#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 2.67 -1.83 4.33 -0.58 -1.26 -4.96 120.64 119.00 2giz n GLU 7 Ca 0.00 -2.31 -0.42 0.00 -0.42 0.00 0.00 57.16 54.01 2giz n GLU 7 Cb 0.00 -1.56 -0.02 0.00 -0.57 0.00 0.00 31.44 29.28 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 -0.96 6.46 0.00 1.62 0.15 -1.26 -4.79 113.70 114.91 2giz s SER 8 Ca 0.43 2.82 0.05 0.00 0.70 0.00 0.00 55.95 59.94 2giz s SER 8 Cb 0.23 -2.61 0.16 0.00 -1.71 0.00 0.00 66.02 62.09 2giz s SER 8 CO 0.27 -0.88 1.13 0.35 1.20 0.00 0.00 173.24 175.31 2giz n THR 9 N 3.07 0.18 1.17 6.45 -2.24 -1.26 -2.98 114.28 118.66 2giz n THR 9 Ca 0.11 -0.18 0.13 0.00 -2.27 0.00 0.00 64.05 61.84 2giz n THR 9 Cb 0.37 0.09 0.50 0.00 -2.10 0.00 0.00 70.33 69.19 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 -0.11 0.30 -3.35 -0.78 1.74 -1.26 -4.64 116.66 108.56 2giz n ARG 10 Ca 0.05 -0.11 -0.38 0.00 -0.77 0.00 0.00 57.85 56.64 2giz n ARG 10 Cb 0.12 -1.50 -0.07 0.00 -1.02 0.00 0.00 32.46 30.00 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 -2.78 4.26 0.53 5.56 0.52 -1.16 -4.96 118.95 120.92 2giz s ARG 11 Ca 0.19 0.33 0.21 0.00 -0.52 0.00 0.00 55.73 55.95 2giz s ARG 11 Cb 0.19 -3.49 1.35 0.00 0.52 0.00 0.00 34.95 33.52 2giz s ARG 11 CO 0.56 0.06 2.06 0.87 0.02 0.00 0.00 175.30 178.87 2giz h LYS 12 N 7.03 0.00 -0.72 3.54 6.56 -1.91 -1.28 116.57 129.79 2giz h LYS 12 Ca -0.38 0.00 -0.03 0.00 -1.06 0.00 0.00 60.65 59.17 2giz h LYS 12 Cb 1.17 0.00 -0.03 0.00 -0.57 0.00 0.00 32.23 32.79 2giz h LYS 12 CO 0.74 0.00 0.32 -0.22 -2.06 0.00 0.00 179.45 178.24 2giz h LYS 13 N 0.00 1.06 -0.33 3.15 3.64 -1.95 -1.82 116.57 120.32 2giz h LYS 13 Ca 0.14 -0.17 -0.15 0.00 -1.27 0.00 0.00 60.65 59.20 2giz h LYS 13 Cb 0.58 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 2giz h LYS 13 CO -0.00 0.85 -0.39 -0.22 -2.27 0.00 0.00 179.45 177.42 2giz h LYS 14 N 1.02 0.80 -0.37 1.90 1.63 -1.54 -2.17 116.57 117.84 2giz h LYS 14 Ca 0.25 -0.41 0.03 0.00 -0.85 0.00 0.00 60.65 59.66 2giz h LYS 14 Cb 0.16 0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 31.77 2giz h LYS 14 CO -0.03 1.04 0.18 1.96 -3.45 0.00 0.00 179.45 179.15 2giz h GLN 15 N 0.65 0.35 -0.74 1.90 4.20 -1.11 -0.23 115.11 120.13 2giz h GLN 15 Ca 0.06 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.72 2giz h GLN 15 Cb 0.95 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 28.61 2giz h GLN 15 CO 0.09 0.23 0.35 -0.22 -0.67 0.00 0.00 178.83 178.62 2giz h LYS 16 N 0.36 1.07 -0.33 1.46 3.64 -1.20 -1.31 116.57 120.26 2giz h LYS 16 Ca 0.16 -0.16 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 2giz h LYS 16 Cb 0.07 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 31.69 2giz h LYS 16 CO -0.11 0.84 0.17 0.93 -2.27 0.00 0.00 179.45 179.00 2giz h GLU 17 N 1.04 0.47 -0.33 1.90 5.08 -0.85 0.20 114.58 122.10 2giz h GLU 17 Ca 0.25 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.55 2giz h GLU 17 Cb 0.12 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 2giz h GLU 17 CO -0.03 0.41 0.19 0.82 -1.00 0.00 0.00 179.01 179.41 2giz h ILE 18 N 0.40 1.12 -0.01 3.13 2.04 -0.79 0.05 117.51 123.44 2giz h ILE 18 Ca 0.11 -0.27 -0.00 0.00 1.00 0.00 0.00 64.86 65.70 2giz h ILE 18 Cb 0.09 0.71 -0.00 0.00 -0.74 0.00 0.00 36.82 36.88 2giz h ILE 18 CO -0.02 0.11 -0.00 0.58 0.00 0.00 0.00 178.15 178.83 2giz h VAL 19 N 0.42 1.25 -0.85 1.67 2.07 -1.11 -2.19 116.25 117.51 2giz h VAL 19 Ca 0.12 -0.74 0.07 0.00 0.82 0.00 0.00 66.70 66.97 2giz h VAL 19 Cb 0.02 1.72 -0.06 0.00 -1.52 0.00 0.00 31.29 31.45 2giz h VAL 19 CO -0.02 0.19 0.52 0.44 0.02 0.00 0.00 177.57 178.72 2giz h ASP 20 N -0.28 0.80 -0.41 0.57 3.32 -0.49 -0.16 116.42 119.77 2giz h ASP 20 Ca 0.00 0.02 -0.06 0.00 0.02 0.00 0.00 57.03 57.01 2giz h ASP 20 Cb 0.32 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 2giz h ASP 20 CO 0.00 0.50 0.01 0.25 -1.72 0.00 0.00 179.24 178.28 2giz h LEU 21 N 0.93 0.70 -0.36 1.55 5.85 -0.93 0.12 115.31 123.18 2giz h LEU 21 Ca 0.38 -0.30 0.03 0.00 0.84 0.00 0.00 57.88 58.83 2giz h LEU 21 Cb 0.21 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.02 2giz h LEU 21 CO -0.19 0.83 0.15 0.45 -0.34 0.00 0.00 178.44 179.34 2giz h HIS 22 N 0.55 0.27 -0.18 1.25 3.86 -0.75 -0.66 115.15 119.50 2giz h HIS 22 Ca 0.12 0.02 -0.06 0.00 -1.16 0.00 0.00 60.37 59.28 2giz h HIS 22 Cb 0.47 -0.07 -0.01 0.00 1.06 0.00 0.00 27.41 28.86 2giz h HIS 22 CO 0.04 0.13 -0.18 -0.91 0.86 0.00 0.00 177.93 177.87 2giz h ASN 23 N 0.31 0.28 -0.43 2.45 2.35 -0.77 -0.67 115.58 119.11 2giz h ASN 23 Ca 0.16 -0.07 -0.07 0.00 -0.55 0.00 0.00 56.30 55.77 2giz h ASN 23 Cb 0.11 -0.08 -0.02 0.00 0.05 0.00 0.00 38.32 38.38 2giz h ASN 23 CO -0.14 0.48 -0.01 -1.28 -1.65 0.00 0.00 177.43 174.84 2giz h SER 24 N 0.27 0.75 -0.21 5.81 0.87 -0.05 -0.40 113.55 120.60 2giz h SER 24 Ca 0.05 -0.31 -0.08 0.00 -1.23 0.00 0.00 61.79 60.22 2giz h SER 24 Cb 0.48 -0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 62.22 2giz h SER 24 CO 0.03 0.88 -0.12 -0.07 -0.53 0.00 0.00 176.83 177.02 2giz h LEU 25 N 0.61 0.58 -0.86 2.23 3.38 -0.71 -2.04 115.31 118.50 2giz h LEU 25 Ca 0.12 -0.16 -0.12 0.00 0.09 0.00 0.00 57.88 57.81 2giz h LEU 25 Cb 0.50 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 2giz h LEU 25 CO 0.02 0.73 -0.51 0.03 0.09 0.00 0.00 178.44 178.80 2giz h ARG 26 N 0.54 0.15 0.00 1.13 3.08 -0.80 -2.76 114.38 115.72 2giz h ARG 26 Ca 0.10 -0.08 -0.11 0.00 0.07 0.00 0.00 59.98 59.95 2giz h ARG 26 Cb 0.53 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.57 2giz h ARG 26 CO 0.03 0.63 -0.53 0.00 -1.07 0.00 0.00 179.97 179.03 2giz h ARG 27 N 0.12 0.00 -0.51 0.04 3.08 -0.67 -3.23 114.38 113.20 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 0.95 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.00 2giz h ARG 27 CO 0.07 0.53 0.00 0.54 -1.07 0.00 0.00 179.97 180.04 2giz n ARG 28 N -3.60 2.21 -1.53 0.04 1.74 -0.80 -4.99 116.66 109.72 2giz n ARG 28 Ca -0.00 -1.84 -0.36 0.00 -0.77 0.00 0.00 57.85 54.88 2giz n ARG 28 Cb 0.60 -1.41 0.08 0.00 -1.02 0.00 0.00 32.46 30.71 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 0.98 3.89 -3.68 1.55 0.24 -1.15 -5.02 118.33 115.14 2giz n VAL 29 Ca 0.17 -0.43 -0.14 0.00 -2.04 0.00 0.00 64.34 61.90 2giz n VAL 29 Cb 0.44 -1.31 -0.14 0.00 -1.47 0.00 0.00 33.84 31.36 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 -1.54 0.38 0.97 -1.34 0.15 -1.26 -3.85 113.70 107.20 2giz s SER 30 Ca 0.78 0.50 -0.11 0.00 0.70 0.00 0.00 55.95 57.82 2giz s SER 30 Cb -0.36 0.52 0.17 0.00 -1.71 0.00 0.00 66.02 64.64 2giz s SER 30 CO 0.45 -0.23 1.09 -2.16 1.20 