.00 0.00 55.73 53.14 2giz s ARG 84 Cb -0.40 -1.11 -0.08 0.00 -0.45 0.00 0.00 34.95 32.92 2giz s ARG 84 CO 0.48 0.23 0.99 0.95 -0.68 0.00 0.00 175.30 177.26 2giz s THR 85 N -1.81 4.45 0.41 0.02 -4.23 -1.26 -4.93 115.64 108.29 2giz s THR 85 Ca 0.09 1.24 0.09 0.00 -1.18 0.00 0.00 61.69 61.93 2giz s THR 85 Cb -0.07 -3.68 0.21 0.00 1.34 0.00 0.00 72.50 70.30 2giz s THR 85 CO 0.04 -0.61 1.99 -0.50 -0.54 0.00 0.00 174.62 175.00 2giz h TRP 86 N 1.05 0.31 -0.73 3.99 4.06 -1.99 -1.77 115.95 120.86 2giz h TRP 86 Ca -0.47 -0.01 -0.04 0.00 2.06 0.00 0.00 58.89 60.42 2giz h TRP 86 Cb 1.19 -0.10 -0.03 0.00 -1.00 0.00 0.00 29.16 29.22 2giz h TRP 86 CO 0.63 0.31 0.29 1.15 -3.56 0.00 0.00 178.44 177.26 2giz h THR 87 N 0.31 1.25 -0.26 1.49 2.02 -1.97 0.67 112.91 116.42 2giz h THR 87 Ca 0.07 -0.79 -0.03 0.00 0.77 0.00 0.00 66.41 66.43 2giz h THR 87 Cb 0.18 0.40 -0.01 0.00 -1.74 0.00 0.00 68.15 66.98 2giz h THR 87 CO 0.00 0.32 0.04 -0.08 0.37 0.00 0.00 175.52 176.17 2giz h GLU 88 N 1.05 0.43 -0.22 6.66 4.81 -1.73 -1.80 114.58 123.79 2giz h GLU 88 Ca 0.24 -0.12 0.02 0.00 -0.13 0.00 0.00 59.36 59.37 2giz h GLU 88 Cb 0.21 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.52 2giz h GLU 88 CO -0.02 0.56 0.10 0.82 -0.73 0.00 0.00 179.01 179.75 2giz h ILE 89 N 0.24 0.99 -0.33 2.32 1.08 -1.05 0.44 117.51 121.20 2giz h ILE 89 Ca 0.08 -0.08 -0.07 0.00 -0.39 0.00 0.00 64.86 64.40 2giz h ILE 89 Cb 0.34 0.74 -0.02 0.00 -3.07 0.00 0.00 36.82 34.82 2giz h ILE 89 CO 0.01 0.04 -0.11 0.40 -0.69 0.00 0.00 178.15 177.80 2giz h ILE 90 N 0.22 1.23 -0.12 -0.67 2.04 -0.86 -1.14 117.51 118.22 2giz h ILE 90 Ca 0.09 -1.04 -0.14 0.00 1.00 0.00 0.00 64.86 64.78 2giz h ILE 90 Cb 0.03 1.11 -0.01 0.00 -0.74 0.00 0.00 36.82 37.21 2giz h ILE 90 CO -0.07 0.34 -0.52 0.45 0.00 0.00 0.00 178.15 178.35 2giz h HIS 91 N 0.52 0.41 -0.30 1.37 3.86 -0.93 0.09 115.15 120.18 2giz h HIS 91 Ca 0.10 -0.14 -0.08 0.00 -1.16 0.00 0.00 60.37 59.09 2giz h HIS 91 Cb 0.50 -0.08 -0.02 0.00 1.06 0.00 0.00 27.41 28.87 2giz h HIS 91 CO 0.02 0.79 -0.15 -0.07 0.86 0.00 0.00 177.93 179.38 2giz h LEU 92 N 0.26 0.51 -0.12 2.43 3.38 -0.23 0.38 115.31 121.93 2giz h LEU 92 Ca 0.01 -0.14 -0.06 0.00 0.09 0.00 0.00 57.88 57.78 2giz h LEU 92 Cb 1.01 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.62 2giz h LEU 92 CO 0.09 0.68 -0.17 -0.50 0.09 0.00 0.00 178.44 178.63 2giz h TRP 93 N 0.48 0.39 -0.19 1.13 6.55 -0.91 -3.26 115.95 120.14 2giz h TRP 93 Ca 0.08 -0.13 -0.08 0.00 0.95 0.00 0.00 58.89 59.72 2giz h TRP 93 Cb 0.53 -0.08 -0.01 0.00 -0.86 0.00 0.00 29.16 28.74 2giz h TRP 93 CO 0.02 0.77 -0.21 1.25 -1.05 0.00 0.00 178.44 179.22 2giz h HIS 94 N -0.10 0.37 0.00 0.49 2.76 -0.66 -3.08 115.15 114.94 2giz h HIS 94 Ca 0.01 -0.06 0.00 0.00 -2.20 0.00 0.00 60.37 58.12 2giz h HIS 94 Cb 0.73 -0.10 0.00 0.00 1.55 0.00 0.00 27.41 29.59 2giz h HIS 94 CO 0.10 0.54 0.20 -0.25 -1.30 0.00 0.00 177.93 177.22 2giz n ASP 95 N -4.17 0.26 0.01 3.26 8.00 0.13 -1.12 116.55 122.93 2giz n ASP 95 Ca -0.00 0.52 0.05 0.00 0.71 0.00 0.00 54.79 56.07 2giz n ASP 95 Cb 0.35 -0.51 0.22 0.00 -0.02 0.00 0.00 41.12 41.16 2giz n ASP 95 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2giz n GLU 96 N -1.85 0.02 0.29 -1.24 1.02 -1.17 -1.74 120.64 115.96 2giz n GLU 96 Ca -0.01 0.37 0.15 0.00 -0.02 0.00 0.00 57.16 57.65 2giz n GLU 96 Cb 0.22 -1.54 0.86 0.00 -0.02 0.00 0.00 31.44 30.96 2giz n GLU 96 CO 0.00 0.00 0.00 0.10 1.18 0.00 0.00 177.13 178.41 2giz h TYR 97 N 0.00 0.00 0.00 -0.32 -0.00 -1.40 -0.64 116.97 114.61 2giz h TYR 97 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 58.73 58.70 2giz h TYR 97 Cb 0.16 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 36.88 2giz h TYR 97 CO 0.00 0.05 -0.14 0.87 -0.00 0.00 0.00 178.16 178.94 2giz h LYS 98 N 0.00 0.00 -0.36 0.10 1.57 -1.59 -2.51 116.57 113.77 2giz h LYS 98 Ca -0.00 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.61 2giz h LYS 98 Cb 0.15 0.00 -0.10 0.00 0.08 0.00 0.00 32.23 32.36 2giz h LYS 98 CO 0.01 0.14 -0.05 0.09 -0.57 0.00 0.00 179.45 179.07 2giz n ASN 99 N -3.51 2.64 -4.04 0.86 5.03 -0.26 -4.94 115.26 111.04 2giz n ASN 99 Ca -0.01 -3.70 -0.20 0.00 0.87 0.00 0.00 54.58 51.54 2giz n ASN 99 