#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ku7 s MET 2 N 0.00 3.33 0.00 1.43 -1.94 -1.26 -4.67 119.30 116.20 2ku7 s MET 2 Ca 0.00 -0.35 0.00 0.00 -1.71 0.00 0.00 55.69 53.63 2ku7 s MET 2 Cb 0.00 -2.97 0.00 0.00 2.01 0.00 0.00 34.83 33.87 2ku7 s MET 2 CO 0.00 0.60 0.00 -1.33 -0.01 0.00 0.00 175.02 174.28 2ku7 n MET 3 N 2.49 0.00 -4.31 2.03 0.00 -1.26 -4.86 117.12 111.22 2ku7 n MET 3 Ca -0.18 0.00 -0.32 0.00 0.00 0.00 0.00 57.70 57.19 2ku7 n MET 3 Cb 0.54 -0.08 -0.09 0.00 0.00 0.00 0.00 33.22 33.59 2ku7 n MET 3 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 175.97 175.32 2ku7 s GLN 4 N 0.00 2.73 0.06 0.03 -1.52 -1.26 -5.13 119.66 114.56 2ku7 s GLN 4 Ca 0.00 -0.64 0.04 0.00 -1.95 0.00 0.00 55.36 52.80 2ku7 s GLN 4 Cb 0.00 -2.63 -0.03 0.00 -0.22 0.00 0.00 33.01 30.14 2ku7 s GLN 4 CO 0.00 0.62 -0.11 0.00 -0.25 0.00 0.00 175.29 175.55 2ku7 n GLY 6 N 1.39 2.34 3.21 0.00 0.00 -1.26 -5.08 105.19 105.79 2ku7 n GLY 6 Ca -0.22 -2.01 -0.26 0.00 0.00 0.00 0.00 46.02 43.54 2ku7 n GLY 6 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2ku7 s LYS 7 N -2.48 1.48 -0.09 1.61 2.20 -1.26 -5.13 119.74 116.07 2ku7 s LYS 7 Ca 0.00 -0.76 0.02 0.00 -0.36 0.00 0.00 55.97 54.86 2ku7 s LYS 7 Cb 0.00 -1.48 0.02 0.00 -1.51 0.00 0.00 37.83 34.86 2ku7 s LYS 7 CO 0.00 0.40 -0.13 0.00 -0.36 0.00 0.00 175.35 175.26 2ku7 s ASP 9 N 0.94 5.37 -0.12 0.00 1.01 -1.26 -5.12 116.67 117.48 2ku7 s ASP 9 Ca -0.09 -0.20 -0.00 0.00 0.71 0.00 0.00 52.55 52.97 2ku7 s ASP 9 Cb -0.15 -1.35 -0.02 0.00 1.01 0.00 0.00 42.92 42.41 2ku7 s ASP 9 CO 0.00 0.06 -0.11 -0.13 0.21 0.00 0.00 175.17 175.20 2ku7 s ARG 10 N -3.14 3.34 0.09 8.23 0.52 -1.26 -5.12 118.95 121.61 2ku7 s ARG 10 Ca 0.30 -0.65 0.05 0.00 -0.52 0.00 0.00 55.73 54.91 2ku7 s ARG 10 Cb -0.10 -2.66 -0.03 0.00 0.52 0.00 0.00 34.95 32.68 2ku7 s ARG 10 CO 0.23 0.27 -0.12 -1.58 0.02 0.00 0.00 175.30 174.11 2ku7 s TRP 11 N 0.21 1.18 -0.12 -0.53 0.52 -1.26 -5.15 118.94 113.79 2ku7 s TRP 11 Ca -0.07 -0.55 -0.01 0.00 0.02 0.00 0.00 56.10 55.49 2ku7 s TRP 11 Cb -0.15 -0.64 -0.03 0.00 -1.15 0.00 0.00 33.47 31.50 2ku7 s TRP 11 CO 0.05 0.05 -0.07 0.08 0.02 0.00 0.00 176.95 177.08 2ku7 s VAL 12 N -1.88 3.67 0.27 4.03 1.01 -1.26 -5.02 120.40 121.22 2ku7 s VAL 12 Ca 0.03 -0.46 -0.01 0.00 0.00 0.00 0.00 61.98 61.54 2ku7 s VAL 12 Cb -0.06 -2.56 0.12 0.00 0.00 0.00 0.00 36.38 33.88 2ku7 s VAL 12 CO 0.02 0.54 1.77 0.45 0.00 0.00 0.00 175.10 177.88 2ku7 h HIS 13 N 6.18 0.81 -0.54 5.22 3.86 -2.01 -3.01 115.15 125.66 2ku7 h HIS 13 Ca -0.36 -0.11 -0.03 0.00 -1.16 0.00 0.00 60.37 58.71 2ku7 h HIS 13 Cb 1.19 -0.22 -0.03 0.00 1.06 0.00 0.00 27.41 29.41 2ku7 h HIS 13 CO 0.54 0.75 0.23 0.77 0.86 0.00 0.00 177.93 181.07 2ku7 h SER 14 N 0.72 0.71 -0.55 2.45 0.02 -1.98 -2.81 113.55 112.11 2ku7 h SER 14 Ca 0.14 -0.08 -0.02 0.00 -0.84 0.00 0.00 61.79 60.99 2ku7 h SER 14 Cb 0.43 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.76 2ku7 h SER 14 CO 0.02 0.63 0.29 0.50 -1.14 0.00 0.00 176.83 177.14 2ku7 h LYS 15 N 0.77 0.80 -0.14 3.45 3.64 -1.96 -3.02 116.57 120.11 2ku7 h LYS 15 Ca 0.19 -0.09 -0.07 0.00 -1.27 0.00 0.00 60.65 59.40 2ku7 h LYS 15 Cb 0.14 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 31.80 2ku7 h LYS 15 CO -0.02 0.60 -0.20 0.00 -2.27 0.00 0.00 179.45 177.56 2ku7 n GLU 17 N -4.50 0.00 -3.65 0.00 1.02 -1.15 -4.83 120.64 107.54 2ku7 n GLU 17 Ca -0.06 0.00 -0.26 0.00 -0.02 0.00 0.00 57.16 56.81 2ku7 n GLU 17 Cb 0.41 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.80 2ku7 n GLU 17 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 2ku7 s ASN 18 N 0.00 6.37 0.26 1.62 0.01 -1.26 -5.08 114.94 116.86 2ku7 s ASN 18 Ca 0.00 0.40 -0.09 0.00 -0.71 0.00 0.00 52.86 52.46 2ku7 s ASN 18 Cb 0.00 -2.01 -0.07 0.00 0.41 0.00 0.00 41.25 39.58 2ku7 s ASN 18 CO 0.00 -0.09 0.58 -0.22 -1.51 0.00 0.00 177.10 175.86 2ku7 s LEU 19 N -3.52 4.11 0.57 0.60 2.96 -1.26 -5.07 118.68 117.06 2ku7 s LEU 19 Ca 0.39 0.93 -0.19 0.00 -0.22 0.00 0.00 54.13 55.03 2ku7 s LEU 19 Cb -0.11 -3.71 -0.05 0.00 0.50 0.00 0.00 46.19 42.83 2ku7 s LEU 19 CO 0.30 -0.13 1.15 -0.55 -1.32 0.00 0.00 176.35 