0.00 0.00 173.24 173.59 2giz s PRO 31 N 2.19 0.66 0.63 5.44 0.04 -1.26 -4.94 135.00 137.76 2giz s PRO 31 Ca 0.00 1.04 -0.16 0.00 0.04 0.00 0.00 61.00 61.92 2giz s PRO 31 Cb -0.12 -1.72 -0.01 0.00 0.04 0.00 0.00 34.50 32.69 2giz s PRO 31 CO -0.08 -2.71 1.12 0.95 0.04 0.00 0.00 177.00 176.32 2giz s THR 32 N -2.73 3.18 -0.06 1.26 -4.23 -1.25 -4.99 115.64 106.82 2giz s THR 32 Ca 0.65 0.59 0.03 0.00 -1.18 0.00 0.00 61.69 61.78 2giz s THR 32 Cb -0.21 -3.13 -0.03 0.00 1.34 0.00 0.00 72.50 70.47 2giz s THR 32 CO 0.59 -0.30 -0.12 0.00 -0.54 0.00 0.00 174.62 174.25 2giz s ALA 33 N -2.18 2.74 -0.95 3.99 0.00 -1.20 -2.47 121.76 121.70 2giz s ALA 33 Ca 0.69 -0.95 0.22 0.00 0.00 0.00 0.00 51.96 51.91 2giz s ALA 33 Cb -0.22 -1.05 -0.11 0.00 0.00 0.00 0.00 23.12 21.75 2giz s ALA 33 CO 0.38 0.54 0.97 -1.13 0.00 0.00 0.00 175.76 176.52 2giz n SER 34 N 2.36 0.87 -1.55 0.00 3.41 -0.56 -3.29 113.62 114.85 2giz n SER 34 Ca -0.17 -0.81 0.03 0.00 -0.26 0.00 0.00 58.87 57.65 2giz n SER 34 Cb 0.52 0.91 0.06 0.00 -0.26 0.00 0.00 64.21 65.45 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 -1.55 1.40 -4.60 4.04 6.94 -1.26 -1.01 115.26 119.22 2giz n ASN 35 Ca 0.04 -2.45 -0.43 0.00 -0.02 0.00 0.00 54.58 51.72 2giz n ASN 35 Cb 0.34 -0.37 -0.02 0.00 -2.36 0.00 0.00 39.78 37.37 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 -1.35 3.63 0.47 -3.83 1.75 -1.26 -4.74 119.30 113.96 2giz s MET 36 Ca 0.35 0.73 -0.23 0.00 -1.25 0.00 0.00 55.69 55.29 2giz s MET 36 Cb 0.38 -3.98 -0.07 0.00 2.84 0.00 0.00 34.83 34.00 2giz s MET 36 CO -0.12 -1.51 1.20 -0.51 -0.65 0.00 0.00 175.02 173.43 2giz s LEU 37 N 5.02 3.99 0.17 4.11 1.43 -1.07 -0.12 118.68 132.21 2giz s LEU 37 Ca 0.55 2.38 -0.30 0.00 -1.03 0.00 0.00 54.13 55.73 2giz s LEU 37 Cb -0.10 -4.24 -0.07 0.00 0.03 0.00 0.00 46.19 41.81 2giz s LEU 37 CO 0.32 -1.01 0.99 -0.75 0.23 0.00 0.00 176.35 176.13 2giz s LYS 38 N -2.72 4.72 0.37 1.70 2.20 0.44 -4.71 119.74 121.75 2giz s LYS 38 Ca 0.65 1.53 -0.07 0.00 -0.36 0.00 0.00 55.97 57.71 2giz s LYS 38 Cb -0.31 -3.32 -0.05 0.00 -1.51 0.00 0.00 37.83 32.64 2giz s LYS 38 CO 0.37 0.28 0.68 -1.64 -0.36 0.00 0.00 175.35 174.68 2giz s MET 39 N -0.47 3.67 0.04 4.03 -1.94 -1.26 -4.71 119.30 118.65 2giz s MET 39 Ca 0.46 0.21 -0.01 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 34.06 2giz s MET 39 CO 0.32 0.03 -0.01 -1.83 -0.01 0.00 0.00 175.02 173.52 2giz s GLU 40 N -3.92 0.53 0.38 2.03 -1.05 0.53 -4.97 118.70 112.22 2giz s GLU 40 Ca 0.47 -0.99 -0.26 0.00 -0.15 0.00 0.00 54.97 54.04 2giz s GLU 40 Cb -0.10 0.19 -0.09 0.00 -0.44 0.00 0.00 34.13 33.68 2giz s GLU 40 CO 0.33 -0.10 1.22 -0.46 0.95 0.00 0.00 175.26 177.21 2giz s TRP 41 N -3.06 3.05 -0.32 4.83 -0.11 -1.26 -1.54 118.94 120.52 2giz s TRP 41 Ca -0.01 1.51 0.00 0.00 1.22 0.00 0.00 56.10 58.82 2giz s TRP 41 Cb 0.02 -3.51 0.10 0.00 -1.50 0.00 0.00 33.47 28.58 2giz s TRP 41 CO -0.07 -1.54 0.10 -0.47 -4.62 0.00 0.00 176.95 170.35 2giz s TYR 42 N -1.30 2.13 0.28 5.86 5.04 0.18 -4.78 117.35 124.76 2giz s TYR 42 Ca 0.54 -2.03 -0.00 0.00 -2.44 0.00 0.00 57.07 53.14 2giz s TYR 42 Cb -0.34 -1.97 0.65 0.00 0.35 0.00 0.00 41.96 40.65 2giz s TYR 42 CO 0.44 -0.89 1.63 -1.35 -1.34 0.00 0.00 175.55 174.04 2giz h PRO 43 N 7.91 0.14 -0.93 4.97 0.11 -1.95 -0.69 132.00 141.56 2giz h PRO 43 Ca -0.11 -0.01 0.05 0.00 0.11 0.00 0.00 66.00 66.04 2giz h PRO 43 Cb 1.01 -0.03 -0.06 0.00 0.11 0.00 0.00 31.00 32.03 2giz h PRO 43 CO 0.48 0.09 0.60 0.93 -0.21 0.00 0.00 178.00 179.89 2giz h GLU 44 N 0.14 1.10 -0.09 1.05 3.07 -1.97 0.43 114.58 118.32 2giz h GLU 44 Ca 0.52 -0.07 -0.19 0.00 -0.50 0.00 0.00 59.36 59.12 2giz h GLU 44 Cb 1.04 -0.25 -0.00 0.00 -0.84 0.00 0.00 28.75 28.70 2giz h GLU 44 CO -0.71 0.73 -0.76 0.00 -1.40 0.00 0.00 179.01 176.88 2giz h ALA 45 N 1.40 0.53 -0.66 3.43 0.00 -1.52 -2.03 119.26 120.40 2giz h ALA 45 Ca 0.38 -0.61 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 2giz h ALA 45 Cb 0.06 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 2giz h ALA 45 CO -0.14 0.75 0.33 0.00 0.00 0.00 0.00 179.25 180.19 2giz h ALA 46 N 0.85 0.85 -0.38 0.00 0.00 -0.45 0.21 119.26 120.35 2giz h ALA 46 Ca -0.04 -0.13 -0.13 0.00 0.00 0.00 0.00 54.91 54.61 2giz h ALA 46 Cb 1.34 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 2giz h ALA 46 CO 0.13 0.41 -0.28 0.77 0.00 0.00 0.00 179.25 180.28 2giz h SER 47 N 0.92 0.84 -0.45 0.00 0.02 -0.90 -0.31 113.55 113.67 2giz h SER 47 Ca 0.23 -0.33 -0.14 0.00 -0.84 0.00 0.00 61.79 60.71 2giz h SER 47 Cb 0.11 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.40 2giz h SER 47 CO -0.03 1.06 -0.27 -1.13 -1.14 0.00 0.00 176.83 175.33 2giz h ASN 48 N 0.69 1.01 -0.32 3.07 -1.24 -1.00 -0.90 115.58 116.90 2giz h ASN 48 Ca 0.08 -0.41 -0.10 0.00 0.71 0.00 0.00 56.30 56.59 2giz h ASN 48 Cb 0.82 -0.28 -0.02 0.00 0.73 0.00 0.00 38.32 39.57 2giz h ASN 48 CO 0.07 1.21 -0.14 0.00 -1.29 0.00 0.00 177.43 177.28 2giz h ALA 49 N 0.85 0.98 -0.34 1.57 0.00 -0.45 -1.97 119.26 119.91 2giz h ALA 49 Ca 0.10 -0.33 -0.05 0.00 0.00 0.00 0.00 54.91 54.63 2giz h ALA 49 Cb 0.85 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 2giz h ALA 49 CO 0.08 0.60 0.02 1.49 0.00 0.00 0.00 179.25 181.44 2giz h GLU 50 N 0.68 0.58 -0.51 0.00 4.81 -0.82 0.11 114.58 119.42 2giz h GLU 50 Ca 0.11 -0.17 0.03 0.00 -0.13 0.00 0.00 59.36 59.19 2giz h GLU 50 Cb 0.62 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.90 2giz h GLU 50 CO 0.04 0.69 0.30 0.00 -0.73 0.00 0.00 179.01 179.31 2giz h ARG 51 N 0.40 0.58 -0.23 1.92 3.08 -0.95 -0.72 114.38 118.45 2giz h ARG 51 Ca 0.10 -0.04 -0.07 0.00 0.07 0.00 0.00 59.98 60.05 2giz h ARG 51 Cb 0.41 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.32 2giz h ARG 51 CO 0.01 0.39 -0.11 2.35 -1.07 0.00 0.00 179.97 181.54 2giz h TRP 52 N 0.60 0.56 -0.95 3.04 2.91 -1.16 -3.08 115.95 117.87 2giz h TRP 52 Ca 0.21 -0.14 0.04 0.00 1.13 0.00 0.00 58.89 60.13 2giz h TRP 52 Cb 0.03 -0.13 -0.06 0.00 -0.51 0.00 0.00 29.16 28.50 2giz h TRP 52 CO -0.07 0.76 0.62 0.00 -1.03 0.00 0.00 178.44 178.72 2giz h ALA 53 N 0.72 1.26 0.00 2.65 0.00 -0.60 -1.39 119.26 121.90 2giz h ALA 53 Ca 0.05 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2giz h ALA 53 Cb 0.61 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2giz h ALA 53 CO 0.03 0.50 0.00 0.09 0.00 0.00 0.00 179.25 179.87 2giz n ASN 54 N -4.48 0.22 0.15 0.00 3.02 -0.29 -1.45 115.26 112.42 2giz n ASN 54 Ca 0.13 0.57 0.13 0.00 -0.03 0.00 0.00 54.58 55.38 2giz n ASN 54 Cb 0.09 -0.61 0.32 0.00 -0.61 0.00 0.00 39.78 38.97 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 -4.03 3.41 1.35 -1.21 -3.47 112.91 108.96 2giz h THR 55 Ca 0.00 -0.67 -0.39 0.00 -0.55 0.00 0.00 66.41 64.80 2giz h THR 55 Cb 0.16 1.67 0.01 0.00 -1.73 0.00 0.00 68.15 68.26 2giz h THR 55 CO 0.00 0.00 -0.55 0.00 -0.25 0.00 0.00 175.52 174.72 2giz h SER 57 N -0.73 0.14 -4.31 0.00 4.64 -1.81 -3.47 113.55 108.01 2giz h SER 57 Ca -0.48 -0.04 -0.40 0.00 -0.47 0.00 0.00 61.79 60.40 2giz h SER 57 Cb 1.34 -0.04 0.06 0.00 -0.31 0.00 0.00 62.40 63.45 2giz h SER 57 CO 0.55 0.40 -0.60 0.18 -0.87 0.00 0.00 176.83 176.49 2giz n LEU 58 N -4.19 -2.64 -4.01 5.97 4.77 -1.26 -4.96 117.00 110.69 2giz n LEU 58 Ca -0.01 -0.27 -0.11 0.00 -0.03 0.00 0.00 56.01 55.59 2giz n LEU 58 Cb 0.34 -2.96 -0.04 0.00 -2.33 0.00 0.00 43.42 38.43 2giz n LEU 58 CO 0.39 0.20 0.20 0.21 -1.33 0.00 0.00 177.39 177.06 2giz s ASN 59 N -2.67 0.23 0.47 -1.43 2.47 -1.26 -5.08 114.94 107.67 2giz s ASN 59 Ca 0.28 -1.13 -0.20 0.00 0.42 0.00 0.00 52.86 52.24 2giz s ASN 59 Cb -0.12 0.64 -0.09 0.00 -1.45 0.00 0.00 41.25 40.22 2giz s ASN 59 CO 0.35 -1.25 0.99 -1.00 -3.72 0.00 0.00 177.10 172.47 2giz s HIS 60 N -3.53 3.20 0.48 0.43 3.76 -1.26 -5.05 115.29 113.32 2giz s HIS 60 Ca 0.24 1.57 -0.05 0.00 -0.15 0.00 0.00 55.06 56.67 2giz s HIS 60 Cb -0.01 -2.93 -0.03 0.00 1.11 0.00 0.00 32.58 30.72 2giz s HIS 60 CO 0.13 -0.47 0.77 -1.54 -0.85 0.00 0.00 174.74 172.78 2giz s SER 61 N -2.29 6.24 0.50 1.40 1.04 -1.26 -5.04 113.70 114.29 2giz s SER 61 Ca 0.63 0.89 -0.23 0.00 0.48 0.00 0.00 55.95 57.73 2giz s SER 61 Cb -0.12 -2.21 -0.06 0.00 0.10 0.00 0.00 66.02 63.72 2giz s SER 61 CO 0.20 -0.58 1.29 -2.84 0.98 0.00 0.00 173.24 172.29 2giz s PRO 62 N -4.72 3.45 0.27 4.02 0.02 -1.26 -4.91 135.00 131.87 2giz s PRO 62 Ca 0.47 2.07 -0.01 0.00 0.02 0.00 0.00 61.00 63.55 2giz s PRO 62 Cb -0.10 -2.37 0.51 0.00 0.02 0.00 0.00 34.50 32.56 2giz s PRO 62 CO 0.44 -0.89 1.80 -0.44 -0.33 0.00 0.00 177.00 177.59 2giz h ASP 63 N 1.81 0.73 0.02 2.53 3.32 -1.96 -0.70 116.42 122.16 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 1.27 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 40.75 2giz h ASP 63 CO 0.59 0.37 -0.00 -0.55 -1.72 0.00 0.00 179.24 177.92 2giz h ASN 64 N 0.81 0.00 0.07 6.45 7.08 -1.98 0.74 115.58 128.75 2giz h ASN 64 Ca 0.46 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.68 2giz h ASN 64 Cb 0.53 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.77 2giz h ASN 64 CO -0.30 0.00 -0.07 0.18 -2.08 0.00 0.00 177.43 175.16 2giz n LEU 65 N -3.27 1.25 -0.75 6.14 4.77 -0.27 -4.01 117.00 120.86 2giz n LEU 65 Ca -0.03 -0.39 0.03 0.00 -0.03 0.00 0.00 56.01 55.60 2giz n LEU 65 Cb 0.08 -0.04 0.20 0.00 -2.33 0.00 0.00 43.42 41.33 2giz n LEU 65 CO 0.22 0.21 0.58 0.54 -1.33 0.00 0.00 177.39 177.61 2giz n ARG 66 N -0.15 1.82 -3.26 3.23 1.74 0.25 -4.91 116.66 115.39 2giz n ARG 66 Ca 0.17 -3.06 -0.45 0.00 -0.77 0.00 0.00 57.85 53.75 2giz n ARG 66 Cb 0.34 -1.70 -0.06 0.00 -1.02 0.00 0.00 32.46 30.01 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 -3.11 5.06 -0.21 1.55 1.01 -1.24 -0.38 120.40 123.07 2giz s VAL 67 Ca 0.40 -1.01 -0.05 0.00 0.00 0.00 0.00 61.98 61.32 2giz s VAL 67 Cb 0.36 -4.29 -0.02 0.00 0.00 0.00 0.00 36.38 32.43 2giz s VAL 67 CO -0.00 -0.81 0.01 -0.76 0.00 0.00 0.00 175.10 173.54 2giz s LEU 68 N 2.08 3.25 -1.57 3.92 1.43 -0.03 -4.52 118.68 123.25 2giz s LEU 68 Ca 0.08 -0.22 -0.14 0.00 -1.03 0.00 0.00 54.13 52.82 2giz s LEU 68 Cb -0.24 -1.83 0.10 0.00 0.03 0.00 0.00 46.19 44.24 2giz s LEU 68 CO 0.07 0.03 0.87 -0.62 0.23 0.00 0.00 176.35 176.93 2giz n GLU 69 N 4.44 -4.58 -0.03 1.70 1.02 -1.26 -1.39 120.64 120.54 2giz n GLU 69 Ca -0.17 0.51 0.00 0.00 -0.02 0.00 0.00 57.16 57.48 2giz n GLU 69 Cb 0.52 -5.28 0.00 0.00 -0.02 0.00 0.00 31.44 26.66 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 -1.61 2.20 3.66 0.62 0.00 -1.26 -5.03 105.19 103.76 2giz n GLY 70 Ca 0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.79 4.83 -0.09 -0.61 1.01 -0.49 -5.02 121.20 118.05 2giz s ILE 71 Ca 0.00 -0.02 -0.30 0.00 0.00 0.00 0.00 60.65 60.33 2giz s ILE 71 Cb 0.00 -3.16 -0.03 0.00 0.01 0.00 0.00 42.46 39.27 2giz s ILE 71 CO 0.00 0.48 1.35 -1.58 0.00 0.00 0.00 174.94 175.19 2giz s GLN 72 N 0.18 4.25 0.19 2.79 2.00 -1.26 -0.85 119.66 126.97 2giz s GLN 72 Ca 0.05 1.82 0.06 0.00 -2.00 0.00 0.00 55.36 55.29 2giz s GLN 72 Cb -0.12 -3.73 -0.04 0.00 0.80 0.00 0.00 33.01 29.92 2giz s GLN 72 CO 0.00 -0.66 0.13 0.00 -0.50 0.00 0.00 175.29 174.27 2giz n GLY 74 N -0.58 1.02 3.63 0.00 0.00 0.32 -4.67 105.19 104.91 2giz n GLY 74 Ca -0.08 -2.04 -0.13 0.00 0.00 0.00 0.00 46.02 43.77 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 -3.51 0.80 -0.02 1.61 2.12 -1.26 -1.56 118.70 116.88 2giz s GLU 75 Ca 0.29 0.94 0.04 0.00 0.36 0.00 0.00 54.97 56.60 2giz s GLU 75 Cb -0.02 0.39 -0.01 0.00 0.26 0.00 0.00 34.13 34.76 2giz s GLU 75 CO 0.19 -0.10 -0.13 -1.12 -0.54 0.00 0.00 175.26 173.56 2giz s SER 76 N 0.34 1.63 0.22 -1.70 0.01 -0.23 -5.00 113.70 108.97 2giz s SER 76 Ca 0.00 -0.25 0.07 0.00 1.31 0.00 0.00 55.95 57.08 2giz s SER 76 Cb -0.05 -0.29 -0.05 0.00 0.21 0.00 0.00 66.02 65.85 2giz s SER 76 CO 0.00 0.14 -0.10 0.27 0.41 0.00 0.00 173.24 173.96 2giz s ILE 77 N -0.15 1.61 -0.11 1.44 -4.36 -1.26 -1.48 121.20 116.89 2giz s ILE 77 Ca 0.02 -2.16 -0.15 0.00 -0.26 0.00 0.00 60.65 58.10 2giz s ILE 77 Cb -0.07 -2.17 0.04 0.00 1.25 0.00 0.00 42.46 41.51 2giz s ILE 77 CO 0.00 -0.50 0.38 -0.47 0.24 0.00 0.00 174.94 174.59 2giz s TYR 78 N -3.05 -0.37 0.02 1.37 5.04 -0.47 -4.99 117.35 114.89 2giz s TYR 78 Ca 0.24 0.84 0.03 0.00 -2.44 0.00 0.00 57.07 55.75 2giz s TYR 78 Cb 0.01 0.14 -0.02 0.00 0.35 0.00 0.00 41.96 42.45 2giz s TYR 78 CO 0.08 -0.27 -0.11 0.00 -1.34 0.00 0.00 175.55 173.91 2giz s MET 79 N -0.27 0.75 0.03 4.97 0.23 -1.26 -0.27 119.30 123.47 2giz s MET 79 Ca -0.04 -0.58 -0.07 0.00 -1.03 0.00 0.00 55.69 53.97 2giz s MET 79 Cb -0.03 -0.69 -0.00 0.00 -1.53 0.00 0.00 34.83 32.57 2giz s MET 79 CO 0.02 0.17 0.14 0.45 -2.03 0.00 0.00 175.02 173.77 2giz s SER 80 N -0.86 0.09 0.09 -1.18 0.15 0.08 -5.00 113.70 107.07 2giz s SER 80 Ca -0.00 -0.40 -0.06 0.00 0.70 0.00 0.00 55.95 56.19 2giz s SER 80 Cb -0.06 0.24 -0.22 0.00 -1.71 0.00 0.00 66.02 64.27 2giz s SER 80 CO 0.00 -0.49 1.19 0.28 1.20 0.00 0.00 173.24 175.42 2giz h SER 81 N 3.75 0.54 -2.04 5.45 0.02 -1.93 -0.21 113.55 119.13 2giz h SER 81 Ca -0.32 -0.51 -0.60 0.00 -0.84 0.00 0.00 61.79 59.52 2giz h SER 81 Cb 1.19 -0.17 -0.12 0.00 0.14 0.00 0.00 62.40 63.43 2giz h SER 81 CO 0.47 1.36 -0.68 0.20 -1.14 0.00 0.00 176.83 177.04 2giz s ASN 82 N -7.19 