Cb 0.29 -0.63 -0.15 0.00 -1.02 0.00 0.00 39.78 38.27 2giz n ASN 99 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.26 175.55 2giz s PHE 100 N -3.21 0.98 -0.13 3.10 5.36 -0.95 -0.43 117.98 122.70 2giz s PHE 100 Ca 0.45 -0.20 0.00 0.00 -0.96 0.00 0.00 56.93 56.22 2giz s PHE 100 Cb 0.40 -0.65 0.02 0.00 -0.34 0.00 0.00 43.02 42.45 2giz s PHE 100 CO 0.01 -0.04 -0.13 0.08 -1.46 0.00 0.00 175.22 173.68 2giz s VAL 101 N -0.15 1.46 0.27 3.12 1.01 0.13 -4.88 120.40 121.35 2giz s VAL 101 Ca 0.02 -0.57 -0.31 0.00 0.00 0.00 0.00 61.98 61.13 2giz s VAL 101 Cb -0.05 -1.38 -0.12 0.00 0.00 0.00 0.00 36.38 34.83 2giz s VAL 101 CO -0.00 0.44 1.51 0.00 0.00 0.00 0.00 175.10 177.05 2giz n TYR 102 N 4.69 2.53 -0.48 5.22 9.36 -1.26 -0.70 117.16 136.52 2giz n TYR 102 Ca -0.17 0.33 0.00 0.00 3.32 0.00 0.00 57.90 61.39 2giz n TYR 102 Cb 0.50 -2.53 0.00 0.00 -0.63 0.00 0.00 39.34 36.68 2giz n TYR 102 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2giz n GLY 103 N 2.17 1.98 1.13 2.98 0.00 0.63 -4.73 105.19 109.35 2giz n GLY 103 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 2giz n GLY 103 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2giz n VAL 104 N -2.00 0.26 0.00 1.61 0.31 -0.69 -4.96 118.33 112.86 2giz n VAL 104 Ca 0.00 0.09 0.00 0.00 -0.01 0.00 0.00 64.34 64.42 2giz n VAL 104 Cb 0.00 -1.40 0.00 0.00 -0.91 0.00 0.00 33.84 31.53 2giz n VAL 104 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2giz n GLY 105 N 2.93 0.26 3.74 2.92 0.00 0.12 -4.89 105.19 110.27 2giz n GLY 105 Ca 0.00 -1.97 -0.42 0.00 0.00 0.00 0.00 46.02 43.63 2giz n GLY 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2giz s ALA 106 N -1.89 3.74 -0.22 4.61 0.00 -1.26 -0.69 121.76 126.04 2giz s ALA 106 Ca 0.00 1.47 -0.04 0.00 0.00 0.00 0.00 51.96 53.39 2giz s ALA 106 Cb 0.00 -3.62 0.10 0.00 0.00 0.00 0.00 23.12 19.59 2giz s ALA 106 CO 0.00 -0.87 0.21 1.21 0.00 0.00 0.00 175.76 176.31 2giz s ASN 107 N 0.62 1.69 0.78 0.00 3.04 0.43 -3.37 114.94 118.13 2giz s ASN 107 Ca 0.64 -0.42 -0.13 0.00 0.04 0.00 0.00 52.86 53.00 2giz s ASN 107 Cb -0.46 0.28 0.07 0.00 -1.54 0.00 0.00 41.25 39.60 2giz s ASN 107 CO 0.42 -0.35 1.15 -2.16 -3.04 0.00 0.00 177.10 173.12 2giz s PRO 108 N 2.29 1.96 0.46 0.43 0.04 -1.26 -4.13 135.00 134.80 2giz s PRO 108 Ca 0.07 1.50 -0.23 0.00 0.04 0.00 0.00 61.00 62.38 2giz s PRO 108 Cb -0.16 -1.84 -0.10 0.00 0.04 0.00 0.00 34.50 32.45 2giz s PRO 108 CO -0.17 -1.92 0.92 -2.30 0.04 0.00 0.00 177.00 173.58 2giz n PRO 109 N -3.28 1.13 0.00 0.56 -0.02 -1.22 -1.78 135.00 130.39 2giz n PRO 109 Ca 0.11 0.41 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 2giz n PRO 109 Cb 0.52 -1.98 0.00 0.00 -0.02 0.00 0.00 33.50 32.01 2giz n PRO 109 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2giz n GLY 110 N 1.31 2.84 3.70 -1.23 0.00 -1.26 -5.01 105.19 105.53 2giz n GLY 110 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 2giz n GLY 110 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2giz n SER 111 N 0.00 2.32 -4.70 1.61 7.64 -0.73 -4.94 113.62 114.82 2giz n SER 111 Ca 0.00 1.04 -0.42 0.00 1.01 0.00 0.00 58.87 60.50 2giz n SER 111 Cb 0.00 -1.50 -0.03 0.00 -1.01 0.00 0.00 64.21 61.67 2giz n SER 111 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2giz s VAL 112 N -1.26 4.86 0.00 0.44 1.01 -1.26 -4.76 120.40 119.43 2giz s VAL 112 Ca 0.65 1.91 0.00 0.00 0.00 0.00 0.00 61.98 64.54 2giz s VAL 112 Cb -0.48 -4.25 0.00 0.00 0.00 0.00 0.00 36.38 31.65 2giz s VAL 112 CO 0.55 0.09 0.12 0.35 0.00 0.00 0.00 175.10 176.21 2giz n THR 113 N 4.27 0.00 0.25 3.92 -2.24 -1.26 -4.82 114.28 114.41 2giz n THR 113 Ca 0.06 -0.15 0.09 0.00 -2.27 0.00 0.00 64.05 61.77 2giz n THR 113 Cb 0.50 1.58 0.65 0.00 -2.10 0.00 0.00 70.33 70.95 2giz n THR 113 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2giz h GLY 114 N 0.00 0.00 1.53 3.38 0.00 -1.95 -1.46 103.07 104.57 2giz h GLY 114 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.15 2giz h GLY 114 CO 0.00 0.00 -0.71 0.45 0.00 0.00 0.00 176.54 176.28 2giz h HIS 115 N 0.00 0.62 -0.03 5.60 3.86 -1.90 -1.90 115.15 121.41 2giz h HIS 115 Ca 0.01 -0.27 -0.02 0.00 -1.16 0.00 0.00 60.37 58.93 2giz h HIS 115 Cb 0.03 -0.10 0.00 0.00 1.06 