175.79 2ku7 s SER 20 N -2.57 5.52 0.37 3.68 0.15 -1.26 -4.90 113.70 114.68 2ku7 s SER 20 Ca 0.48 2.21 0.05 0.00 0.70 0.00 0.00 55.95 59.38 2ku7 s SER 20 Cb -0.11 -2.58 0.71 0.00 -1.71 0.00 0.00 66.02 62.33 2ku7 s SER 20 CO 0.23 -1.36 1.98 0.44 1.20 0.00 0.00 173.24 175.73 2ku7 h ASP 21 N 0.99 0.54 -0.21 5.45 3.32 -1.99 -2.10 116.42 122.43 2ku7 h ASP 21 Ca -0.50 -0.05 -0.03 0.00 0.02 0.00 0.00 57.03 56.48 2ku7 h ASP 21 Cb 1.27 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 40.67 2ku7 h ASP 21 CO 0.56 0.47 0.01 -0.08 -1.72 0.00 0.00 179.24 178.49 2ku7 h GLU 22 N 0.61 0.36 -0.36 3.56 4.81 -2.00 -1.92 114.58 119.63 2ku7 h GLU 22 Ca 0.15 -0.11 -0.14 0.00 -0.13 0.00 0.00 59.36 59.14 2ku7 h GLU 22 Cb 0.08 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.41 2ku7 h GLU 22 CO -0.02 0.53 -0.33 0.52 -0.73 0.00 0.00 179.01 178.98 2ku7 h MET 23 N 0.13 0.82 -0.37 1.92 2.86 -1.92 -2.71 114.93 115.66 2ku7 h MET 23 Ca 0.06 -0.39 -0.07 0.00 -2.06 0.00 0.00 59.70 57.23 2ku7 h MET 23 Cb 0.36 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.01 2ku7 h MET 23 CO 0.01 1.03 -0.06 -0.92 1.06 0.00 0.00 176.91 178.02 2ku7 h TYR 24 N 0.68 0.77 -0.35 -0.22 3.20 -1.38 -2.41 116.97 117.26 2ku7 h TYR 24 Ca 0.07 -0.16 -0.16 0.00 3.14 0.00 0.00 58.73 61.62 2ku7 h TYR 24 Cb 0.89 -0.19 -0.00 0.00 1.54 0.00 0.00 36.73 38.96 2ku7 h TYR 24 CO 0.05 0.83 -0.43 0.93 -1.64 0.00 0.00 178.16 177.89 2ku7 h GLU 25 N 0.49 0.89 -0.09 1.82 5.08 -1.38 -1.55 114.58 119.84 2ku7 h GLU 25 Ca 0.10 -0.49 -0.04 0.00 -1.00 0.00 0.00 59.36 57.92 2ku7 h GLU 25 Cb 0.56 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.84 2ku7 h GLU 25 CO 0.03 1.14 -0.10 0.82 -1.00 0.00 0.00 179.01 179.90 2ku7 h ILE 26 N 0.72 1.37 -0.34 3.13 2.04 -1.53 -1.03 117.51 121.86 2ku7 h ILE 26 Ca 0.05 -1.26 -0.14 0.00 1.00 0.00 0.00 64.86 64.50 2ku7 h ILE 26 Cb 1.02 1.99 -0.01 0.00 -0.74 0.00 0.00 36.82 39.09 2ku7 h ILE 26 CO 0.10 0.36 -0.33 -0.07 0.00 0.00 0.00 178.15 178.21 2ku7 h LEU 27 N -0.19 0.88 -0.43 1.44 3.38 -1.51 -3.23 115.31 115.65 2ku7 h LEU 27 Ca 0.01 -0.47 -0.18 0.00 0.09 0.00 0.00 57.88 57.34 2ku7 h LEU 27 Cb 0.62 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.12 2ku7 h LEU 27 CO 0.02 1.17 -0.69 0.28 0.09 0.00 0.00 178.44 179.31 2ku7 h SER 28 N 0.61 0.51 -3.85 -0.43 0.02 -1.37 -3.38 113.55 105.66 2ku7 h SER 28 Ca 0.06 -0.32 -0.69 0.00 -0.84 0.00 0.00 61.79 59.99 2ku7 h SER 28 Cb 0.91 -0.15 -0.36 0.00 0.14 0.00 0.00 62.40 62.95 2ku7 h SER 28 CO 0.08 1.05 -0.29 0.20 -1.14 0.00 0.00 176.83 176.73 2ku7 s ASN 29 N -6.96 5.45 -0.29 3.07 0.01 -0.39 -5.06 114.94 110.76 2ku7 s ASN 29 Ca -0.06 -3.21 -0.09 0.00 -0.71 0.00 0.00 52.86 48.79 2ku7 s ASN 29 Cb 0.11 -1.86 -0.02 0.00 0.41 0.00 0.00 41.25 39.89 2ku7 s ASN 29 CO 0.84 -0.29 0.14 -0.76 -1.51 0.00 0.00 177.10 175.52 2ku7 s LEU 30 N -0.58 3.94 0.10 0.60 1.43 -1.24 -4.58 118.68 118.35 2ku7 s LEU 30 Ca 0.21 -0.39 -0.31 0.00 -1.03 0.00 0.00 54.13 52.61 2ku7 s LEU 30 Cb -0.15 -2.00 -0.08 0.00 0.03 0.00 0.00 46.19 44.00 2ku7 s LEU 30 CO -0.07 -0.14 1.42 -2.84 0.23 0.00 0.00 176.35 174.94 2ku7 s PRO 31 N 1.63 4.30 0.43 1.29 0.02 -1.26 -4.90 135.00 136.52 2ku7 s PRO 31 Ca 0.05 2.09 0.27 0.00 0.02 0.00 0.00 61.00 63.43 2ku7 s PRO 31 Cb -0.16 -3.31 1.33 0.00 0.02 0.00 0.00 34.50 32.38 2ku7 s PRO 31 CO 0.06 -0.48 1.68 1.49 -0.33 0.00 0.00 177.00 179.42 2ku7 h GLU 32 N 7.03 0.17 0.12 5.54 4.57 -1.98 0.45 114.58 130.49 2ku7 h GLU 32 Ca -0.42 -0.01 -0.35 0.00 -1.18 0.00 0.00 59.36 57.40 2ku7 h GLU 32 Cb 1.20 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.74 2ku7 h GLU 32 CO 0.88 0.11 -1.92 0.77 -1.18 0.00 0.00 179.01 177.67 2ku7 h SER 33 N 0.18 0.41 0.15 1.04 0.02 -1.91 -3.38 113.55 110.06 2ku7 h SER 33 Ca 0.74 -0.93 -0.09 0.00 -0.84 0.00 0.00 61.79 60.67 2ku7 h SER 33 Cb 2.24 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 64.63 2ku7 h SER 33 CO -0.36 1.83 -0.32 0.58 -1.14 0.00 0.00 176.83 177.42 2ku7 h VAL 34 N 0.00 1.27 0.00 2.27 2.07 -1.53 -2.63 116.25 117.70 2ku7 h VAL 34 Ca -0.41 -1.30 -0.04 0.00 0.82 0.00 0.00 66.70 65.76 2ku7 h VAL 34 Cb 1.99 1.52 -0.01 0.00 -1.52 