3.91 0.25 3.07 0.01 -1.26 -4.41 114.94 109.33 2giz s ASN 82 Ca -0.05 -1.03 -0.30 0.00 -0.71 0.00 0.00 52.86 50.77 2giz s ASN 82 Cb 0.07 -0.44 -0.10 0.00 0.41 0.00 0.00 41.25 41.19 2giz s ASN 82 CO 0.89 -0.12 1.35 0.00 -1.51 0.00 0.00 177.10 177.71 2giz s ALA 83 N -2.52 3.56 0.12 0.60 0.00 -1.26 -4.80 121.76 117.46 2giz s ALA 83 Ca 0.32 1.22 0.08 0.00 0.00 0.00 0.00 51.96 53.58 2giz s ALA 83 Cb -0.01 -3.51 -0.04 0.00 0.00 0.00 0.00 23.12 19.56 2giz s ALA 83 CO 0.17 -0.63 -0.18 1.03 0.00 0.00 0.00 175.76 176.15 2giz s ARG 84 N -0.59 1.13 0.51 0.00 1.81 -1.26 -5.14 118.95 115.41 2giz s ARG 84 Ca 0.56 -1.24 -0.17 0.00 -1.72 0.00 0.00 55.73 53.15 2giz s ARG 84 Cb -0.39 -1.24 -0.08 0.00 -0.45 0.00 0.00 34.95 32.79 2giz s ARG 84 CO 0.43 0.27 0.99 0.95 -0.68 0.00 0.00 175.30 177.26 2giz s THR 85 N -1.64 4.37 0.40 0.02 -4.23 -1.26 -4.93 115.64 108.37 2giz s THR 85 Ca 0.09 1.21 0.08 0.00 -1.18 0.00 0.00 61.69 61.89 2giz s THR 85 Cb -0.08 -3.64 0.21 0.00 1.34 0.00 0.00 72.50 70.33 2giz s THR 85 CO 0.05 -0.58 1.98 -0.50 -0.54 0.00 0.00 174.62 175.03 2giz h TRP 86 N 1.06 0.39 -0.80 3.99 4.06 -1.99 -1.66 115.95 120.99 2giz h TRP 86 Ca -0.47 -0.02 -0.03 0.00 2.06 0.00 0.00 58.89 60.43 2giz h TRP 86 Cb 1.19 -0.12 -0.04 0.00 -1.00 0.00 0.00 29.16 29.19 2giz h TRP 86 CO 0.62 0.35 0.38 1.15 -3.56 0.00 0.00 178.44 177.38 2giz h THR 87 N 0.39 1.25 -0.26 1.49 2.02 -1.97 0.29 112.91 116.12 2giz h THR 87 Ca 0.09 -0.72 -0.04 0.00 0.77 0.00 0.00 66.41 66.51 2giz h THR 87 Cb 0.17 0.24 -0.01 0.00 -1.74 0.00 0.00 68.15 66.81 2giz h THR 87 CO -0.00 0.31 0.02 -0.08 0.37 0.00 0.00 175.52 176.14 2giz h GLU 88 N 1.14 0.45 -0.18 6.66 4.81 -1.71 -1.80 114.58 123.96 2giz h GLU 88 Ca 0.27 -0.13 0.02 0.00 -0.13 0.00 0.00 59.36 59.39 2giz h GLU 88 Cb 0.13 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.45 2giz h GLU 88 CO -0.03 0.59 0.05 0.82 -0.73 0.00 0.00 179.01 179.70 2giz h ILE 89 N 0.24 0.94 -0.37 2.32 1.08 -1.04 0.60 117.51 121.29 2giz h ILE 89 Ca 0.08 -0.04 -0.07 0.00 -0.39 0.00 0.00 64.86 64.43 2giz h ILE 89 Cb 0.37 0.80 -0.02 0.00 -3.07 0.00 0.00 36.82 34.90 2giz h ILE 89 CO 0.01 0.02 -0.06 0.40 -0.69 0.00 0.00 178.15 177.83 2giz h ILE 90 N 0.13 1.23 -0.09 -0.67 2.04 -0.95 -0.99 117.51 118.21 2giz h ILE 90 Ca 0.08 -0.97 -0.14 0.00 1.00 0.00 0.00 64.86 64.83 2giz h ILE 90 Cb 0.06 1.01 -0.01 0.00 -0.74 0.00 0.00 36.82 37.14 2giz h ILE 90 CO -0.09 0.33 -0.55 0.45 0.00 0.00 0.00 178.15 178.29 2giz h HIS 91 N 0.57 0.33 -0.27 1.37 3.86 -0.88 0.34 115.15 120.46 2giz h HIS 91 Ca 0.11 -0.12 -0.09 0.00 -1.16 0.00 0.00 60.37 59.11 2giz h HIS 91 Cb 0.45 -0.06 -0.01 0.00 1.06 0.00 0.00 27.41 28.84 2giz h HIS 91 CO 0.02 0.75 -0.22 -0.07 0.86 0.00 0.00 177.93 179.27 2giz h LEU 92 N 0.20 0.51 -0.13 2.43 3.38 -0.16 0.40 115.31 121.94 2giz h LEU 92 Ca 0.00 -0.16 -0.07 0.00 0.09 0.00 0.00 57.88 57.74 2giz h LEU 92 Cb 1.03 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.64 2giz h LEU 92 CO 0.09 0.73 -0.18 -0.50 0.09 0.00 0.00 178.44 178.67 2giz h TRP 93 N 0.46 0.44 -0.19 1.13 6.55 -0.90 -3.24 115.95 120.20 2giz h TRP 93 Ca 0.07 -0.14 -0.07 0.00 0.95 0.00 0.00 58.89 59.70 2giz h TRP 93 Cb 0.63 -0.09 -0.01 0.00 -0.86 0.00 0.00 29.16 28.83 2giz h TRP 93 CO 0.02 0.79 -0.19 1.25 -1.05 0.00 0.00 178.44 179.26 2giz h HIS 94 N -0.04 0.35 0.00 0.49 2.76 -0.61 -3.08 115.15 115.03 2giz h HIS 94 Ca 0.02 -0.06 0.00 0.00 -2.20 0.00 0.00 60.37 58.13 2giz h HIS 94 Cb 0.73 -0.09 0.00 0.00 1.55 0.00 0.00 27.41 29.60 2giz h HIS 94 CO 0.09 0.51 0.28 -0.44 -1.30 0.00 0.00 177.93 177.07 2giz h ASP 95 N 0.30 0.00 0.23 3.26 3.32 -0.22 -0.92 116.42 122.40 2giz h ASP 95 Ca 0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.10 2giz h ASP 95 Cb 0.51 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.06 2giz h ASP 95 CO 0.03 0.00 0.00 -0.62 -1.72 0.00 0.00 179.24 176.93 2giz n GLU 96 N -2.34 0.01 0.26 3.56 1.02 -1.17 -1.70 120.64 120.27 2giz n GLU 96 Ca -0.01 0.37 0.11 0.00 -0.02 0.00 0.00 57.16 57.60 2giz n GLU 96 Cb 0.31 -1.50 0.72 0.00 -0.02 0.00 0.00 31.44 30.95 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 -1.44 -0.94 116.97 114.27 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 0.12 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 36.84 2giz h TYR 97 CO 0.00 0.08 -0.13 0.87 -0.00 0.00 0.00 178.16 178.98 2giz h LYS 98 N 0.00 0.00 -0.45 0.10 1.57 -1.58 -2.43 116.57 113.77 2giz h LYS 98 Ca -0.00 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.55 2giz h LYS 98 Cb 0.18 0.00 -0.14 0.00 0.08 0.00 0.00 32.23 32.35 2giz h LYS 98 CO 0.01 0.13 0.03 0.09 -0.57 0.00 0.00 179.45 179.14 2giz n ASN 99 N -3.58 2.68 -3.99 0.86 5.03 -0.36 -4.94 115.26 110.96 2giz n ASN 99 Ca -0.01 -3.75 -0.18 0.00 0.87 0.00 0.00 54.58 51.51 2giz n ASN 99 Cb 0.26 -0.67 -0.15 0.00 -1.02 0.00 0.00 39.78 38.21 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 -3.26 0.68 -0.14 3.10 5.36 -0.92 -0.59 117.98 122.22 2giz s PHE 100 Ca 0.47 -0.14 0.00 0.00 -0.96 0.00 0.00 56.93 56.30 2giz s PHE 100 Cb 0.42 -0.46 0.02 0.00 -0.34 0.00 0.00 43.02 42.66 2giz s PHE 100 CO 0.01 -0.03 -0.13 0.08 -1.46 0.00 0.00 175.22 173.69 2giz s VAL 101 N -0.06 1.50 0.25 3.12 1.01 0.21 -4.89 120.40 121.54 2giz s VAL 101 Ca 0.01 -0.59 -0.31 0.00 0.00 0.00 0.00 61.98 61.09 2giz s VAL 101 Cb -0.04 -1.41 -0.13 0.00 0.00 0.00 0.00 36.38 34.80 2giz s VAL 101 CO -0.00 0.45 1.53 0.00 0.00 0.00 0.00 175.10 177.07 2giz n TYR 102 N 4.77 2.49 -0.41 5.22 9.36 -1.26 -0.63 117.16 136.69 2giz n TYR 102 Ca -0.16 0.31 0.00 0.00 3.32 0.00 0.00 57.90 61.36 2giz n TYR 102 Cb 0.50 -2.54 0.00 0.00 -0.63 0.00 0.00 39.34 36.67 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 2.49 1.96 1.10 2.98 0.00 0.49 -4.74 105.19 109.47 2giz n GLY 103 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 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 0.34 0.00 1.61 0.31 -0.62 -4.96 118.33 113.01 2giz n VAL 104 Ca 0.00 0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.44 2giz n VAL 104 Cb 0.00 -1.44 0.00 0.00 -0.91 0.00 0.00 33.84 31.49 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 3.01 0.26 3.73 2.92 0.00 0.20 -4.89 105.19 110.42 2giz n GLY 105 Ca 0.00 -1.93 -0.42 0.00 0.00 0.00 0.00 46.02 43.67 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 -1.85 3.76 -0.21 4.61 0.00 -1.26 -0.62 121.76 126.19 2giz s ALA 106 Ca 0.00 1.45 -0.04 0.00 0.00 0.00 0.00 51.96 53.37 2giz s ALA 106 Cb 0.00 -3.62 0.09 0.00 0.00 0.00 0.00 23.12 19.58 2giz s ALA 106 CO 0.00 -0.85 0.18 1.21 0.00 0.00 0.00 175.76 176.30 2giz s ASN 107 N 0.77 1.92 0.80 