0.00 0.00 27.41 28.40 2giz h HIS 115 CO 0.00 1.03 -0.06 -0.92 0.86 0.00 0.00 177.93 178.83 2giz h TYR 116 N 0.33 0.12 0.00 2.45 3.20 -1.36 -2.63 116.97 119.08 2giz h TYR 116 Ca -0.03 -0.04 -0.02 0.00 3.14 0.00 0.00 58.73 61.78 2giz h TYR 116 Cb 1.28 -0.02 -0.00 0.00 1.54 0.00 0.00 36.73 39.53 2giz h TYR 116 CO 0.05 0.65 -0.08 1.79 -1.64 0.00 0.00 178.16 178.93 2giz h THR 117 N -0.44 0.84 -0.14 1.81 1.35 -1.32 -1.20 112.91 113.81 2giz h THR 117 Ca 0.00 -0.28 -0.19 0.00 -0.55 0.00 0.00 66.41 65.39 2giz h THR 117 Cb 0.64 1.16 0.00 0.00 -1.73 0.00 0.00 68.15 68.22 2giz h THR 117 CO 0.01 0.07 -0.70 -0.61 -0.25 0.00 0.00 175.52 174.05 2giz h GLN 118 N 0.00 0.60 -0.55 4.72 5.75 -1.32 -1.48 115.11 122.82 2giz h GLN 118 Ca -0.00 -0.46 -0.04 0.00 -0.15 0.00 0.00 58.65 58.01 2giz h GLN 118 Cb 0.15 0.09 -0.03 0.00 1.07 0.00 0.00 27.48 28.76 2giz h GLN 118 CO 0.01 1.08 0.19 0.82 -2.65 0.00 0.00 178.83 178.28 2giz h ILE 119 N 0.42 1.21 -0.57 2.39 2.04 -0.86 -2.88 117.51 119.27 2giz h ILE 119 Ca -0.03 -0.70 -0.18 0.00 1.00 0.00 0.00 64.86 64.96 2giz h ILE 119 Cb 1.29 0.58 -0.10 0.00 -0.74 0.00 0.00 36.82 37.85 2giz h ILE 119 CO 0.13 0.27 0.16 1.33 0.00 0.00 0.00 178.15 180.04 2giz n VAL 120 N -4.31 2.73 -2.32 1.67 0.24 -0.77 -4.77 118.33 110.79 2giz n VAL 120 Ca 0.04 -1.94 -0.43 0.00 -2.04 0.00 0.00 64.34 59.98 2giz n VAL 120 Cb 0.18 -0.33 -0.02 0.00 -1.47 0.00 0.00 33.84 32.20 2giz n VAL 120 CO 0.00 0.00 0.00 0.86 -2.14 0.00 0.00 176.83 175.55 2giz s TRP 121 N -3.03 2.56 0.38 6.34 -0.11 -0.57 -4.51 118.94 120.01 2giz s TRP 121 Ca 0.50 0.79 0.10 0.00 1.22 0.00 0.00 56.10 58.72 2giz s TRP 121 Cb 0.41 -3.77 0.87 0.00 -1.50 0.00 0.00 33.47 29.48 2giz s TRP 121 CO 0.10 -2.15 1.91 0.10 -4.62 0.00 0.00 176.95 172.29 2giz h TYR 122 N 9.19 0.69 0.00 5.86 -0.00 -1.11 -2.38 116.97 129.22 2giz h TYR 122 Ca -0.29 0.02 -0.02 0.00 0.00 0.00 0.00 58.73 58.44 2giz h TYR 122 Cb 1.12 -0.22 -0.00 0.00 0.00 0.00 0.00 36.73 37.62 2giz h TYR 122 CO 0.86 0.29 -0.09 1.96 -0.00 0.00 0.00 178.16 181.18 2giz h GLN 123 N 0.62 0.00 -6.13 0.10 4.20 -1.85 -2.75 115.11 109.30 2giz h GLN 123 Ca 0.38 0.00 -0.57 0.00 0.06 0.00 0.00 58.65 58.52 2giz h GLN 123 Cb 0.62 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.35 2giz h GLN 123 CO -0.15 0.09 0.84 0.99 -0.67 0.00 0.00 178.83 179.94 2giz s THR 124 N -3.34 4.47 0.00 -0.54 2.01 -0.90 -4.25 115.64 113.10 2giz s THR 124 Ca 0.04 1.78 0.00 0.00 0.31 0.00 0.00 61.69 63.82 2giz s THR 124 Cb 0.07 -4.15 0.00 0.00 0.01 0.00 0.00 72.50 68.43 2giz s THR 124 CO 0.65 -0.15 0.58 0.00 -0.69 0.00 0.00 174.62 175.00 2giz n TYR 125 N 6.39 0.00 -4.36 4.92 0.18 -1.02 -4.70 117.16 118.57 2giz n TYR 125 Ca 0.13 -0.17 -0.21 0.00 1.88 0.00 0.00 57.90 59.53 2giz n TYR 125 Cb 0.45 -0.02 -0.16 0.00 -0.38 0.00 0.00 39.34 39.24 2giz n TYR 125 CO 0.00 0.00 0.00 1.03 -2.08 0.00 0.00 176.86 175.81 2giz s ARG 126 N -0.33 1.10 0.01 -3.48 0.52 -0.58 -0.56 118.95 115.62 2giz s ARG 126 Ca 0.00 -0.26 0.00 0.00 -0.52 0.00 0.00 55.73 54.95 2giz s ARG 126 Cb 0.00 -1.00 -0.01 0.00 0.52 0.00 0.00 34.95 34.46 2giz s ARG 126 CO 0.00 0.03 -0.03 0.00 0.02 0.00 0.00 175.30 175.32 2giz s ALA 127 N 0.56 0.14 -0.15 2.13 0.00 -0.59 -0.30 121.76 123.55 2giz s ALA 127 Ca -0.09 -0.38 -0.09 0.00 0.00 0.00 0.00 51.96 51.39 2giz s ALA 127 Cb -0.12 0.07 0.05 0.00 0.00 0.00 0.00 23.12 23.12 2giz s ALA 127 CO 0.01 -0.08 0.36 0.20 0.00 0.00 0.00 175.76 176.26 2giz s GLY 128 N -0.89 -0.27 0.25 0.00 0.00 -0.62 -0.72 107.32 105.08 2giz s GLY 128 Ca -0.09 1.28 0.01 0.00 0.00 0.00 0.00 44.72 45.92 2giz s GLY 128 CO -0.00 1.39 0.10 0.00 0.00 0.00 0.00 173.10 174.59 2giz s ALA 130 N -3.81 -1.71 -0.01 0.00 0.00 0.17 -4.74 121.76 111.66 2giz s ALA 130 Ca 0.38 0.99 0.03 0.00 0.00 0.00 0.00 51.96 53.36 2giz s ALA 130 Cb 0.08 0.35 -0.01 0.00 0.00 0.00 0.00 23.12 23.53 2giz s ALA 130 CO 0.14 -0.54 -0.11 0.54 0.00 0.00 0.00 175.76 175.79 2giz s VAL 131 N -2.28 0.88 0.12 0.00 0.11 -1.26 -0.68 120.40 117.30 2giz s VAL 131 Ca -0.05 -0.48 0.07 0.00 -2.93 0.00 0.00 61.98 58.59 2giz s VAL 131 Cb -0.00 -0.74 -0.04 0.00 -1.53 0.00 0.00 36.38 34.07 2giz s VAL 131 CO -0.00 0.25 -0.17 -0.94 -3.33 0.00 0.00 175.10 170.90 2giz