0.00 0.00 31.29 33.28 2ku7 h VAL 34 CO 0.08 0.39 -0.21 0.00 0.02 0.00 0.00 177.57 177.85 2ku7 h ALA 35 N 1.44 1.64 -2.06 1.67 0.00 -1.17 -3.43 119.26 117.35 2ku7 h ALA 35 Ca 0.03 -0.19 0.02 0.00 0.00 0.00 0.00 54.91 54.77 2ku7 h ALA 35 Cb 0.68 -0.03 -0.21 0.00 0.00 0.00 0.00 17.79 18.23 2ku7 h ALA 35 CO 0.05 0.27 -0.05 1.52 0.00 0.00 0.00 179.25 181.04 2ku7 s TYR 36 N -4.56 -1.10 0.13 0.00 -0.85 -0.99 -5.12 117.35 104.87 2ku7 s TYR 36 Ca -0.04 2.11 0.08 0.00 -0.52 0.00 0.00 57.07 58.70 2ku7 s TYR 36 Cb 0.15 0.65 -0.04 0.00 0.38 0.00 0.00 41.96 43.10 2ku7 s TYR 36 CO 0.70 -0.55 -0.18 0.95 -1.52 0.00 0.00 175.55 174.95 2ku7 s THR 37 N 1.96 1.64 -0.24 -3.49 -4.23 -1.24 -4.60 115.64 105.45 2ku7 s THR 37 Ca -0.09 -1.75 -0.05 0.00 -1.18 0.00 0.00 61.69 58.62 2ku7 s THR 37 Cb -0.07 -1.66 -0.18 0.00 1.34 0.00 0.00 72.50 71.93 2ku7 s THR 37 CO -0.19 -0.27 -0.12 0.00 -0.54 0.00 0.00 174.62 173.50 2ku7 s VAL 39 N -2.51 1.80 -0.22 0.00 1.01 -1.26 -5.13 120.40 114.09 2ku7 s VAL 39 Ca -0.33 -0.94 -0.10 0.00 0.00 0.00 0.00 61.98 60.61 2ku7 s VAL 39 Cb 0.10 -1.52 -0.05 0.00 0.00 0.00 0.00 36.38 34.91 2ku7 s VAL 39 CO 0.60 0.51 0.13 0.21 0.00 0.00 0.00 175.10 176.56 2ku7 s ASN 40 N -0.25 6.02 -0.23 3.32 2.47 -1.26 -5.08 114.94 119.93 2ku7 s ASN 40 Ca 0.01 0.12 -0.11 0.00 0.42 0.00 0.00 52.86 53.29 2ku7 s ASN 40 Cb -0.11 -2.07 -0.05 0.00 -1.45 0.00 0.00 41.25 37.57 2ku7 s ASN 40 CO 0.02 0.10 0.20 0.00 -3.72 0.00 0.00 177.10 173.70 2ku7 n THR 42 N 4.16 0.00 -0.00 0.00 -2.24 -1.26 -4.08 114.28 110.86 2ku7 n THR 42 Ca -0.14 -0.01 -0.06 0.00 -2.27 0.00 0.00 64.05 61.58 2ku7 n THR 42 Cb 0.52 0.22 0.14 0.00 -2.10 0.00 0.00 70.33 69.10 2ku7 n THR 42 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 2ku7 h GLU 43 N 0.07 0.53 -0.28 -0.78 4.81 -2.05 -3.15 114.58 113.73 2ku7 h GLU 43 Ca 0.00 -0.24 -0.07 0.00 -0.13 0.00 0.00 59.36 58.92 2ku7 h GLU 43 Cb 0.50 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.85 2ku7 h GLU 43 CO 0.00 0.81 -0.13 0.00 -0.73 0.00 0.00 179.01 178.96 2ku7 h ARG 44 N 0.45 0.47 -5.83 1.92 3.08 -2.02 -3.43 114.38 109.03 2ku7 h ARG 44 Ca 0.05 -0.13 -0.67 0.00 0.07 0.00 0.00 59.98 59.30 2ku7 h ARG 44 Cb 0.82 -0.05 -0.19 0.00 0.08 0.00 0.00 29.97 30.63 2ku7 h ARG 44 CO 0.07 0.60 -0.67 -1.01 -1.07 0.00 0.00 179.97 177.89 2ku7 s HIS 45 N -4.73 3.02 0.01 3.04 3.76 -1.19 -5.12 115.29 114.08 2ku7 s HIS 45 Ca -0.07 -0.05 0.03 0.00 -0.15 0.00 0.00 55.06 54.83 2ku7 s HIS 45 Cb 0.15 -1.81 -0.01 0.00 1.11 0.00 0.00 32.58 32.02 2ku7 s HIS 45 CO 0.77 0.24 -0.11 0.54 -0.85 0.00 0.00 174.74 175.34 2ku7 s VAL 46 N -0.44 0.86 0.04 -0.90 0.11 -1.26 -4.89 120.40 113.91 2ku7 s VAL 46 Ca 0.07 -0.61 -0.20 0.00 -2.93 0.00 0.00 61.98 58.31 2ku7 s VAL 46 Cb -0.12 -0.75 -0.06 0.00 -1.53 0.00 0.00 36.38 33.92 2ku7 s VAL 46 CO 0.02 0.13 0.58 -1.81 -3.33 0.00 0.00 175.10 170.69 2ku7 s ASP 47 N -0.54 7.02 0.00 3.54 1.01 -1.26 -5.03 116.67 121.41 2ku7 s ASP 47 Ca 0.02 1.21 0.00 0.00 0.71 0.00 0.00 52.55 54.50 2ku7 s ASP 47 Cb -0.05 -2.36 0.00 0.00 1.01 0.00 0.00 42.92 41.52 2ku7 s ASP 47 CO 0.00 0.20 0.00 0.61 0.21 0.00 0.00 175.17 176.19 2ku7 n GLY 48 N 2.05 -1.46 3.61 0.21 0.00 -1.26 -5.19 105.19 103.14 2ku7 n GLY 48 Ca -0.09 -1.04 -0.04 0.00 0.00 0.00 0.00 46.02 44.86 2ku7 n GLY 48 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ku7 s GLY 49 N 0.00 -0.24 0.25 -0.02 0.00 -1.26 -4.79 107.32 101.25 2ku7 s GLY 49 Ca 0.00 1.78 -0.03 0.00 0.00 0.00 0.00 44.72 46.48 2ku7 s GLY 49 CO 0.00 0.62 1.72 1.76 0.00 0.00 0.00 173.10 177.20 2ku7 h SER 50 N 2.02 0.77 0.00 1.64 0.02 -2.00 -3.44 113.55 112.55 2ku7 h SER 50 Ca -0.07 -0.21 0.00 0.00 -0.84 0.00 0.00 61.79 60.67 2ku7 h SER 50 Cb 1.16 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 63.49 2ku7 h SER 50 CO 0.22 0.87 0.00 0.61 -1.14 0.00 0.00 176.83 177.39 2ku7 n GLY 51 N -0.52 -0.48 2.46 -3.77 0.00 -1.26 -5.15 105.19 96.47 2ku7 n GLY 51 Ca 0.02 0.05 -0.16 0.00 0.00 0.00 0.00 46.02 45.93 2ku7 n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ku7 n GLY 52 N 1.11 -0.08 0.28 -0.02 0.00 -1.26 -5.00 105.19 100.22 2ku7 n GLY 52 Ca 0.00 -1.89 -0.00 