0.00 3.04 0.24 -3.30 114.94 118.40 2giz s ASN 107 Ca 0.66 -0.50 -0.12 0.00 0.04 0.00 0.00 52.86 52.94 2giz s ASN 107 Cb -0.45 0.14 0.08 0.00 -1.54 0.00 0.00 41.25 39.47 2giz s ASN 107 CO 0.39 -0.35 1.13 -2.16 -3.04 0.00 0.00 177.10 173.07 2giz s PRO 108 N 2.25 1.86 0.41 0.43 0.04 -1.26 -4.14 135.00 134.58 2giz s PRO 108 Ca 0.06 1.44 -0.24 0.00 0.04 0.00 0.00 61.00 62.30 2giz s PRO 108 Cb -0.16 -1.83 -0.11 0.00 0.04 0.00 0.00 34.50 32.44 2giz s PRO 108 CO -0.16 -1.99 0.96 -2.30 0.04 0.00 0.00 177.00 173.56 2giz n PRO 109 N -3.50 1.27 0.00 0.56 -0.02 -1.21 -1.77 135.00 130.33 2giz n PRO 109 Ca 0.11 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 2giz n PRO 109 Cb 0.52 -1.97 0.00 0.00 -0.02 0.00 0.00 33.50 32.03 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 1.25 2.92 3.68 -1.23 0.00 -1.26 -5.02 105.19 105.53 2giz n GLY 110 Ca 0.10 0.00 -0.39 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 1.94 -4.70 1.61 7.64 -0.73 -4.94 113.62 114.45 2giz n SER 111 Ca 0.00 0.97 -0.41 0.00 1.01 0.00 0.00 58.87 60.43 2giz n SER 111 Cb 0.00 -1.48 -0.04 0.00 -1.01 0.00 0.00 64.21 61.69 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 -1.33 4.90 0.00 0.44 1.01 -1.26 -4.76 120.40 119.40 2giz s VAL 112 Ca 0.69 1.77 0.00 0.00 0.00 0.00 0.00 61.98 64.45 2giz s VAL 112 Cb -0.46 -4.19 0.00 0.00 0.00 0.00 0.00 36.38 31.73 2giz s VAL 112 CO 0.52 0.11 0.13 0.35 0.00 0.00 0.00 175.10 176.21 2giz n THR 113 N 4.25 0.00 0.27 3.92 -2.24 -1.26 -4.82 114.28 114.39 2giz n THR 113 Ca 0.04 -0.16 0.11 0.00 -2.27 0.00 0.00 64.05 61.77 2giz n THR 113 Cb 0.50 1.56 0.74 0.00 -2.10 0.00 0.00 70.33 71.03 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 1.65 3.38 0.00 -1.95 -1.59 103.07 104.56 2giz h GLY 114 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.13 2giz h GLY 114 CO 0.00 0.00 -0.84 0.45 0.00 0.00 0.00 176.54 176.15 2giz h HIS 115 N 0.00 0.46 -0.05 5.60 3.86 -1.90 -2.18 115.15 120.95 2giz h HIS 115 Ca 0.01 -0.23 -0.03 0.00 -1.16 0.00 0.00 60.37 58.95 2giz h HIS 115 Cb 0.02 -0.06 0.00 0.00 1.06 0.00 0.00 27.41 28.44 2giz h HIS 115 CO 0.00 1.02 -0.10 -0.92 0.86 0.00 0.00 177.93 178.79 2giz h TYR 116 N 0.20 0.19 0.00 2.45 3.20 -1.35 -2.66 116.97 118.99 2giz h TYR 116 Ca -0.05 -0.07 -0.02 0.00 3.14 0.00 0.00 58.73 61.73 2giz h TYR 116 Cb 1.44 -0.03 -0.00 0.00 1.54 0.00 0.00 36.73 39.68 2giz h TYR 116 CO 0.04 0.69 -0.11 1.79 -1.64 0.00 0.00 178.16 178.93 2giz h THR 117 N -0.37 0.79 -0.09 1.81 1.35 -1.35 -1.45 112.91 113.59 2giz h THR 117 Ca 0.00 -0.43 -0.20 0.00 -0.55 0.00 0.00 66.41 65.23 2giz h THR 117 Cb 0.69 1.25 0.00 0.00 -1.73 0.00 0.00 68.15 68.36 2giz h THR 117 CO 0.02 0.11 -0.78 -0.61 -0.25 0.00 0.00 175.52 174.01 2giz h GLN 118 N 0.00 0.53 -0.62 4.72 5.75 -1.37 -1.37 115.11 122.74 2giz h GLN 118 Ca -0.00 -0.45 -0.04 0.00 -0.15 0.00 0.00 58.65 58.01 2giz h GLN 118 Cb 0.24 0.10 -0.03 0.00 1.07 0.00 0.00 27.48 28.86 2giz h GLN 118 CO 0.01 1.08 0.22 0.82 -2.65 0.00 0.00 178.83 178.32 2giz h ILE 119 N 0.35 1.23 -0.58 2.39 2.04 -0.92 -2.86 117.51 119.16 2giz h ILE 119 Ca -0.05 -0.75 -0.15 0.00 1.00 0.00 0.00 64.86 64.91 2giz h ILE 119 Cb 1.39 0.52 -0.09 0.00 -0.74 0.00 0.00 36.82 37.90 2giz h ILE 119 CO 0.14 0.29 0.15 1.33 0.00 0.00 0.00 178.15 180.07 2giz n VAL 120 N -4.29 2.74 -2.30 1.67 0.24 -0.80 -4.78 118.33 110.81 2giz n VAL 120 Ca 0.05 -1.82 -0.43 0.00 -2.04 0.00 0.00 64.34 60.11 2giz n VAL 120 Cb 0.19 -0.33 -0.02 0.00 -1.47 0.00 0.00 33.84 32.21 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 -2.98 2.52 0.38 6.34 -0.11 -0.53 -4.52 118.94 120.05 2giz s TRP 121 Ca 0.51 0.75 0.09 0.00 1.22 0.00 0.00 56.10 58.68 2giz s TRP 121 Cb 0.41 -3.77 0.85 0.00 -1.50 0.00 0.00 33.47 29.46 2giz s TRP 121 CO 0.11 -2.28 1.93 0.10 -4.62 0.00 0.00 176.95 172.19 2giz h TYR 122 N 9.21 0.70 0.00 5.86 -0.00 -1.21 -2.46 116.97 129.06 2giz h TYR 122 Ca -0.30 0.02 -0.05 0.00 0.00 0.00 0.00 58.73 58.40 2giz h TYR 122 Cb 1.12 -0.22 -0.01 0.00 0.00 0.00 0.00 36.73 37.62 2giz h TYR 122 CO 0.86 0.32 -0.24 1.96 -0.00 0.00 0.00 178.16 181.05 2giz h GLN 123 N 0.64 0.00 -6.16 0.10 4.20 -1.85 -2.84 115.11 109.20 2giz h GLN 123 Ca 0.36 0.00 -0.57 0.00 0.06 0.00 0.00 58.65 58.50 2giz h GLN 123 Cb 0.52 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.26 2giz h GLN 123 CO -0.13 0.24 0.89 0.99 -0.67 0.00 0.00 178.83 180.15 2giz s THR 124 N -3.34 4.33 0.00 -0.54 2.01 -0.93 -4.25 115.64 112.92 2giz s THR 124 Ca 0.03 1.60 0.00 0.00 0.31 0.00 0.00 61.69 63.63 2giz s THR 124 Cb 0.08 -4.07 0.00 0.00 0.01 0.00 0.00 72.50 68.52 2giz s THR 124 CO 0.67 -0.19 0.62 0.00 -0.69 0.00 0.00 174.62 175.03 2giz n TYR 125 N 6.69 0.00 -4.43 4.92 0.18 -1.02 -4.70 117.16 118.80 2giz n TYR 125 Ca 0.14 -0.19 -0.21 0.00 1.88 0.00 0.00 57.90 59.51 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 -0.38 1.11 0.01 -3.48 0.52 -0.65 -0.34 118.95 115.73 2giz s ARG 126 Ca 0.00 -0.32 -0.01 0.00 -0.52 0.00 0.00 55.73 54.88 2giz s ARG 126 Cb 0.00 -1.01 -0.01 0.00 0.52 0.00 0.00 34.95 34.45 2giz s ARG 126 CO 0.00 0.09 0.01 0.00 0.02 0.00 0.00 175.30 175.42 2giz s ALA 127 N 0.33 0.00 -0.13 2.13 0.00 -0.59 -0.71 121.76 122.79 2giz s ALA 127 Ca -0.06 -0.25 -0.08 0.00 0.00 0.00 0.00 51.96 51.57 2giz s ALA 127 Cb -0.11 0.06 0.05 0.00 0.00 0.00 0.00 23.12 23.12 2giz s ALA 127 CO 0.01 -0.10 0.33 0.20 0.00 0.00 0.00 175.76 176.21 2giz s GLY 128 N -0.78 -0.24 0.24 0.00 0.00 -0.68 -0.65 107.32 105.22 2giz s GLY 128 Ca -0.09 1.19 0.01 0.00 0.00 0.00 0.00 44.72 45.83 2giz s GLY 128 CO -0.00 1.30 0.11 0.00 0.00 0.00 0.00 173.10 174.51 2giz s ALA 130 N -3.86 -1.75 -0.01 0.00 0.00 -0.09 -4.74 121.76 111.30 2giz s ALA 130 Ca 0.38 1.12 0.04 0.00 0.00 0.00 0.00 51.96 53.50 2giz s ALA 130 Cb 0.07 0.17 -0.01 0.00 0.00 0.00 0.00 23.12 23.35 2giz s ALA 130 CO 0.13 -0.49 -0.14 0.54 0.00 0.00 0.00 175.76 175.80 2giz s VAL 131 N -2.02 1.08 0.11 0.00 0.11 -1.26 -0.98 120.40 117.44 2giz s VAL 131 Ca -0.05 -0.58 0.08 0.00 -2.93 0.00 0.00 61.98 58.50 2giz s VAL 131 Cb -0.00 -0.90 -0.04 0.00 -1.53 0.00 0.00 36.38 33.91 2giz s VAL 131 CO 0.01 0.31 -0.20 -0.94 -3.33 0.00 0.00 175.10 170.95 2giz s SER 132 N -0.31 2.47 -0.21 3.54 1.04 -0.20 -4.94 113.70 115.09 2giz s SER 132 Ca 0.05 -0.71 -0.13 0.00 0.48 0.00 0.00 55.95 55.64 2giz s SER 132 Cb -0.05 -0.13 -0.04 0.00 0.10 0.00 0.00 66.02 65.89 2giz s SER 132 CO -0.00 0.03 0.28 -0.47 0.98 0.00 0.00 173.24 174.05 2giz s TYR 133 N -1.33 3.36 -0.61 5.02 5.04 -1.26 -1.55 117.35 126.03 2giz s TYR 133 Ca 0.07 0.45 0.06 0.00 -2.44 0.00 0.00 57.07 55.20 2giz s TYR 133 Cb -0.09 -2.38 0.21 0.00 0.35 0.00 0.00 41.96 40.04 2giz s TYR 133 CO 0.04 0.07 0.57 0.00 -1.34 0.00 0.00 175.55 174.89 2giz h PRO 135 N 4.83 0.00 0.00 0.00 0.13 -1.88 -2.48 132.00 132.60 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 0.75 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.88 2giz h PRO 135 CO 0.69 0.00 -0.97 0.43 -0.23 0.00 0.00 178.00 177.92 2giz n SER 136 N -3.72 0.69 -4.83 1.44 7.64 -1.26 -4.99 113.62 108.59 2giz n SER 136 Ca 0.01 -0.48 -0.28 0.00 1.01 0.00 0.00 58.87 59.13 2giz n SER 136 Cb 0.31 0.83 0.09 0.00 -1.01 0.00 0.00 64.21 64.43 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 -3.45 4.48 0.54 6.43 0.01 -0.93 -4.96 113.70 115.82 2giz s SER 137 Ca 0.06 0.58 0.24 0.00 1.31 0.00 0.00 55.95 58.13 2giz s SER 137 Cb 0.16 -1.08 1.51 0.00 0.21 0.00 0.00 66.02 66.82 2giz s SER 137 CO 0.81 -1.87 2.17 0.00 0.41 0.00 0.00 173.24 174.76 2giz h ALA 138 N -0.93 1.65 -4.01 1.44 0.00 -1.94 -3.39 119.26 112.08 2giz h ALA 138 Ca -0.45 -0.04 -0.45 0.00 0.00 0.00 0.00 54.91 53.97 2giz h ALA 138 Cb 1.31 -0.01 -0.30 0.00 0.00 0.00 0.00 17.79 18.80 2giz h ALA 138 CO 0.60 0.05 -0.80 -1.58 0.00 0.00 0.00 179.25 177.53 2giz s TRP 139 N -4.70 1.09 -0.24 0.00 0.52 -1.26 -4.95 118.94 109.39 2giz s TRP 139 Ca -0.05 -0.24 0.19 0.00 0.02 0.00 0.00 56.10 56.02 2giz s TRP 139 Cb 0.15 -0.73 0.10 0.00 -1.15 0.00 0.00 33.47 31.84 2giz s TRP 139 CO 0.61 -0.06 1.32 0.77 0.02 0.00 0.00 176.95 179.61 2giz h SER 140 N 6.06 0.00 -3.32 2.95 0.02 -1.50 -3.42 113.55 114.33 2giz h SER 140 Ca -0.33 0.00 -0.58 0.00 -0.84 0.00 0.00 61.79 60.04 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 0.29 -0.84 -0.31 -1.14 0.00 0.00 176.83 175.32 2giz s TYR 141 N -3.09 1.92 -0.21 3.45 1.51 -0.17 0.45 117.35 121.20 2giz s TYR 141 Ca 0.03 -0.83 0.02 0.00 -1.01 0.00 0.00 57.07 55.27 2giz s TYR 141 Cb 0.07 -1.37 0.04 0.00 -0.11 0.00 0.00 41.96 40.60 2giz s TYR 141 CO 0.74 -0.41 -0.13 0.12 -1.11 0.00 0.00 175.55 174.76 2giz s PHE 142 N 0.79 2.76 -0.17 2.71 5.36 -0.60 -0.74 117.98 128.10 2giz s PHE 142 Ca -0.11 -1.82 -0.08 0.00 -0.96 0.00 0.00 56.93 53.96 2giz s PHE 142 Cb -0.16 -1.80 -0.04 0.00 -0.34 0.00 0.00 43.02 40.68 2giz s PHE 142 CO 0.02 -0.80 0.09 0.71 -1.46 0.00 0.00 175.22 173.78 2giz s TYR 143 N 1.28 3.35 -0.06 10.12 1.51 0.63 -1.04 117.35 133.15 2giz s TYR 143 Ca -0.02 0.24 0.00 0.00 -1.01 0.00 0.00 57.07 56.28 2giz s TYR 143 Cb -0.16 -2.06 0.02 0.00 -0.11 0.00 0.00 41.96 39.65 2giz s TYR 143 CO -0.09 0.32 -0.04 0.08 -1.11 0.00 0.00 175.55 174.71 2giz s VAL 144 N 0.05 0.55 -0.07 0.71 1.01 -0.15 -1.37 120.40 121.12 2giz s VAL 144 Ca 0.07 -0.08 0.04 0.00 0.00 0.00 0.00 61.98 62.01 2giz s VAL 144 Cb -0.12 -0.61 0.00 0.00 0.00 0.00 0.00 36.38 35.65 2giz s VAL 144 CO 0.00 0.25 -0.19 0.00 0.00 0.00 0.00 175.10 175.16 2giz s GLN 146 N 0.29 2.41 -0.07 0.00 -0.21 0.77 -1.07 119.66 121.77 2giz s GLN 146 Ca -0.12 -0.76 0.05 0.00 0.02 0.00 0.00 55.36 54.55 2giz s GLN 146 Cb -0.15 -2.34 -0.01 0.00 1.00 0.00 0.00 33.01 31.51 2giz s GLN 146 CO 0.05 0.60 -0.24 0.71 -2.12 0.00 0.00 175.29 174.30 2giz s TYR 147 N -0.79 2.39 -0.06 0.91 1.51 -0.60 -1.68 117.35 119.02 2giz s TYR 147 Ca 0.13 -0.82 0.01 0.00 -1.01 0.00 0.00 57.07 55.37 2giz s TYR 147 Cb -0.11 -1.59 0.02 0.00 -0.11 0.00 0.00 41.96 40.18 2giz s TYR 147 CO 0.02 -0.29 -0.07 0.00 -1.11 0.00 0.00 175.55 174.10 2giz s PRO 149 N 0.96 1.71 0.52 0.00 0.04 -1.26 -1.64 135.00 135.33 2giz s PRO 149 Ca -0.10 0.47 -0.22 0.00 0.04 0.00 0.00 61.00 61.19 2giz s PRO 149 Cb -0.15 -1.89 -0.06 0.00 0.04 0.00 0.00 34.50 32.45 2giz s PRO 149 CO 0.00 -1.85 1.31 0.45 0.04 0.00 0.00 177.00 176.96 2giz s SER 150 N -3.99 5.53 0.00 6.66 0.15 -0.05 -4.26 113.70 117.73 2giz s SER 150 Ca 0.62 2.65 0.00 0.00 0.70 0.00 0.00 55.95 59.92 2giz s SER 150 Cb -0.14 -2.63 0.00 0.00 -1.71 0.00 0.00 66.02 61.54 2giz s SER 150 CO 0.54 -1.38 0.00 0.61 1.20 0.00 0.00 173.24 174.20 2giz n GLY 151 N 0.65 2.27 3.60 9.45 0.00 -1.26 -4.76 105.19 115.13 2giz n GLY 151 Ca 0.09 -2.13 -0.25 0.00 0.00 0.00 0.00 46.02 43.74 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 -2.42 -6.15 -4.76 1.61 5.03 -1.26 -4.91 115.26 102.40 2giz n ASN 152 Ca 0.00 -0.55 -0.41 0.00 0.87 0.00 0.00 54.58 54.48 2giz n ASN 152 Cb 0.00 -4.85 -0.01 0.00 -1.02 0.00 0.00 39.78 33.89 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 -3.30 2.77 0.06 3.10 5.36 -1.26 -4.79 117.98 119.92 2giz s PHE 153 Ca 0.58 1.02 -0.37 0.00 -0.96 0.00 0.00 56.93 57.20 2giz s PHE 153 Cb -0.26 -3.97 -0.17 0.00 -0.34 0.00 0.00 43.02 38.28 2giz s PHE 153 CO 0.72 -3.06 1.38 0.00 -1.46 0.00 0.00 175.22 172.80 2giz n GLN 154 N 1.49 1.17 -0.26 10.12 10.64 -1.26 -1.17 117.38 138.12 2giz n GLN 154 Ca 0.05 0.42 0.00 0.00 -1.83 0.00 0.00 57.00 55.64 2giz n GLN 154 Cb 0.39 -2.07 0.00 0.00 -0.86 0.00 0.00 30.24 27.69 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 2.68 1.70 0.00 2.61 0.00 -1.26 -4.84 105.19 106.08 2giz n GLY 155 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 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 1.56 0.16 1.61 4.76 -0.32 -4.79 118.16 119.14 2giz n LYS 156 Ca 0.00 -1.10 0.16 0.00 -2.87 0.00 0.00 58.31 54.50 2giz n LYS 156 Cb 0.00 -0.95 0.75 0.00 -1.84 0.00 0.00 35.03 32.99 2giz n LYS 156 CO 0.00 0.00 0.00 1.79 -1.37 0.00 0.00 177.40 177.82 2giz h THR 157 N 0.22 0.65 0.00 -0.18 1.35 -1.86 -1.52 112.91 111.58 2giz h THR 157 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 2giz h THR 157 Cb 0.39 0.85 0.00 0.00 -1.73 0.00 0.00 68.15 67.66 2giz h THR 157 CO 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.27 2giz n ALA 158 N -2.46 2.12 -3.42 6.62 0.00 -1.26 -4.02 120.51 118.08 2giz n ALA 158 Ca 0.03 -0.08 -0.26 0.00 0.00 0.00 0.00 53.44 53.13 2giz n ALA 158 Cb 0.35 -1.40 -0.09 0.00 0.00 0.00 0.00 19.45 18.31 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 -1.57 0.83 0.41 0.00 -2.24 -0.57 -0.38 114.28 110.76 2giz n THR 159 Ca 0.06 -4.56 0.09 0.00 -2.27 0.00 0.00 64.05 57.37 2giz n THR 159 Cb 0.30 -2.01 0.37 0.00 -2.10 0.00 0.00 70.33 66.88 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 1.46 0.08 -3.86 -0.78 -0.04 -1.26 -4.83 135.00 125.77 2giz n PRO 160 Ca 0.26 0.36 -0.07 0.00 -0.04 0.00 0.00 63.50 64.00 2giz n PRO 160 Cb 0.45 -1.67 -0.02 0.00 -0.04 0.00 0.00 33.50 32.22 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 -3.15 -0.16 -0.09 0.54 -0.85 -1.26 -0.69 117.35 111.68 2giz s TYR 161 Ca 0.05 -0.31 -0.18 0.00 -0.52 0.00 0.00 57.07 56.11 2giz s TYR 161 Cb 0.09 0.71 -0.04 0.00 0.38 0.00 0.00 41.96 43.09 2giz s TYR 161 CO 0.29 -1.26 