s SER 132 N -0.25 2.33 -0.22 3.54 1.04 -0.32 -4.93 113.70 114.89 2giz s SER 132 Ca 0.04 -0.76 -0.12 0.00 0.48 0.00 0.00 55.95 55.59 2giz s SER 132 Cb -0.04 -0.11 -0.05 0.00 0.10 0.00 0.00 66.02 65.91 2giz s SER 132 CO -0.00 -0.04 0.21 -0.47 0.98 0.00 0.00 173.24 173.91 2giz s TYR 133 N -1.71 3.35 -0.60 5.02 5.04 -1.26 -1.57 117.35 125.63 2giz s TYR 133 Ca 0.09 0.34 0.06 0.00 -2.44 0.00 0.00 57.07 55.11 2giz s TYR 133 Cb -0.07 -2.30 0.22 0.00 0.35 0.00 0.00 41.96 40.16 2giz s TYR 133 CO 0.04 0.10 0.61 0.00 -1.34 0.00 0.00 175.55 174.96 2giz h PRO 135 N 4.59 0.00 -0.00 0.00 0.13 -1.88 -2.22 132.00 132.62 2giz h PRO 135 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 2giz h PRO 135 Cb 0.74 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.87 2giz h PRO 135 CO 0.71 0.00 -0.89 0.43 -0.23 0.00 0.00 178.00 178.01 2giz n SER 136 N -3.83 0.91 -4.79 1.44 7.64 -1.26 -4.99 113.62 108.74 2giz n SER 136 Ca 0.07 -0.85 -0.27 0.00 1.01 0.00 0.00 58.87 58.83 2giz n SER 136 Cb 0.60 0.84 0.09 0.00 -1.01 0.00 0.00 64.21 64.73 2giz n SER 136 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2giz s SER 137 N -2.99 4.47 0.52 6.43 0.01 -0.83 -4.97 113.70 116.33 2giz s SER 137 Ca 0.09 0.43 0.21 0.00 1.31 0.00 0.00 55.95 57.99 2giz s SER 137 Cb 0.16 -0.94 1.37 0.00 0.21 0.00 0.00 66.02 66.83 2giz s SER 137 CO 0.83 -1.85 2.12 0.00 0.41 0.00 0.00 173.24 174.75 2giz h ALA 138 N -0.84 1.67 -3.98 1.44 0.00 -1.94 -3.39 119.26 112.21 2giz h ALA 138 Ca -0.44 -0.07 -0.48 0.00 0.00 0.00 0.00 54.91 53.92 2giz h ALA 138 Cb 1.30 -0.01 -0.30 0.00 0.00 0.00 0.00 17.79 18.78 2giz h ALA 138 CO 0.57 0.09 -0.81 -1.58 0.00 0.00 0.00 179.25 177.52 2giz s TRP 139 N -4.68 1.24 -0.23 0.00 0.52 -1.26 -4.95 118.94 109.58 2giz s TRP 139 Ca -0.04 -0.30 0.18 0.00 0.02 0.00 0.00 56.10 55.96 2giz s TRP 139 Cb 0.15 -0.84 0.11 0.00 -1.15 0.00 0.00 33.47 31.75 2giz s TRP 139 CO 0.63 -0.09 1.41 0.77 0.02 0.00 0.00 176.95 179.69 2giz h SER 140 N 6.14 0.00 -3.36 2.95 0.02 -1.57 -3.42 113.55 114.31 2giz h SER 140 Ca -0.33 0.00 -0.59 0.00 -0.84 0.00 0.00 61.79 60.03 2giz h SER 140 Cb 1.17 0.00 -0.34 0.00 0.14 0.00 0.00 62.40 63.37 2giz h SER 140 CO 0.49 0.35 -0.84 -0.31 -1.14 0.00 0.00 176.83 175.37 2giz s TYR 141 N -3.05 1.97 -0.21 3.45 1.51 -0.29 0.46 117.35 121.19 2giz s TYR 141 Ca 0.04 -0.81 0.01 0.00 -1.01 0.00 0.00 57.07 55.30 2giz s TYR 141 Cb 0.07 -1.38 0.04 0.00 -0.11 0.00 0.00 41.96 40.59 2giz s TYR 141 CO 0.73 -0.37 -0.11 0.12 -1.11 0.00 0.00 175.55 174.81 2giz s PHE 142 N 0.62 2.62 -0.17 2.71 5.36 -0.61 -0.87 117.98 127.64 2giz s PHE 142 Ca -0.14 -1.75 -0.08 0.00 -0.96 0.00 0.00 56.93 53.99 2giz s PHE 142 Cb -0.16 -1.72 -0.04 0.00 -0.34 0.00 0.00 43.02 40.75 2giz s PHE 142 CO 0.04 -0.78 0.10 0.71 -1.46 0.00 0.00 175.22 173.84 2giz s TYR 143 N 1.33 3.39 -0.06 10.12 1.51 0.65 -1.18 117.35 133.12 2giz s TYR 143 Ca -0.02 0.29 0.00 0.00 -1.01 0.00 0.00 57.07 56.33 2giz s TYR 143 Cb -0.17 -2.06 0.02 0.00 -0.11 0.00 0.00 41.96 39.64 2giz s TYR 143 CO -0.08 0.36 -0.03 0.08 -1.11 0.00 0.00 175.55 174.78 2giz s VAL 144 N -0.03 0.48 -0.07 0.71 1.01 0.15 -1.34 120.40 121.30 2giz s VAL 144 Ca 0.08 -0.02 0.04 0.00 0.00 0.00 0.00 61.98 62.08 2giz s VAL 144 Cb -0.12 -0.56 0.00 0.00 0.00 0.00 0.00 36.38 35.71 2giz s VAL 144 CO 0.00 0.24 -0.20 0.00 0.00 0.00 0.00 175.10 175.14 2giz s GLN 146 N 0.30 2.49 -0.08 0.00 -0.21 0.92 -1.00 119.66 122.08 2giz s GLN 146 Ca -0.13 -0.71 0.05 0.00 0.02 0.00 0.00 55.36 54.58 2giz s GLN 146 Cb -0.16 -2.40 -0.00 0.00 1.00 0.00 0.00 33.01 31.45 2giz s GLN 146 CO 0.06 0.62 -0.23 0.71 -2.12 0.00 0.00 175.29 174.33 2giz s TYR 147 N -0.80 2.33 -0.06 0.91 1.51 -0.52 -1.59 117.35 119.14 2giz s TYR 147 Ca 0.13 -0.84 0.01 0.00 -1.01 0.00 0.00 57.07 55.36 2giz s TYR 147 Cb -0.11 -1.56 0.02 0.00 -0.11 0.00 0.00 41.96 40.21 2giz s TYR 147 CO 0.02 -0.31 -0.08 0.00 -1.11 0.00 0.00 175.55 174.07 2giz s PRO 149 N 0.96 1.86 0.51 0.00 0.04 -1.26 -1.53 135.00 135.58 2giz s PRO 149 Ca -0.10 0.37 -0.23 0.00 0.04 0.00 0.00 61.00 61.08 2giz s PRO 149 Cb -0.15 -1.92 -0.06 0.00 0.04 0.00 0.00 34.50 32.42 2giz s PRO 149 CO 0.00 -1.71 1.32 0.45 0.04 0.00 0.00 177.00 177.10 2giz s SER 150 N -4.18 