0.00 0.00 0.00 0.00 46.02 44.13 2ku7 n GLY 52 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2ku7 h SER 53 N -0.65 0.53 0.00 1.61 0.02 -1.96 -3.40 113.55 109.70 2ku7 h SER 53 Ca -0.23 -0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.62 2ku7 h SER 53 Cb 0.77 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.17 2ku7 h SER 53 CO 0.21 0.58 0.00 0.61 -1.14 0.00 0.00 176.83 177.09 2ku7 n GLY 54 N -0.91 0.41 0.10 -3.77 0.00 -1.26 -4.72 105.19 95.04 2ku7 n GLY 54 Ca 0.02 -0.08 -0.19 0.00 0.00 0.00 0.00 46.02 45.76 2ku7 n GLY 54 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2ku7 h GLY 55 N 0.00 0.08 1.49 -0.02 0.00 -2.00 -3.37 103.07 99.25 2ku7 h GLY 55 Ca 0.00 -0.20 -0.07 0.00 0.00 0.00 0.00 47.33 47.06 2ku7 h GLY 55 CO 0.00 0.18 -0.06 1.76 0.00 0.00 0.00 176.54 178.42 2ku7 h SER 56 N -0.80 0.59 -3.91 0.19 0.02 -2.00 -3.49 113.55 104.15 2ku7 h SER 56 Ca -0.24 -0.14 0.00 0.00 -0.84 0.00 0.00 61.79 60.57 2ku7 h SER 56 Cb 1.35 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.73 2ku7 h SER 56 CO -0.07 0.70 0.00 0.61 -1.14 0.00 0.00 176.83 176.93 2ku7 n GLY 57 N -0.67 -1.86 0.00 -3.77 0.00 -1.26 -4.96 105.19 92.67 2ku7 n GLY 57 Ca 0.01 -1.75 0.00 0.00 0.00 0.00 0.00 46.02 44.28 2ku7 n GLY 57 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ku7 n GLY 58 N 0.00 2.81 0.18 -0.02 0.00 -1.26 -4.99 105.19 101.92 2ku7 n GLY 58 Ca 0.00 -0.10 0.03 0.00 0.00 0.00 0.00 46.02 45.95 2ku7 n GLY 58 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2ku7 h SER 59 N 0.00 0.00 0.73 1.61 0.02 -2.04 -3.01 113.55 110.85 2ku7 h SER 59 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2ku7 h SER 59 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2ku7 h SER 59 CO 0.00 0.40 0.00 0.00 -1.14 0.00 0.00 176.83 176.09 2ku7 n ALA 60 N -2.42 1.75 0.27 3.77 0.00 -1.26 -3.07 120.51 119.54 2ku7 n ALA 60 Ca -0.02 0.02 0.16 0.00 0.00 0.00 0.00 53.44 53.61 2ku7 n ALA 60 Cb 0.45 -1.35 0.65 0.00 0.00 0.00 0.00 19.45 19.20 2ku7 n ALA 60 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 2ku7 h THR 61 N 0.00 0.12 0.00 0.00 1.35 -1.90 -2.90 112.91 109.58 2ku7 h THR 61 Ca 0.00 -0.62 -0.08 0.00 -0.55 0.00 0.00 66.41 65.16 2ku7 h THR 61 Cb 0.36 1.55 -0.01 0.00 -1.73 0.00 0.00 68.15 68.32 2ku7 h THR 61 CO 0.00 0.05 -0.36 0.71 -0.25 0.00 0.00 175.52 175.66 2ku7 h THR 62 N 0.00 0.77 -3.44 6.82 1.35 -1.76 -3.44 112.91 113.21 2ku7 h THR 62 Ca -0.00 -1.59 -0.61 0.00 -0.55 0.00 0.00 66.41 63.67 2ku7 h THR 62 Cb 0.54 2.02 -0.13 0.00 -1.73 0.00 0.00 68.15 68.86 2ku7 h THR 62 CO 0.01 0.35 -0.41 -0.54 -0.25 0.00 0.00 175.52 174.68 2ku7 s LYS 63 N -3.44 4.15 0.00 4.72 1.02 -1.10 -4.96 119.74 120.14 2ku7 s LYS 63 Ca 0.01 -0.10 0.07 0.00 0.02 0.00 0.00 55.97 55.97 2ku7 s LYS 63 Cb 0.10 -3.49 0.18 0.00 -0.52 0.00 0.00 37.83 34.09 2ku7 s LYS 63 CO 0.69 0.13 1.11 0.54 -0.92 0.00 0.00 175.35 176.90 2ku7 n ARG 64 N 4.02 2.61 -3.93 1.68 1.74 -1.26 -4.89 116.66 116.63 2ku7 n ARG 64 Ca -0.13 -1.74 -0.35 0.00 -0.77 0.00 0.00 57.85 54.85 2ku7 n ARG 64 Cb 0.52 -1.16 -0.08 0.00 -1.02 0.00 0.00 32.46 30.71 2ku7 n ARG 64 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2ku7 s VAL 65 N -0.96 5.14 0.18 1.55 1.01 -1.26 -1.47 120.40 124.59 2ku7 s VAL 65 Ca 0.14 0.08 0.09 0.00 0.00 0.00 0.00 61.98 62.29 2ku7 s VAL 65 Cb 0.07 -3.28 -0.04 0.00 0.00 0.00 0.00 36.38 33.13 2ku7 s VAL 65 CO 0.10 0.52 -0.19 -0.76 0.00 0.00 0.00 175.10 174.77 2ku7 s LEU 66 N -0.22 2.45 -0.18 3.92 1.43 0.65 -0.17 118.68 126.55 2ku7 s LEU 66 Ca 0.09 -0.88 -0.08 0.00 -1.03 0.00 0.00 54.13 52.23 2ku7 s LEU 66 Cb -0.12 -0.90 -0.04 0.00 0.03 0.00 0.00 46.19 45.16 2ku7 s LEU 66 CO 0.01 -0.01 0.09 -0.47 0.23 0.00 0.00 176.35 176.20 2ku7 s TYR 67 N -2.04 3.32 -0.11 0.29 5.04 0.26 -0.05 117.35 124.06 2ku7 s TYR 67 Ca 0.18 0.19 0.01 0.00 -2.44 0.00 0.00 57.07 55.01 2ku7 s TYR 67 Cb -0.06 -2.09 0.02 0.00 0.35 0.00 0.00 41.96 40.18 2ku7 s TYR 67 CO 0.08 0.25 -0.14 0.14 -1.34 0.00 0.00 175.55 174.54 2ku7 s VAL 68 N 0.24 1.39 0.06 3.14 -7.23 0.79 -0.82 120.40 117.98 2ku7 s VAL 68 Ca 0.06 -0.57 0.02 0.00 -1.81 0.00 0.00 61.98 59.67 2ku7 s VAL 68 Cb -0.12 -1.29 -0.03 0.00 0.56 0.00 0.00 36.38 35.50 2ku7 s VAL 68 CO -0.00 0.42 -0.07 -0.83 -0.31 0.00 0.00 175.10 174.31 2ku7 s GLY 69 N 1.11 0.58 0.00 2.32 0.00 0.28 -0.37 107.32 111.24 2ku7 s GLY 69 Ca -0.05 -1.01 0.00 0.00 0.00 0.00 0.00 44.72 43.67 2ku7 s GLY 69 CO -0.03 -1.09 0.00 0.61 0.00 0.00 0.00 173.10 172.59 2ku7 n GLY 70 N 0.80 1.26 3.92 0.20 0.00 0.01 -0.09 105.19 111.29 2ku7 n GLY 70 Ca -0.18 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.58 2ku7 n GLY 70 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ku7 s LEU 71 N 0.00 3.72 0.36 0.99 1.02 -1.04 -4.47 118.68 119.26 2ku7 s LEU 71 Ca 0.00 0.75 -0.07 0.00 0.02 0.00 0.00 54.13 54.83 2ku7 s LEU 71 Cb 0.00 -3.67 -0.05 0.00 0.02 0.00 0.00 46.19 42.49 2ku7 s LEU 71 CO 0.00 -0.52 0.68 0.00 0.02 0.00 0.00 176.35 176.52 2ku7 s ALA 72 N -2.62 3.48 0.52 4.21 0.00 -1.26 -4.49 121.76 121.59 2ku7 s ALA 72 Ca 0.46 -0.41 0.26 0.00 0.00 0.00 0.00 51.96 52.26 2ku7 s ALA 72 Cb -0.10 -2.50 1.57 0.00 0.00 0.00 0.00 23.12 22.09 2ku7 s ALA 72 CO 0.42 0.05 2.17 0.93 0.00 0.00 0.00 175.76 179.33 2ku7 h GLU 73 N 1.29 0.00 0.00 0.00 5.08 -1.97 -1.02 114.58 117.95 2ku7 h GLU 73 Ca -0.47 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 2ku7 h GLU 73 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 2ku7 h GLU 73 CO 0.64 0.05 0.00 0.39 -1.00 0.00 0.00 179.01 179.10 2ku7 n GLU 74 N -3.92 0.38 -3.35 2.33 1.02 -1.26 -4.78 120.64 111.05 2ku7 n GLU 74 Ca -0.03 0.07 -0.37 0.00 -0.02 0.00 0.00 57.16 56.82 2ku7 n GLU 74 Cb 0.14 -1.50 -0.06 0.00 -0.02 0.00 0.00 31.44 30.00 2ku7 n GLU 74 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 2ku7 s VAL 75 N -2.43 4.84 0.18 2.62 -7.23 -0.39 -5.06 120.40 112.92 2ku7 s VAL 75 Ca 0.22 0.96 0.01 0.00 -1.81 0.00 0.00 61.98 61.37 2ku7 s VAL 75 Cb 0.14 -3.79 -0.00 0.00 0.56 0.00 0.00 36.38 33.29 2ku7 s VAL 75 CO 0.30 0.40 0.04 -0.90 -0.31 0.00 0.00 175.10 174.63 2ku7 n ASP 76 N 1.27 1.47 0.07 4.85 5.68 -1.26 -4.98 116.55 123.65 2ku7 n ASP 76 Ca -0.08 -1.88 0.05 0.00 -0.50 0.00 0.00 54.79 52.37 2ku7 n ASP 76 Cb 0.51 0.34 0.48 0.00 -1.14 0.00 0.00 41.12 41.32 2ku7 n ASP 76 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 2ku7 h ASP 77 N 0.61 0.34 -0.43 -1.12 5.19 -1.95 -1.88 116.42 117.18 2ku7 h ASP 77 Ca -0.14 -0.01 -0.14 0.00 -0.62 0.00 0.00 57.03 56.12 2ku7 h ASP 77 Cb 0.50 -0.09 -0.01 0.00 0.18 0.00 0.00 39.33 39.91 2ku7 h ASP 77 CO 0.22 0.26 -0.28 0.11 -3.12 0.00 0.00 179.24 176.43 2ku7 h LYS 78 N 0.40 0.96 -0.13 3.56 1.57 -1.98 -1.50 116.57 119.44 2ku7 h LYS 78 Ca 0.11 -0.45 -0.02 0.00 -1.87 0.00 0.00 60.65 58.42 2ku7 h LYS 78 Cb -0.03 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.27 2ku7 h LYS 78 CO -0.02 1.12 -0.00 0.28 -0.57 0.00 0.00 179.45 180.25 2ku7 h VAL 79 N 0.80 1.25 -0.46 0.50 2.07 -1.82 -1.26 116.25 117.32 2ku7 h VAL 79 Ca 0.09 -0.83 -0.11 0.00 0.82 0.00 0.00 66.70 66.67 2ku7 h VAL 79 Cb 0.87 1.55 -0.02 0.00 -1.52 0.00 0.00 31.29 32.17 2ku7 h VAL 79 CO 0.08 0.24 -0.15 0.25 0.02 0.00 0.00 177.57 178.01 2ku7 h LEU 80 N -0.04 0.88 -0.06 2.57 6.46 -1.38 -1.80 115.31 121.94 2ku7 h LEU 80 Ca 0.04 -0.30 -0.02 0.00 -0.12 0.00 0.00 57.88 57.48 2ku7 h LEU 80 Cb 0.37 -0.24 -0.00 0.00 -0.73 0.00 0.00 40.66 40.05 2ku7 h LEU 80 CO 0.01 1.03 -0.03 -0.74 -0.62 0.00 0.00 178.44 178.09 2ku7 h HIS 81 N 0.78 0.15 0.00 1.25 2.76 -1.28 -2.70 115.15 116.11 2ku7 h HIS 81 Ca 0.12 -0.04 -0.01 0.00 -2.20 0.00 0.00 60.37 58.25 2ku7 h HIS 81 Cb 0.68 -0.04 -0.00 0.00 1.55 0.00 0.00 27.41 29.60 2ku7 h HIS 81 CO 0.04 0.50 -0.03 0.00 -1.30 0.00 0.00 177.93 177.15 2ku7 h ALA 82 N 0.62 1.01 0.09 5.26 0.00 -1.24 -0.22 119.26 124.79 2ku7 h ALA 82 Ca 0.01 -0.02 -0.29 0.00 0.00 0.00 0.00 54.91 54.61 2ku7 h ALA 82 Cb 0.46 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2ku7 h ALA 82 CO 0.01 0.03 -1.48 0.00 0.00 0.00 0.00 179.25 177.81 2ku7 h ALA 83 N 1.97 0.34 -0.03 0.00 0.00 -1.31 -3.34 119.26 116.90 2ku7 h ALA 83 Ca -0.00 -1.12 0.00 0.00 0.00 0.00 0.00 54.91 53.79 2ku7 h ALA 83 Cb 0.55 0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.59 2ku7 h ALA 83 CO 0.00 1.20 -0.06 1.19 0.00 