0.48 0.21 -1.52 0.00 0.00 175.55 173.76 2giz s LYS 162 N -3.82 4.30 0.28 -3.49 2.20 -1.26 -5.03 119.74 112.92 2giz s LYS 162 Ca 0.11 0.48 -0.29 0.00 -0.36 0.00 0.00 55.97 55.91 2giz s LYS 162 Cb -0.06 -3.41 -0.10 0.00 -1.51 0.00 0.00 37.83 32.76 2giz s LYS 162 CO 0.07 0.23 1.22 -0.51 -0.36 0.00 0.00 175.35 176.00 2giz s LEU 163 N 0.38 4.47 0.00 5.43 1.43 -1.26 -1.50 118.68 127.63 2giz s LEU 163 Ca 0.26 2.44 0.00 0.00 -1.03 0.00 0.00 54.13 55.80 2giz s LEU 163 Cb -0.16 -3.63 0.00 0.00 0.03 0.00 0.00 46.19 42.43 2giz s LEU 163 CO 0.11 -0.37 0.00 0.61 0.23 0.00 0.00 176.35 176.93 2giz n GLY 164 N 1.34 -0.53 3.78 -3.19 0.00 -1.03 -4.63 105.19 100.94 2giz n GLY 164 Ca 0.01 -1.27 -0.35 0.00 0.00 0.00 0.00 46.02 44.41 2giz n GLY 164 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2giz s PRO 165 N -2.00 3.77 0.06 1.61 0.04 -1.26 -3.21 135.00 134.01 2giz s PRO 165 Ca 0.00 1.51 -0.37 0.00 0.04 0.00 0.00 61.00 62.18 2giz s PRO 165 Cb 0.00 -2.22 -0.17 0.00 0.04 0.00 0.00 34.50 32.15 2giz s PRO 165 CO 0.00 -0.48 1.32 -2.30 0.04 0.00 0.00 177.00 175.58 2giz n PRO 166 N -0.78 1.01 -1.53 0.56 -0.02 -1.21 -0.57 135.00 132.47 2giz n PRO 166 Ca 0.09 0.37 -0.18 0.00 -2.02 0.00 0.00 63.50 61.75 2giz n PRO 166 Cb 0.51 -1.99 -0.08 0.00 -0.02 0.00 0.00 33.50 31.92 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 -1.35 0.00 0.00 -0.56 -0.94 103.07 100.22 2giz h GLY 168 Ca -0.37 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.96 2giz h GLY 168 CO 0.54 0.00 -0.02 1.22 0.00 0.00 0.00 176.54 178.28 2giz n ASP 169 N -4.36 2.41 -2.86 0.19 8.00 -0.18 -4.42 116.55 115.32 2giz n ASP 169 Ca -0.02 -1.79 -0.12 0.00 0.71 0.00 0.00 54.79 53.58 2giz n ASP 169 Cb 0.15 0.02 0.03 0.00 -0.02 0.00 0.00 41.12 41.30 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 2.86 0.00 -0.57 0.00 0.13 -1.64 -1.56 132.00 131.22 2giz h PRO 171 Ca -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 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 0.37 0.00 0.00 0.43 -0.23 0.00 0.00 178.00 178.57 2giz n SER 172 N -4.31 4.04 -3.06 1.44 7.64 -1.26 -4.43 113.62 113.69 2giz n SER 172 Ca 0.13 -2.26 -0.16 0.00 1.01 0.00 0.00 58.87 57.59 2giz n SER 172 Cb 0.76 -0.47 -0.00 0.00 -1.01 0.00 0.00 64.21 63.49 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 1.00 1.21 -3.00 -0.43 0.00 -0.59 -5.07 120.51 113.63 2giz n ALA 173 Ca 0.22 -2.83 -0.32 0.00 0.00 0.00 0.00 53.44 50.51 2giz n ALA 173 Cb 0.71 -0.99 -0.17 0.00 0.00 0.00 0.00 19.45 19.00 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 0.11 4.25 -1.10 0.00 3.68 0.18 -4.88 116.67 118.92 2giz s ASP 175 Ca -0.12 -2.46 -0.29 0.00 2.13 0.00 0.00 52.55 51.82 2giz s ASP 175 Cb -0.16 -1.38 0.04 0.00 -1.45 0.00 0.00 42.92 39.97 2giz s ASP 175 CO 0.06 -0.31 0.63 -3.20 0.13 0.00 0.00 175.17 172.48 2giz n ASN 176 N 3.82 -3.96 0.00 -0.34 5.15 -1.26 -2.27 115.26 116.40 2giz n ASN 176 Ca 0.04 -1.20 0.00 0.00 -0.60 0.00 0.00 54.58 52.82 2giz n ASN 176 Cb 0.37 -1.49 0.00 0.00 -0.53 0.00 0.00 39.78 38.13 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 -1.98 0.79 3.32 8.20 0.00 -1.26 -4.94 105.19 109.31 2giz n GLY 177 Ca -0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.57 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 2.12 0.22 0.99 1.43 -0.96 -4.11 118.68 118.36 2giz s LEU 178 Ca 0.00 -0.45 -0.30 0.00 -1.03 0.00 0.00 54.13 52.35 2giz s LEU 178 Cb 0.00 -1.36 -0.08 0.00 0.03 0.00 0.00 46.19 44.77 2giz s LEU 178 CO 0.00 0.32 0.96 0.00 0.23 0.00 0.00 176.35 177.85 2giz n THR 180 N 1.74 2.42 -3.15 0.00 -2.24 0.44 -0.42 114.28 113.08 2giz n THR 180 Ca -0.01 -1.93 -0.27 0.00 -2.27 0.00 0.00 64.05 59.56 2giz n THR 180 Cb 0.47 -0.28 -0.06 0.00 -2.10 0.00 0.00 70.33 68.37 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 -0.48 4.24 -4.83 3.42 2.04 -1.26 -5.03 115.26 113.36 2giz n ASN 181 Ca 0.25 -3.58 -0.31 0.00 -0.44 0.00 0.00 54.58 50.50 2giz n ASN 181 Cb 0.98 -0.62 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 -3.05 3.24 -0.03 -0.53 0.04 -1.26 -1.17 135.00 132.24 2giz s PRO 182 Ca 0.45 0.96 -0.14 0.00 0.04 0.00 0.00 61.00 62.30 2giz s PRO 182 Cb 0.22 -2.03 -0.05 0.00 0.04 0.00 0.00 34.50 32.68 2giz s PRO 182 CO -0.08 -0.86 0.38 0.00 0.04 0.00 0.00 177.00 176.48 2giz h THR 184 N 3.88 0.77 -1.59 0.00 2.02 -1.96 -3.44 112.91 112.60 2giz h THR 184 Ca -0.50 -0.88 -0.50 0.00 0.77 0.00 0.00 66.41 65.30 2giz h THR 184 Cb 1.21 1.54 -0.04 0.00 -1.74 0.00 0.00 68.15 69.12 2giz h THR 184 CO 0.63 0.21 -0.40 0.27 0.37 0.00 0.00 175.52 176.60 2giz s ILE 185 N -4.08 2.79 0.06 3.11 -4.36 -1.26 -5.14 121.20 112.34 2giz s ILE 185 Ca -0.02 -1.38 -0.00 0.00 -0.26 0.00 0.00 60.65 58.99 2giz s ILE 185 Cb 0.13 -3.03 -0.04 0.00 1.25 0.00 0.00 42.46 40.77 2giz s ILE 185 CO 0.64 -0.03 -0.04 -0.72 0.24 0.00 0.00 174.94 175.03 2giz s TYR 186 N -2.45 0.62 0.10 1.37 -0.85 -1.26 -4.73 117.35 110.15 2giz s TYR 186 Ca 0.46 -1.04 -0.24 0.00 -0.52 0.00 0.00 57.07 55.74 2giz s TYR 186 Cb -0.03 -0.42 -0.07 0.00 0.38 0.00 0.00 41.96 41.82 2giz s TYR 186 CO 0.27 -0.33 0.73 -0.80 -1.52 0.00 0.00 175.55 173.91 2giz s ASN 187 N -2.95 7.25 0.24 -0.18 0.01 -1.26 -4.17 114.94 113.88 2giz s ASN 187 Ca 0.09 1.49 0.13 0.00 -0.71 0.00 0.00 52.86 53.86 2giz s ASN 187 Cb 0.07 -2.46 0.10 0.00 0.41 0.00 0.00 41.25 39.38 2giz s ASN 187 CO -0.08 0.14 1.45 0.11 -1.51 0.00 0.00 177.10 177.21 2giz h LYS 188 N 4.93 0.00 -6.38 -0.60 1.57 -1.19 -3.46 116.57 111.44 2giz h LYS 188 Ca -0.46 0.00 -0.61 0.00 -1.87 0.00 0.00 60.65 57.70 2giz h LYS 188 Cb 1.21 0.00 -0.12 0.00 0.08 0.00 0.00 32.23 33.39 2giz h LYS 188 CO 0.68 0.65 -0.69 -0.51 -0.57 0.00 0.00 179.45 179.01 2giz s LEU 189 N -6.72 3.17 0.00 2.94 1.43 -1.22 -5.01 118.68 113.27 2giz s LEU 189 Ca 0.02 -0.47 0.27 0.00 -1.03 0.00 0.00 54.13 52.92 2giz s LEU 189 Cb 0.09 -1.84 0.88 0.00 0.03 0.00 0.00 46.19 45.35 2giz s LEU 189 CO 0.76 0.10 1.66 0.35 0.23 0.00 0.00 176.35 179.45 2giz n THR 190 N -0.03 0.00 1.05 5.49 -2.24 -1.26 -3.95 114.28 113.34 2giz n THR 190 Ca -0.10 -0.03 0.12 0.00 -2.27 0.00 0.00 64.05 61.76 2giz n THR 190 Cb 0.55 0.03 0.25 0.00 -2.10 0.00 0.00 70.33 69.06 2giz n THR 190 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2giz n ASN 191 N -1.23 0.64 -0.27 3.42 5.15 -1.26 -4.67 115.26 117.04 2giz n ASN 191 Ca 0.09 -0.42 0.08 0.00 -0.60 0.00 0.00 54.58 53.73 2giz n ASN 191 Cb 0.32 0.27 0.21 0.00 -0.53 0.00 0.00 39.78 40.06 2giz n ASN 191 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2giz h ASP 193 N 0.19 0.00 0.35 0.00 3.32 -1.93 -0.19 116.42 118.16 2giz h ASP 193 Ca 0.47 0.00 -0.30 0.00 0.02 0.00 0.00 57.03 57.22 2giz h ASP 193 Cb 0.86 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.36 2giz h ASP 193 CO -0.62 0.00 -1.90 -1.54 -1.72 0.00 0.00 179.24 173.46 2giz n SER 194 N -4.14 0.58 0.26 6.45 3.41 -0.19 -3.31 113.62 116.68 2giz n SER 194 Ca 0.01 0.27 0.08 0.00 -0.26 0.00 0.00 58.87 58.97 2giz n SER 194 Cb 0.25 0.34 0.64 0.00 -0.26 0.00 0.00 64.21 65.18 2giz n SER 194 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2giz h LEU 195 N 0.00 0.00 0.00 1.04 3.38 -0.26 -0.45 115.31 119.03 2giz h LEU 195 Ca -0.35 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.62 2giz h LEU 195 Cb 2.