5.59 0.00 6.66 0.15 -0.03 -4.27 113.70 117.62 2giz s SER 150 Ca 0.62 2.67 0.00 0.00 0.70 0.00 0.00 55.95 59.93 2giz s SER 150 Cb -0.13 -2.63 0.00 0.00 -1.71 0.00 0.00 66.02 61.55 2giz s SER 150 CO 0.52 -1.35 0.00 0.61 1.20 0.00 0.00 173.24 174.23 2giz n GLY 151 N 0.64 2.26 3.51 9.45 0.00 -1.26 -4.75 105.19 115.03 2giz n GLY 151 Ca 0.09 -2.13 -0.24 0.00 0.00 0.00 0.00 46.02 43.73 2giz n GLY 151 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2giz n ASN 152 N -2.51 -6.14 -4.76 1.61 5.03 -1.26 -4.91 115.26 102.32 2giz n ASN 152 Ca 0.00 -0.51 -0.41 0.00 0.87 0.00 0.00 54.58 54.53 2giz n ASN 152 Cb 0.00 -4.87 -0.01 0.00 -1.02 0.00 0.00 39.78 33.88 2giz n ASN 152 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.26 175.55 2giz s PHE 153 N -3.28 2.74 -0.09 3.10 5.36 -1.26 -4.79 117.98 119.76 2giz s PHE 153 Ca 0.54 0.95 -0.39 0.00 -0.96 0.00 0.00 56.93 57.07 2giz s PHE 153 Cb -0.24 -4.01 -0.17 0.00 -0.34 0.00 0.00 43.02 38.25 2giz s PHE 153 CO 0.66 -3.24 1.44 0.00 -1.46 0.00 0.00 175.22 172.62 2giz n GLN 154 N 1.61 0.85 0.00 10.12 10.64 -1.26 -1.12 117.38 138.22 2giz n GLN 154 Ca 0.05 0.31 0.00 0.00 -1.83 0.00 0.00 57.00 55.53 2giz n GLN 154 Cb 0.38 -1.93 0.00 0.00 -0.86 0.00 0.00 30.24 27.84 2giz n GLN 154 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2giz n GLY 155 N 2.98 2.23 0.05 2.61 0.00 -1.26 -4.85 105.19 106.94 2giz n GLY 155 Ca 0.22 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.30 2giz n GLY 155 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2giz n LYS 156 N -2.00 1.92 0.27 1.61 5.02 -0.27 -4.77 118.16 119.94 2giz n LYS 156 Ca 0.00 -2.14 0.11 0.00 -2.02 0.00 0.00 58.31 54.25 2giz n LYS 156 Cb 0.00 -1.30 0.74 0.00 -0.02 0.00 0.00 35.03 34.45 2giz n LYS 156 CO 0.00 0.00 0.00 1.79 -0.52 0.00 0.00 177.40 178.67 2giz h THR 157 N 0.07 0.81 0.00 -0.18 1.35 -1.87 -1.90 112.91 111.20 2giz h THR 157 Ca 0.00 -0.10 0.00 0.00 -0.55 0.00 0.00 66.41 65.76 2giz h THR 157 Cb 0.81 1.06 0.00 0.00 -1.73 0.00 0.00 68.15 68.29 2giz h THR 157 CO 0.00 0.03 0.00 0.00 -0.25 0.00 0.00 175.52 175.30 2giz n ALA 158 N -2.44 2.03 -3.43 6.62 0.00 -1.26 -4.00 120.51 118.03 2giz n ALA 158 Ca -0.03 -0.08 -0.26 0.00 0.00 0.00 0.00 53.44 53.07 2giz n ALA 158 Cb 0.11 -1.36 -0.09 0.00 0.00 0.00 0.00 19.45 18.11 2giz n ALA 158 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2giz n THR 159 N -1.50 0.45 0.43 0.00 -2.24 -0.71 -0.27 114.28 110.44 2giz n THR 159 Ca 0.05 -4.37 0.10 0.00 -2.27 0.00 0.00 64.05 57.56 2giz n THR 159 Cb 0.26 -1.97 0.41 0.00 -2.10 0.00 0.00 70.33 66.93 2giz n THR 159 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 2giz n PRO 160 N 1.68 0.11 -3.86 -0.78 -0.04 -1.26 -4.85 135.00 126.01 2giz n PRO 160 Ca 0.25 0.35 -0.07 0.00 -0.04 0.00 0.00 63.50 63.99 2giz n PRO 160 Cb 0.45 -1.71 -0.01 0.00 -0.04 0.00 0.00 33.50 32.19 2giz n PRO 160 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 2giz s TYR 161 N -3.18 -0.11 -0.09 0.54 -0.85 -1.26 -0.51 117.35 111.89 2giz s TYR 161 Ca 0.05 -0.38 -0.17 0.00 -0.52 0.00 0.00 57.07 56.06 2giz s TYR 161 Cb 0.09 0.71 -0.05 0.00 0.38 0.00 0.00 41.96 43.09 2giz s TYR 161 CO 0.33 -1.28 0.43 0.21 -1.52 0.00 0.00 175.55 173.72 2giz s LYS 162 N -3.66 4.21 0.35 -3.49 2.20 -1.26 -5.02 119.74 113.06 2giz s LYS 162 Ca 0.12 0.39 -0.27 0.00 -0.36 0.00 0.00 55.97 55.85 2giz s LYS 162 Cb -0.06 -3.37 -0.09 0.00 -1.51 0.00 0.00 37.83 32.80 2giz s LYS 162 CO 0.08 0.33 1.18 -0.51 -0.36 0.00 0.00 175.35 176.06 2giz s LEU 163 N 0.10 4.36 0.00 5.43 1.43 -1.26 -1.30 118.68 127.43 2giz s LEU 163 Ca 0.24 2.40 0.00 0.00 -1.03 0.00 0.00 54.13 55.74 2giz s LEU 163 Cb -0.15 -3.82 0.00 0.00 0.03 0.00 0.00 46.19 42.25 2giz s LEU 163 CO 0.10 -0.48 0.00 0.61 0.23 0.00 0.00 176.35 176.82 2giz n GLY 164 N 0.83 -0.04 3.77 -3.19 0.00 -1.01 -4.58 105.19 100.97 2giz n GLY 164 Ca 0.02 -1.42 -0.36 0.00 0.00 0.00 0.00 46.02 44.26 2giz n GLY 164 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2giz s PRO 165 N -1.83 3.71 0.06 1.61 0.02 -1.26 -3.25 135.00 134.04 2giz s PRO 165 Ca 0.00 1.70 -0.37 0.00 0.02 0.00 0.00 61.00 62.35 2giz s PRO 165 Cb 0.00 -2.31 -0.17 0.00 0.02 0.00 0.00 34.50 32.04 2giz s PRO 165 CO 0.00 -0.58 1.38 -2.30 -0.33 0.00 0.00 177.00 175.17 2giz n PRO 166 N -0.65 1.16 -1.45 5.54 -0.02 -1.21 -0.55 135.00 137.81 2giz n PRO 166 Ca 0.08 0.42 -0.16 0.00 -2.02 0.00 0.00 63.50 61.82 2giz n PRO 166 Cb 0.49 -2.07 -0.07 0.00 -0.02 0.00 0.00 33.50 31.83 2giz n PRO 166 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2giz h GLY 168 N 0.00 0.00 -1.26 0.00 0.00 -0.55 -1.00 103.07 100.27 2giz h GLY 168 Ca -0.32 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.01 2giz h GLY 168 CO 0.47 0.00 -0.05 1.22 0.00 0.00 0.00 176.54 178.18 2giz n ASP 169 N -4.38 2.32 -2.87 0.19 8.00 -0.23 -4.43 116.55 115.16 2giz n ASP 169 Ca -0.01 -1.74 -0.12 0.00 0.71 0.00 0.00 54.79 53.63 2giz n ASP 169 Cb 0.18 0.04 0.03 0.00 -0.02 0.00 0.00 41.12 41.36 2giz n ASP 169 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2giz h PRO 171 N 2.85 0.00 -0.58 0.00 0.13 -1.64 -1.32 132.00 131.44 2giz h PRO 171 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 2giz h PRO 171 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 2giz h PRO 171 CO 0.35 0.00 0.00 0.43 -0.23 0.00 0.00 178.00 178.55 2giz n SER 172 N -4.07 4.23 -3.02 1.44 7.64 -1.26 -4.42 113.62 114.16 2giz n SER 172 Ca 0.05 -2.35 -0.15 0.00 1.01 0.00 0.00 58.87 57.44 2giz n SER 172 Cb 0.47 -0.50 0.01 0.00 -1.01 0.00 0.00 64.21 63.18 2giz n SER 172 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2giz n ALA 173 N 0.96 0.97 -2.84 -0.43 0.00 -0.50 -5.07 120.51 113.60 2giz n ALA 173 Ca 0.23 -2.68 -0.31 0.00 0.00 0.00 0.00 53.44 50.68 2giz n ALA 173 Cb 0.77 -1.01 -0.16 0.00 0.00 0.00 0.00 19.45 19.04 2giz n ALA 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2giz s ASP 175 N -0.05 4.19 -0.94 0.00 3.68 0.40 -4.89 116.67 119.06 2giz s ASP 175 Ca -0.06 -2.27 -0.23 0.00 2.13 0.00 0.00 52.55 52.12 2giz s ASP 175 Cb -0.14 -1.25 0.03 0.00 -1.45 0.00 0.00 42.92 40.11 2giz s ASP 175 CO 0.04 -0.34 0.55 -3.20 0.13 0.00 0.00 175.17 172.35 2giz n ASN 176 N 4.05 -3.53 0.00 -0.34 5.15 -1.26 -2.17 115.26 117.16 2giz n ASN 176 Ca 0.04 -1.03 0.00 0.00 -0.60 0.00 0.00 54.58 52.98 2giz n ASN 176 Cb 0.38 -1.32 0.00 0.00 -0.53 0.00 0.00 39.78 38.32 2giz n ASN 176 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2giz n GLY 177 N -1.81 0.70 3.31 8.20 0.00 -1.26 -4.94 105.19 109.39 2giz n GLY 177 Ca -0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.58 2giz n GLY 177 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2giz s LEU 178 N 0.00 2.09 0.20 0.99 1.43 -0.92 -4.14 118.68 118.33 2giz s LEU 178 Ca 0.00 -0.50 -0.29 0.00 -1.03 0.00 0.00 54.13 52.30 2giz s LEU 178 Cb 0.00 -1.30 -0.08 0.00 0.03 0.00 0.00 46.19 44.84 2giz s LEU 178 CO 0.00 0.29 0.92 0.00 0.23 0.00 0.00 176.35 177.79 2giz n THR 180 N 1.77 2.41 -3.13 0.00 -2.24 0.53 -0.59 114.28 113.03 2giz n THR 180 Ca -0.02 -1.88 -0.27 0.00 -2.27 0.00 0.00 64.05 59.61 2giz n THR 180 Cb 0.48 -0.27 -0.05 0.00 -2.10 0.00 0.00 70.33 68.38 2giz n THR 180 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2giz n ASN 181 N -0.40 4.26 -4.82 3.42 2.04 -1.26 -5.03 115.26 113.46 2giz n ASN 181 Ca 0.24 -3.59 -0.32 0.00 -0.44 0.00 0.00 54.58 50.47 2giz n ASN 181 Cb 0.97 -0.61 0.03 0.00 -2.53 0.00 0.00 39.78 37.64 2giz n ASN 181 CO 0.00 0.00 0.00 -2.16 -0.44 0.00 0.00 177.26 174.66 2giz s PRO 182 N -3.10 3.19 -0.02 -0.53 0.04 -1.26 -1.31 135.00 132.00 2giz s PRO 182 Ca 0.45 1.00 -0.14 0.00 0.04 0.00 0.00 61.00 62.36 2giz s PRO 182 Cb 0.23 -2.02 -0.05 0.00 0.04 0.00 0.00 34.50 32.69 2giz s PRO 182 CO -0.09 -0.90 0.37 0.00 0.04 0.00 0.00 177.00 176.42 2giz h THR 184 N 3.80 0.76 -1.54 0.00 2.02 -1.95 -3.45 112.91 112.55 2giz h THR 184 Ca -0.52 -0.82 -0.50 0.00 0.77 0.00 0.00 66.41 65.34 2giz h THR 184 Cb 1.22 1.50 -0.04 0.00 -1.74 0.00 0.00 68.15 69.09 2giz h THR 184 CO 0.62 0.20 -0.40 0.27 0.37 0.00 0.00 175.52 176.58 2giz s ILE 185 N -4.12 2.63 0.07 3.11 -4.36 -1.26 -5.14 121.20 112.12 2giz s ILE 185 Ca -0.02 -1.40 -0.02 0.00 -0.26 0.00 0.00 60.65 58.96 2giz s ILE 185 Cb 0.13 -3.00 -0.04 0.00 1.25 0.00 0.00 42.46 40.80 2giz s ILE 185 CO 0.63 -0.01 -0.00 -0.72 0.24 0.00 0.00 174.94 175.09 2giz s TYR 186 N -2.49 0.55 0.05 1.37 -0.85 -1.26 -4.75 117.35 109.97 2giz s TYR 186 Ca 0.47 -1.06 -0.24 0.00 -0.52 