0.00 0.00 179.25 181.59 2ku7 n PHE 84 N -3.39 0.00 0.11 0.00 3.01 -1.02 -4.49 117.46 111.67 2ku7 n PHE 84 Ca -0.14 0.00 -0.02 0.00 1.01 0.00 0.00 57.45 58.30 2ku7 n PHE 84 Cb 1.03 0.00 0.22 0.00 -0.01 0.00 0.00 39.48 40.72 2ku7 n PHE 84 CO 0.00 0.00 0.00 0.97 1.01 0.00 0.00 176.76 178.74 2ku7 h ILE 85 N 4.24 1.33 -0.03 4.37 6.09 -1.15 -3.21 117.51 129.16 2ku7 h ILE 85 Ca 0.00 -1.63 0.01 0.00 -1.37 0.00 0.00 64.86 61.87 2ku7 h ILE 85 Cb 0.93 1.78 -0.00 0.00 0.47 0.00 0.00 36.82 40.00 2ku7 h ILE 85 CO 0.00 0.48 0.06 -0.65 -3.07 0.00 0.00 178.15 174.97 2ku7 h PRO 86 N 0.15 0.00 0.02 2.19 0.11 -1.80 -2.08 132.00 130.59 2ku7 h PRO 86 Ca 0.01 0.00 -0.21 0.00 0.11 0.00 0.00 66.00 65.91 2ku7 h PRO 86 Cb 0.87 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.96 2ku7 h PRO 86 CO 0.07 0.00 -0.97 0.74 -0.21 0.00 0.00 178.00 177.63 2ku7 h PHE 87 N 0.00 0.12 0.00 0.65 0.04 -1.89 -3.50 116.94 112.36 2ku7 h PHE 87 Ca 0.01 -0.08 0.00 0.00 2.80 0.00 0.00 57.97 60.71 2ku7 h PHE 87 Cb 0.13 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.27 2ku7 h PHE 87 CO 0.00 0.99 0.00 0.41 -0.60 0.00 0.00 178.31 179.11 2ku7 n GLY 88 N 1.17 -0.74 3.74 -1.45 0.00 -0.78 -4.77 105.19 102.35 2ku7 n GLY 88 Ca -0.02 -0.92 -0.40 0.00 0.00 0.00 0.00 46.02 44.67 2ku7 n GLY 88 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2ku7 s ASP 89 N -4.00 7.34 -0.05 1.61 1.01 -1.26 -4.53 116.67 116.78 2ku7 s ASP 89 Ca 0.00 1.60 0.04 0.00 0.71 0.00 0.00 52.55 54.90 2ku7 s ASP 89 Cb 0.00 -2.52 -0.03 0.00 1.01 0.00 0.00 42.92 41.38 2ku7 s ASP 89 CO 0.00 -0.04 -0.15 -0.63 0.21 0.00 0.00 175.17 174.56 2ku7 s ILE 90 N 0.05 2.97 -0.10 0.77 1.01 -1.26 -2.65 121.20 121.98 2ku7 s ILE 90 Ca 0.43 -0.76 -0.07 0.00 0.00 0.00 0.00 60.65 60.25 2ku7 s ILE 90 Cb -0.22 -2.15 -0.02 0.00 0.01 0.00 0.00 42.46 40.08 2ku7 s ILE 90 CO 0.26 0.59 -0.13 0.35 0.00 0.00 0.00 174.94 176.01 2ku7 n THR 91 N 2.35 1.01 -3.83 2.92 -2.24 0.04 -4.88 114.28 109.65 2ku7 n THR 91 Ca -0.17 0.30 -0.11 0.00 -2.27 0.00 0.00 64.05 61.80 2ku7 n THR 91 Cb 0.52 -2.13 -0.09 0.00 -2.10 0.00 0.00 70.33 66.53 2ku7 n THR 91 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2ku7 s ASP 92 N -5.09 -0.01 -0.16 3.42 1.01 -1.25 -5.04 116.67 109.54 2ku7 s ASP 92 Ca -0.11 -0.25 0.01 0.00 0.71 0.00 0.00 52.55 52.91 2ku7 s ASP 92 Cb 0.01 0.28 0.01 0.00 1.01 0.00 0.00 42.92 44.23 2ku7 s ASP 92 CO 0.16 -0.50 -0.17 -0.63 0.21 0.00 0.00 175.17 174.23 2ku7 s ILE 93 N -2.12 2.40 -0.16 0.77 -1.09 -1.26 -2.25 121.20 117.48 2ku7 s ILE 93 Ca -0.08 -0.85 0.01 0.00 -2.23 0.00 0.00 60.65 57.50 2ku7 s ILE 93 Cb -0.03 -2.01 0.02 0.00 -1.58 0.00 0.00 42.46 38.86 2ku7 s ILE 93 CO -0.01 0.52 -0.20 -1.58 -1.23 0.00 0.00 174.94 172.44 2ku7 s GLN 94 N 1.01 2.96 -0.16 2.79 2.00 -1.07 -4.99 119.66 122.20 2ku7 s GLN 94 Ca -0.02 -0.82 -0.00 0.00 -2.00 0.00 0.00 55.36 52.52 2ku7 s GLN 94 Cb -0.15 -2.50 0.04 0.00 0.80 0.00 0.00 33.01 31.20 2ku7 s GLN 94 CO -0.04 -0.15 -0.08 0.42 -0.50 0.00 0.00 175.29 174.94 2ku7 s ILE 95 N 1.14 1.25 0.10 -2.34 1.09 -1.26 -2.19 121.20 118.99 2ku7 s ILE 95 Ca 0.01 -0.64 -0.32 0.00 -1.10 0.00 0.00 60.65 58.61 2ku7 s ILE 95 Cb -0.14 -1.35 -0.11 0.00 -1.06 0.00 0.00 42.46 39.81 2ku7 s ILE 95 CO -0.09 0.22 1.84 -2.65 -0.10 0.00 0.00 174.94 174.16 2ku7 n PRO 96 N 4.84 2.69 -4.69 2.79 -0.02 -1.26 -5.00 135.00 134.34 2ku7 n PRO 96 Ca -0.13 0.98 -0.24 0.00 -2.02 0.00 0.00 63.50 62.08 2ku7 n PRO 96 Cb 0.48 -2.87 -0.16 0.00 -0.02 0.00 0.00 33.50 30.94 2ku7 n PRO 96 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2ku7 s LEU 97 N 2.90 1.85 0.14 2.45 2.96 -1.26 -4.57 118.68 123.14 2ku7 s LEU 97 Ca 0.84 -0.31 -0.17 0.00 -0.22 0.00 0.00 54.13 54.27 2ku7 s LEU 97 Cb -0.51 -0.85 -0.07 0.00 0.50 0.00 0.00 46.19 45.26 2ku7 s LEU 97 CO 0.39 0.12 0.59 -1.81 -1.32 0.00 0.00 176.35 174.31 2ku7 s ASP 98 N 0.16 6.94 0.32 3.68 1.01 -1.26 -4.94 116.67 122.58 2ku7 s ASP 98 Ca -0.05 1.19 0.04 0.00 0.71 0.00 0.00 52.55 54.44 2ku7 s ASP 98 Cb -0.11 -2.33 0.56 0.00 1.01 0.00 0.00 42.92 42.04 2ku7 s ASP 98 CO 0.02 0.15 1.84 1.88 0.21 0.00 0.00 175.17 179.27 2ku7 h TYR 99 N 3.84 0.56 -0.03 