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.77 2giz h LEU 195 CO 0.06 0.01 -0.00 -0.07 0.09 0.00 0.00 178.44 178.52 2giz h LEU 196 N 0.00 0.00 -0.14 1.67 3.38 -1.16 0.18 115.31 119.25 2giz h LEU 196 Ca -0.00 -0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.73 2giz h LEU 196 Cb 0.02 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.78 2giz h LEU 196 CO 0.00 0.00 -0.94 0.11 0.09 0.00 0.00 178.44 177.70 2giz h LYS 197 N 0.00 0.55 0.21 1.13 1.57 -1.09 -3.36 116.57 115.59 2giz h LYS 197 Ca 0.00 -0.56 -0.32 0.00 -1.87 0.00 0.00 60.65 57.90 2giz h LYS 197 Cb 0.97 0.15 0.03 0.00 0.08 0.00 0.00 32.23 33.46 2giz h LYS 197 CO 0.00 1.18 -1.46 1.96 -0.57 0.00 0.00 179.45 180.57 2giz h GLN 198 N 0.33 0.45 0.00 3.15 4.20 -1.28 -3.49 115.11 118.46 2giz h GLN 198 Ca -0.09 -0.77 0.00 0.00 0.06 0.00 0.00 58.65 57.85 2giz h GLN 198 Cb 1.57 0.29 0.00 0.00 0.30 0.00 0.00 27.48 29.64 2giz h GLN 198 CO 0.17 1.36 0.00 0.45 -0.67 0.00 0.00 178.83 180.15 2giz n SER 199 N -3.65 0.00 -3.99 1.46 2.88 0.63 -5.11 113.62 105.84 2giz n SER 199 Ca -0.16 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.30 2giz n SER 199 Cb 1.08 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 64.44 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 1.00 0.30 0.00 -3.46 0.15 -1.26 -4.67 113.70 105.76 2giz s SER 200 Ca 0.00 -0.69 0.21 0.00 0.70 0.00 0.00 55.95 56.17 2giz s SER 200 Cb 0.00 0.19 1.27 0.00 -1.71 0.00 0.00 66.02 65.78 2giz s SER 200 CO 0.00 -0.50 1.66 0.00 1.20 0.00 0.00 173.24 175.59 2giz h GLN 202 N 0.00 0.00 -6.43 0.00 4.20 -1.97 -3.39 115.11 107.52 2giz h GLN 202 Ca 0.00 0.00 -0.54 0.00 0.06 0.00 0.00 58.65 58.17 2giz h GLN 202 Cb 0.00 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.77 2giz h GLN 202 CO 0.00 0.00 0.56 0.34 -0.67 0.00 0.00 178.83 179.06 2giz s ASP 203 N -4.80 7.12 0.21 1.46 2.15 -0.54 -4.93 116.67 117.33 2giz s ASP 203 Ca 0.06 1.92 -0.09 0.00 0.43 0.00 0.00 52.55 54.86 2giz s ASP 203 Cb 0.11 -2.57 0.28 0.00 -0.30 0.00 0.00 42.92 40.44 2giz s ASP 203 CO 0.70 -0.46 1.74 0.44 -0.17 0.00 0.00 175.17 177.43 2giz h ASP 204 N 6.95 0.23 -0.37 -0.34 5.19 -1.87 0.13 116.42 126.33 2giz h ASP 204 Ca -0.40 0.08 0.03 0.00 -0.62 0.00 0.00 57.03 56.12 2giz h ASP 204 Cb 1.20 0.06 -0.03 0.00 0.18 0.00 0.00 39.33 40.74 2giz h ASP 204 CO 0.82 0.13 0.18 -0.25 -3.12 0.00 0.00 179.24 177.00 2giz h TRP 205 N 0.41 0.32 -0.38 4.55 2.91 -1.94 0.09 115.95 121.91 2giz h TRP 205 Ca 0.31 0.02 -0.15 0.00 1.13 0.00 0.00 58.89 60.19 2giz h TRP 205 Cb 0.38 -0.09 -0.01 0.00 -0.51 0.00 0.00 29.16 28.93 2giz h TRP 205 CO -0.17 0.17 -0.36 0.82 -1.03 0.00 0.00 178.44 177.87 2giz h ILE 206 N 0.36 1.27 -0.30 2.65 2.04 -1.70 -0.78 117.51 121.05 2giz h ILE 206 Ca 0.16 -1.53 0.04 0.00 1.00 0.00 0.00 64.86 64.53 2giz h ILE 206 Cb 0.08 1.36 -0.04 0.00 -0.74 0.00 0.00 36.82 37.47 2giz h ILE 206 CO -0.12 0.51 0.06 0.50 0.00 0.00 0.00 178.15 179.10 2giz h LYS 207 N 0.74 0.16 -0.08 2.37 3.64 -0.48 0.34 116.57 123.26 2giz h LYS 207 Ca 0.07 -0.01 -0.16 0.00 -1.27 0.00 0.00 60.65 59.27 2giz h LYS 207 Cb 0.94 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.71 2giz h LYS 207 CO 0.09 0.11 -0.65 1.03 -2.27 0.00 0.00 179.45 177.75 2giz h SER 208 N 0.17 0.38 0.43 4.20 0.87 -0.84 -3.17 113.55 115.59 2giz h SER 208 Ca 0.14 -0.23 0.00 0.00 -1.23 0.00 0.00 61.79 60.47 2giz h SER 208 Cb 0.15 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.00 2giz h SER 208 CO -0.19 0.93 -1.17 0.59 -0.53 0.00 0.00 176.83 176.46 2giz n ASN 209 N -3.86 0.57 -2.53 6.23 3.02 -0.31 -4.45 115.26 113.94 2giz n ASN 209 Ca -0.03 -0.13 -0.15 0.00 -0.03 0.00 0.00 54.58 54.24 2giz n ASN 209 Cb 0.66 0.93 0.02 0.00 -0.61 0.00 0.00 39.78 40.78 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 2.66 0.33 0.00 0.00 0.13 -1.72 -1.45 132.00 131.95 2giz h PRO 211 Ca 0.10 -0.02 -0.00 0.00 -0.87 0.00 0.00 66.00 65.21 2giz h PRO 211 Cb 1.18 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.23 2giz h PRO 211 CO 0.59 0.22 -0.00 0.00 -0.23 0.00 0.00 178.00 178.58 2giz h ALA 212 N 1.81 -0.01 -0.48 -0.56 0.00 -1.85 0.19 119.26 118.36 2giz h ALA 212 Ca 0.13 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 2giz h ALA 212 Cb 0.11 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 2giz h ALA 212 CO -0.03 -0.32 0.07 0.77 0.00 0.00 0.00 179.25 179.74 2giz h SER 213 N -0.37 0.71 0.70 0.00 0.02 -1.84 -1.05 113.55 111.72 2giz h SER 213 Ca -0.00 -0.14 -0.24 0.00 -0.84 0.00 0.00 61.79 60.57 2giz h SER 213 Cb 0.36 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.71 2giz h SER 213 CO 0.00 0.73 -1.09 0.00 -1.14 0.00 0.00 176.83 175.34 2giz n PHE 215 N -3.53 0.00 -1.68 0.00 3.72 0.64 -5.03 117.46 111.58 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 0.95 -0.03 -0.03 0.00 -0.94 0.00 0.00 39.48 39.42 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 0.05 2.84 -1.39 0.00 3.52 -1.26 -4.69 118.95 118.02 2giz s ARG 217 Ca 0.71 -0.96 -0.10 0.00 -0.13 0.00 0.00 55.73 55.25 2giz s ARG 217 Cb -0.64 -2.90 0.03 0.00 -1.56 0.00 0.00 34.95 29.88 2giz s ARG 217 CO 0.45 -0.37 1.13 0.09 -0.81 0.00 0.00 175.30 175.80 2giz n ASN 218 N 4.65 -5.82 -4.41 -2.12 3.02 -1.26 -5.00 115.26 104.32 2giz n ASN 218 Ca -0.17 -0.60 -0.22 0.00 -0.03 0.00 0.00 54.58 53.56 2giz n ASN 218 Cb 0.47 -4.77 -0.10 0.00 -0.61 0.00 0.00 39.78 34.77 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 -6.35 1.50 -0.33 3.52 -0.14 -1.26 -4.91 119.74 111.77 2giz s LYS 219 Ca 0.58 -1.66 -0.21 0.00 -1.36 0.00 0.00 55.97 53.31 2giz s LYS 219 Cb -0.26 -1.48 0.00 0.00 -1.68 0.00 0.00 37.83 34.41 2giz s LYS 219 CO 0.75 0.27 0.69 0.42 -0.76 0.00 0.00 175.35 176.73 2giz s ILE 220 N -2.64 4.85 0.00 2.17 -1.09 -0.31 -4.97 121.20 119.21 2giz s ILE 220 Ca 0.26 0.83 0.00 0.00 -2.23 0.00 0.00 60.65 59.51 2giz s ILE 220 Cb -0.03 -4.10 0.00 0.00 -1.58 0.00 0.00 42.46 36.75 2giz s ILE 220 CO 0.11 -0.28 0.00 0.00 -1.23 0.00 0.00 174.94 173.54