0.00 0.00 57.07 55.71 2giz s TYR 186 Cb -0.02 -0.38 -0.06 0.00 0.38 0.00 0.00 41.96 41.88 2giz s TYR 186 CO 0.27 -0.41 0.74 -0.80 -1.52 0.00 0.00 175.55 173.83 2giz s ASN 187 N -2.94 7.20 0.36 -0.18 0.01 -1.26 -4.20 114.94 113.93 2giz s ASN 187 Ca 0.10 1.43 0.19 0.00 -0.71 0.00 0.00 52.86 53.87 2giz s ASN 187 Cb 0.08 -2.46 0.31 0.00 0.41 0.00 0.00 41.25 39.59 2giz s ASN 187 CO -0.08 0.06 1.56 0.11 -1.51 0.00 0.00 177.10 177.24 2giz h LYS 188 N 5.47 0.00 -6.63 -0.60 1.57 -1.40 -3.45 116.57 111.52 2giz h LYS 188 Ca -0.45 0.00 -0.67 0.00 -1.87 0.00 0.00 60.65 57.67 2giz h LYS 188 Cb 1.20 0.00 -0.17 0.00 0.08 0.00 0.00 32.23 33.34 2giz h LYS 188 CO 0.70 0.30 -0.77 -0.51 -0.57 0.00 0.00 179.45 178.59 2giz s LEU 189 N -6.42 2.84 0.10 2.94 1.43 -1.21 -5.04 118.68 113.32 2giz s LEU 189 Ca 0.04 -0.51 0.27 0.00 -1.03 0.00 0.00 54.13 52.90 2giz s LEU 189 Cb 0.07 -1.65 0.90 0.00 0.03 0.00 0.00 46.19 45.55 2giz s LEU 189 CO 0.70 0.17 1.76 0.35 0.23 0.00 0.00 176.35 179.56 2giz n THR 190 N 0.64 0.29 -1.37 5.49 -2.24 -1.26 -3.90 114.28 111.94 2giz n THR 190 Ca -0.14 -0.15 -0.07 0.00 -2.27 0.00 0.00 64.05 61.42 2giz n THR 190 Cb 0.53 -0.44 0.20 0.00 -2.10 0.00 0.00 70.33 68.53 2giz n THR 190 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2giz n ASN 191 N -1.89 2.88 -0.33 3.42 6.94 -1.26 -4.71 115.26 120.31 2giz n ASN 191 Ca 0.06 -3.67 -0.01 0.00 -0.02 0.00 0.00 54.58 50.94 2giz n ASN 191 Cb 0.39 -0.67 0.12 0.00 -2.36 0.00 0.00 39.78 37.26 2giz n ASN 191 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2giz h ASP 193 N 1.12 0.00 0.03 0.00 3.58 -1.92 0.23 116.42 119.45 2giz h ASP 193 Ca 0.36 0.00 -0.07 0.00 0.42 0.00 0.00 57.03 57.74 2giz h ASP 193 Cb 0.02 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.08 2giz h ASP 193 CO -0.12 0.00 -0.28 0.28 -2.88 0.00 0.00 179.24 176.23 2giz h SER 194 N 0.00 0.19 -0.74 2.28 0.02 -1.31 -3.03 113.55 110.97 2giz h SER 194 Ca 0.04 -0.89 0.12 0.00 -0.84 0.00 0.00 61.79 60.21 2giz h SER 194 Cb 0.18 -0.06 -0.05 0.00 0.14 0.00 0.00 62.40 62.61 2giz h SER 194 CO -0.00 1.07 0.49 -0.07 -1.14 0.00 0.00 176.83 177.18 2giz h LEU 195 N -0.65 0.49 -0.75 5.07 3.38 -0.21 0.09 115.31 122.72 2giz h LEU 195 Ca -0.04 0.02 -0.06 0.00 0.09 0.00 0.00 57.88 57.89 2giz h LEU 195 Cb 1.14 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 2giz h LEU 195 CO 0.05 0.28 -0.27 -0.07 0.09 0.00 0.00 178.44 178.52 2giz h LEU 196 N 0.53 0.00 -0.15 1.67 3.38 -1.03 0.92 115.31 120.63 2giz h LEU 196 Ca 0.35 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.23 2giz h LEU 196 Cb 0.63 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.38 2giz h LEU 196 CO -0.12 0.27 -0.25 0.11 0.09 0.00 0.00 178.44 178.54 2giz h LYS 197 N 0.00 0.44 -0.00 1.13 1.57 -0.85 -3.33 116.57 115.52 2giz h LYS 197 Ca -0.00 -0.27 0.00 0.00 -1.87 0.00 0.00 60.65 58.51 2giz h LYS 197 Cb 0.93 0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.26 2giz h LYS 197 CO 0.04 0.86 -0.61 0.00 -0.57 0.00 0.00 179.45 179.17 2giz n GLN 198 N -4.44 0.13 0.00 3.15 10.64 -1.03 -4.99 117.38 120.85 2giz n GLN 198 Ca -0.06 -0.09 0.00 0.00 -1.83 0.00 0.00 57.00 55.02 2giz n GLN 198 Cb 0.44 -1.50 0.00 0.00 -0.86 0.00 0.00 30.24 28.32 2giz n GLN 198 CO 0.00 0.00 0.00 0.45 -1.83 0.00 0.00 177.06 175.68 2giz n SER 199 N -1.36 0.02 -3.94 2.61 2.88 0.31 -5.10 113.62 109.04 2giz n SER 199 Ca 0.06 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.51 2giz n SER 199 Cb 0.34 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.71 2giz n SER 199 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2giz s SER 200 N 1.02 0.21 0.00 -3.46 0.15 -1.26 -4.66 113.70 105.70 2giz s SER 200 Ca 0.00 -0.60 0.19 0.00 0.70 0.00 0.00 55.95 56.25 2giz s SER 200 Cb 0.00 0.23 1.10 0.00 -1.71 0.00 0.00 66.02 65.64 2giz s SER 200 CO 0.00 -0.54 1.57 0.00 1.20 0.00 0.00 173.24 175.47 2giz h GLN 202 N 0.00 0.00 -6.47 0.00 4.20 -1.97 -3.38 115.11 107.49 2giz h GLN 202 Ca 0.00 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 58.18 2giz h GLN 202 Cb 0.06 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 2giz h GLN 202 CO 0.00 0.00 0.47 0.34 -0.67 0.00 0.00 178.83 178.97 2giz s ASP 203 N -4.62 7.23 0.19 1.46 2.15 -0.56 -4.94 116.67 117.58 2giz s ASP 203 Ca 0.08 1.86 -0.12 0.00 0.43 0.00 0.00 52.55 54.80 2giz s ASP 203 Cb 0.12 -2.58 0.19 0.00 -0.30 0.00 0.00 42.92 40.35 2giz s ASP 203 CO 0.67 -0.35 1.74 0.44 -0.17 0.00 0.00 175.17 177.50 2giz h ASP 204 N 6.64 0.14 -0.64 -0.34 5.19 -1.88 0.11 116.42 125.64 2giz h ASP 204 Ca -0.42 0.07 0.00 0.00 -0.62 0.00 0.00 57.03 56.07 2giz h ASP 204 Cb 1.22 0.07 -0.03 0.00 0.18 0.00 0.00 39.33 40.76 2giz h ASP 204 CO 0.78 0.10 0.41 -0.25 -3.12 0.00 0.00 179.24 177.16 2giz h TRP 205 N 0.33 0.82 -0.33 4.55 7.01 -1.94 -0.24 115.95 126.15 2giz h TRP 205 Ca 0.25 0.01 -0.16 0.00 2.11 0.00 0.00 58.89 61.10 2giz h TRP 205 Cb 0.29 -0.27 -0.00 0.00 -2.10 0.00 0.00 29.16 27.07 2giz h TRP 205 CO -0.18 0.54 -0.44 0.82 -2.79 0.00 0.00 178.44 176.38 2giz h ILE 206 N 0.87 1.28 0.00 2.65 2.04 -1.73 -0.90 117.51 121.72 2giz h ILE 206 Ca 0.23 -1.63 -0.08 0.00 1.00 0.00 0.00 64.86 64.39 2giz h ILE 206 Cb -0.07 1.50 -0.01 0.00 -0.74 0.00 0.00 36.82 37.50 2giz h ILE 206 CO -0.05 0.53 -0.38 0.07 0.00 0.00 0.00 178.15 178.33 2giz h LYS 207 N 0.68 0.00 0.08 2.37 2.10 -0.51 0.21 116.57 121.50 2giz h LYS 207 Ca 0.04 0.00 -0.25 0.00 -2.00 0.00 0.00 60.65 58.44 2giz h LYS 207 Cb 1.03 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.35 2giz h LYS 207 CO 0.10 0.38 -1.15 0.77 -2.00 0.00 0.00 179.45 177.55 2giz h SER 208 N 0.00 0.27 0.45 7.07 0.02 -0.83 -3.25 113.55 117.28 2giz h SER 208 Ca -0.00 -0.29 0.00 0.00 -0.84 0.00 0.00 61.79 60.66 2giz h SER 208 Cb 0.71 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.16 2giz h SER 208 CO 0.05 1.22 -1.12 0.59 -1.14 0.00 0.00 176.83 176.43 2giz n ASN 209 N -3.47 0.59 -2.57 3.07 3.02 -0.36 -4.45 115.26 111.09 2giz n ASN 209 Ca -0.05 -0.14 -0.13 0.00 -0.03 0.00 0.00 54.58 54.23 2giz n ASN 209 Cb 0.99 0.88 0.03 0.00 -0.61 0.00 0.00 39.78 41.06 2giz n ASN 209 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2giz h PRO 211 N 2.68 0.20 -0.07 0.00 0.13 -1.74 -0.79 132.00 132.41 2giz h PRO 211 Ca 0.05 -0.01 -0.02 0.00 -0.87 0.00 0.00 66.00 65.14 2giz h PRO 211 Cb 1.20 -0.04 -0.00 0.00 0.13 0.00 0.00 31.00 32.29 2giz h PRO 211 CO 0.53 0.14 -0.05 0.00 -0.23 0.00 0.00 178.00 178.38 2giz h ALA 212 N 1.90 0.10 -0.69 -0.56 0.00 -1.86 0.18 119.26 118.33 2giz h ALA 212 Ca 0.05 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.66 2giz h ALA 212 Cb -0.02 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 2giz h ALA 212 CO -0.01 -0.12 0.25 0.77 0.00 0.00 0.00 179.25 180.14 2giz h SER 213 N -0.25 0.95 0.63 0.00 0.02 -1.82 -1.30 113.55 111.78 2giz h SER 213 Ca 0.01 -0.15 -0.23 0.00 -0.84 0.00 0.00 61.79 60.59 2giz h SER 213 Cb 0.53 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.82 2giz h SER 213 CO 0.01 0.86 -1.02 0.00 -1.14 0.00 0.00 176.83 175.55 2giz n PHE 215 N -3.58 0.00 -1.67 0.00 3.72 0.61 -5.04 117.46 111.51 2giz n PHE 215 Ca -0.05 0.00 -0.45 0.00 -0.05 0.00 0.00 57.45 56.90 2giz n PHE 215 Cb 0.90 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.41 2giz n PHE 215 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2giz s ARG 217 N -0.01 2.74 -1.31 0.00 1.70 -1.26 -4.70 118.95 116.11 2giz s ARG 217 Ca 0.72 -0.74 -0.08 0.00 -0.47 0.00 0.00 55.73 55.15 2giz s ARG 217 Cb -0.66 -2.31 0.01 0.00 -0.57 0.00 0.00 34.95 31.42 2giz s ARG 217 CO 0.46 -0.11 1.14 0.09 -1.08 0.00 0.00 175.30 175.80 2giz n ASN 218 N 4.34 -5.97 -4.39 -2.89 3.02 -1.26 -5.01 115.26 103.10 2giz n ASN 218 Ca -0.20 -0.53 -0.20 0.00 -0.03 0.00 0.00 54.58 53.62 2giz n ASN 218 Cb 0.51 -4.90 -0.10 0.00 -0.61 0.00 0.00 39.78 34.68 2giz n ASN 218 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2giz s LYS 219 N -6.21 1.46 -0.29 3.52 -0.14 -1.26 -4.92 119.74 111.89 2giz s LYS 219 Ca 0.53 -1.68 -0.16 0.00 -1.36 0.00 0.00 55.97 53.30 2giz s LYS 219 Cb -0.23 -1.27 -0.03 0.00 -1.68 0.00 0.00 37.83 34.62 2giz s LYS 219 CO 0.71 0.18 0.41 0.42 -0.76 0.00 0.00 175.35 176.31 2giz s ILE 220 N -2.88 5.13 0.00 2.17 -1.09 -0.43 -4.97 121.20 119.13 2giz s ILE 220 Ca 0.26 0.49 0.00 0.00 -2.23 0.00 0.00 60.65 59.17 2giz s ILE 220 Cb -0.00 -3.78 0.00 0.00 -1.58 0.00 0.00 42.46 37.10 2giz s ILE 220 CO 0.10 0.04 0.00 2.30 -1.23 0.00 0.00 174.94 176.15