4.23 0.05 -1.98 0.60 116.97 124.23 2ku7 h TYR 99 Ca -0.49 -0.07 -0.02 0.00 0.05 0.00 0.00 58.73 58.20 2ku7 h TYR 99 Cb 1.20 -0.16 0.00 0.00 1.01 0.00 0.00 36.73 38.78 2ku7 h TYR 99 CO 0.66 0.57 -0.07 1.49 -1.05 0.00 0.00 178.16 179.76 2ku7 h GLU 100 N 0.50 0.11 0.00 4.88 4.81 -2.01 -3.37 114.58 119.51 2ku7 h GLU 100 Ca 0.10 -0.07 -0.27 0.00 -0.13 0.00 0.00 59.36 58.99 2ku7 h GLU 100 Cb 0.39 0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.73 2ku7 h GLU 100 CO 0.02 0.66 -2.01 0.25 -0.73 0.00 0.00 179.01 177.20 2ku7 n THR 101 N -4.71 1.23 -1.93 0.32 -2.24 -1.23 -4.98 114.28 100.75 2ku7 n THR 101 Ca -0.08 -0.77 -0.17 0.00 -2.27 0.00 0.00 64.05 60.75 2ku7 n THR 101 Cb 0.34 -0.58 -0.04 0.00 -2.10 0.00 0.00 70.33 67.94 2ku7 n THR 101 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2ku7 n GLU 102 N -2.78 -1.63 -4.38 -0.78 1.02 0.21 -4.97 120.64 107.32 2ku7 n GLU 102 Ca -0.22 0.93 -0.25 0.00 -0.02 0.00 0.00 57.16 57.60 2ku7 n GLU 102 Cb 1.01 -5.39 -0.11 0.00 -0.02 0.00 0.00 31.44 26.92 2ku7 n GLU 102 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2ku7 s LYS 103 N -4.19 1.41 0.28 3.49 1.02 -1.26 -4.89 119.74 115.60 2ku7 s LYS 103 Ca 0.00 -1.48 0.05 0.00 0.02 0.00 0.00 55.97 54.56 2ku7 s LYS 103 Cb 0.00 -1.62 -0.02 0.00 -0.52 0.00 0.00 37.83 35.67 2ku7 s LYS 103 CO 0.00 0.34 0.41 -3.38 -0.92 0.00 0.00 175.35 171.80 2ku7 s HIS 104 N -1.84 3.35 -1.68 3.18 -3.43 -1.26 -4.13 115.29 109.49 2ku7 s HIS 104 Ca 0.19 -0.05 0.28 0.00 -0.80 0.00 0.00 55.06 54.68 2ku7 s HIS 104 Cb -0.07 -1.73 1.11 0.00 -1.43 0.00 0.00 32.58 30.46 2ku7 s HIS 104 CO 0.09 0.27 1.79 0.54 -2.00 0.00 0.00 174.74 175.42 2ku7 n ARG 105 N -1.52 0.73 0.00 -0.38 1.74 -1.26 -4.88 116.66 111.09 2ku7 n ARG 105 Ca -0.06 -0.30 0.00 0.00 -0.77 0.00 0.00 57.85 56.72 2ku7 n ARG 105 Cb 0.57 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.52 2ku7 n ARG 105 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2ku7 n GLY 106 N 1.29 1.81 3.21 -0.13 0.00 -1.26 -4.96 105.19 105.16 2ku7 n GLY 106 Ca 0.14 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.03 2ku7 n GLY 106 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2ku7 s PHE 107 N -2.00 -0.15 0.18 1.61 -0.12 -1.26 -0.81 117.98 115.44 2ku7 s PHE 107 Ca 0.00 0.21 -0.17 0.00 -0.05 0.00 0.00 56.93 56.92 2ku7 s PHE 107 Cb 0.00 0.07 0.03 0.00 -0.63 0.00 0.00 43.02 42.49 2ku7 s PHE 107 CO 0.00 -0.37 0.50 0.00 -0.05 0.00 0.00 175.22 175.30 2ku7 s ALA 108 N -1.29 -0.95 -0.12 1.99 0.00 0.50 -4.61 121.76 117.29 2ku7 s ALA 108 Ca -0.13 -0.17 -0.02 0.00 0.00 0.00 0.00 51.96 51.64 2ku7 s ALA 108 Cb -0.06 0.83 -0.03 0.00 0.00 0.00 0.00 23.12 23.87 2ku7 s ALA 108 CO 0.04 -0.77 -0.05 -0.06 0.00 0.00 0.00 175.76 174.92 2ku7 s PHE 109 N -3.86 3.00 -0.12 0.00 0.08 -0.93 -0.15 117.98 116.01 2ku7 s PHE 109 Ca 0.08 -0.16 -0.01 0.00 0.12 0.00 0.00 56.93 56.97 2ku7 s PHE 109 Cb -0.00 -1.85 -0.02 0.00 -0.57 0.00 0.00 43.02 40.57 2ku7 s PHE 109 CO -0.05 0.13 -0.09 0.54 -0.10 0.00 0.00 175.22 175.65 2ku7 s VAL 110 N -0.16 3.41 -0.17 -0.44 0.11 0.93 -2.59 120.40 121.48 2ku7 s VAL 110 Ca 0.03 -0.55 -0.05 0.00 -2.93 0.00 0.00 61.98 58.47 2ku7 s VAL 110 Cb -0.13 -2.43 -0.03 0.00 -1.53 0.00 0.00 36.38 32.26 2ku7 s VAL 110 CO 0.03 0.54 0.00 -0.70 -3.33 0.00 0.00 175.10 171.64 2ku7 s GLU 111 N 0.02 3.76 0.03 1.54 2.12 -0.95 -0.25 118.70 124.96 2ku7 s GLU 111 Ca -0.02 -0.46 0.06 0.00 0.36 0.00 0.00 54.97 54.90 2ku7 s GLU 111 Cb -0.14 -3.05 -0.03 0.00 0.26 0.00 0.00 34.13 31.17 2ku7 s GLU 111 CO 0.04 0.20 -0.14 -0.06 -0.54 0.00 0.00 175.26 174.76 2ku7 s PHE 112 N 0.50 2.68 0.20 5.30 0.08 -0.54 -0.78 117.98 125.42 2ku7 s PHE 112 Ca -0.01 -0.18 -0.04 0.00 0.12 0.00 0.00 56.93 56.82 2ku7 s PHE 112 Cb -0.14 -1.51 0.13 0.00 -0.57 0.00 0.00 43.02 40.93 2ku7 s PHE 112 CO 0.02 0.30 1.55 1.49 -0.10 0.00 0.00 175.22 178.48 2ku7 h GLU 113 N 4.47 0.67 -5.76 0.44 4.81 -1.83 -3.44 114.58 113.95 2ku7 h GLU 113 Ca -0.48 -0.35 -0.66 0.00 -0.13 0.00 0.00 59.36 57.73 2ku7 h GLU 113 Cb 1.16 0.01 -0.14 0.00 0.63 0.00 0.00 28.75 30.41 2ku7 h GLU 113 CO 0.50 0.96 -0.59 -0.51 -0.73 0.00 0.00 179.01 178.64 2ku7 s LEU 114 N -8.61 3.73 0.48 1.64 1.02 -1.26 -4.99 118.68 110.70 2ku7 s LEU 114 Ca -0.08 0.17 0.28 0.00 0.02 0.00 0.00 54.13 54.52 2ku7 s LEU 114 Cb 0.12 -1.88 0.86 0.00 0.02 0.00 0.00 46.19 45.31 2ku7 s LEU 114 CO 0.84 0.34 1.80 0.00 0.02 0.00 0.00 176.35 179.35 2ku7 h ALA 115 N 5.48 1.00 -0.00 4.21 0.00 -1.85 -2.97 119.26 125.14 2ku7 h ALA 115 Ca -0.48 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.43 2ku7 h ALA 115 Cb 1.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2ku7 h ALA 115 CO 0.58 0.00 -0.00 1.49 0.00 0.00 0.00 179.25 181.32 2ku7 h GLU 116 N 0.00 0.00 -0.07 0.00 4.57 -1.94 -2.77 114.58 114.37 2ku7 h GLU 116 Ca 0.00 -0.00 -0.11 0.00 -1.18 0.00 0.00 59.36 58.07 2ku7 h GLU 116 Cb 0.74 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.32 2ku7 h GLU 116 CO 0.00 0.56 -0.44 0.38 -1.18 0.00 0.00 179.01 178.33 2ku7 h ASP 117 N -0.56 0.18 -0.38 1.04 3.04 -1.86 -2.59 116.42 115.30 2ku7 h ASP 117 Ca 0.00 -0.08 -0.04 0.00 -3.24 0.00 0.00 57.03 53.68 2ku7 h ASP 117 Cb 0.56 -0.05 -0.02 0.00 -1.04 0.00 0.00 39.33 38.78 2ku7 h ASP 117 CO 0.00 0.60 0.10 0.00 -2.04 0.00 0.00 179.24 177.90 2ku7 h ALA 118 N 1.41 0.50 0.00 4.15 0.00 -1.58 -1.12 119.26 122.62 2ku7 h ALA 118 Ca 0.01 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 2ku7 h ALA 118 Cb 0.84 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 2ku7 h ALA 118 CO 0.07 0.17 -0.34 0.00 0.00 0.00 0.00 179.25 179.14 2ku7 h ALA 119 N 0.95 1.42 -0.21 0.00 0.00 -1.43 -2.53 119.26 117.46 2ku7 h ALA 119 Ca 0.12 -0.31 -0.13 0.00 0.00 0.00 0.00 54.91 54.59 2ku7 h ALA 119 Cb 0.29 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2ku7 h ALA 119 CO 0.00 0.43 -0.42 0.00 0.00 0.00 0.00 179.25 179.26 2ku7 h ALA 120 N 1.66 0.89 -0.41 0.00 0.00 -1.06 -2.74 119.26 117.60 2ku7 h ALA 120 Ca -0.00 -0.44 -0.13 0.00 0.00 0.00 0.00 54.91 54.33 2ku7 h ALA 120 Cb 0.61 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 2ku7 h ALA 120 CO 0.04 0.64 -0.27 0.00 0.00 0.00 0.00 179.25 179.66 2ku7 h ALA 121 N 1.14 0.74 -0.15 0.00 0.00 -0.79 -2.70 119.26 117.50 2ku7 h ALA 121 Ca 0.03 -0.40 -0.12 0.00 0.00 0.00 0.00 54.91 54.41 2ku7 h ALA 121 Cb 0.91 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 2ku7 h ALA 121 CO 0.08 0.66 -0.45 0.82 0.00 0.00 0.00 179.25 180.36 2ku7 h ILE 122 N 0.74 1.32 -0.20 0.00 2.04 -1.45 0.32 117.51 120.28 2ku7 h ILE 122 Ca 0.09 -1.63 -0.14 0.00 1.00 0.00 0.00 64.86 64.17 2ku7 h ILE 122 Cb 0.83 1.70 -0.01 0.00 -0.74 0.00 0.00 36.82 38.60 2ku7 h ILE 122 CO 0.07 0.50 -0.48 -0.78 0.00 0.00 0.00 178.15 177.46 2ku7 h ASP 123 N 0.29 0.57 0.00 1.72 3.58 -1.40 -3.05 116.42 118.13 2ku7 h ASP 123 Ca 0.02 -0.28 -0.33 0.00 0.42 0.00 0.00 57.03 56.86 2ku7 h ASP 123 Cb 0.91 -0.16 -0.06 0.00 1.72 0.00 0.00 39.33 41.74 2ku7 h ASP 123 CO 0.08 0.96 -2.26 0.59 -2.88 0.00 0.00 179.24 175.72 2ku7 n ASN 124 N -3.99 1.60 -0.53 2.28 3.02 -1.03 -4.57 115.26 112.05 2ku7 n ASN 124 Ca -0.02 -0.07 0.14 0.00 -0.03 0.00 0.00 54.58 54.59 2ku7 n ASN 124 Cb 0.56 0.16 0.48 0.00 -0.61 0.00 0.00 39.78 40.37 2ku7 n ASN 124 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 2ku7 n MET 125 N -2.96 1.72 -0.23 3.52 2.81 0.11 -4.25 117.12 117.84 2ku7 n MET 125 Ca -0.36 -1.05 0.07 0.00 -1.81 0.00 0.00 57.70 54.55 2ku7 n MET 125 Cb 0.99 -1.47 0.33 0.00 -0.71 0.00 0.00 33.22 32.36 2ku7 n MET 125 CO 0.00 0.00 0.00 -0.97 1.51 0.00 0.00 175.97 176.51 2ku7 h ASN 126 N 2.52 0.72 -1.99 7.83 -0.73 -1.64 -3.28 115.58 118.99 2ku7 h ASN 126 Ca 0.00 0.01 -0.55 0.00 1.87 0.00 0.00 56.30 57.63 2ku7 h ASN 126 Cb 0.54 -0.14 -0.38 0.00 0.27 0.00 0.00 38.32 38.61 2ku7 h ASN 126 CO 0.00 0.44 -1.06 1.21 -0.37 0.00 0.00 177.43 177.65 2ku7 n GLU 127 N -4.50 0.61 -4.40 6.67 2.13 -1.24 -3.19 120.64 116.72 2ku7 n GLU 127 Ca 0.13 -3.15 -0.26 0.00 0.66 0.00 0.00 57.16 54.54 2ku7 n GLU 127 Cb 0.28 -1.30 -0.12 0.00 0.27 0.00 0.00 31.44 30.57 2ku7 n GLU 127 CO 0.00 0.00 0.00 -1.12 -0.41 0.00 0.00 177.13 175.60 2ku7 s SER 128 N -0.96 3.25 -0.27 4.31 0.01 -1.20 -4.95 113.70 113.90 2ku7 s SER 128 Ca 0.35 -0.85 -0.18 0.00 1.31 0.00 0.00 55.95 56.57 2ku7 s SER 128 Cb 0.15 -0.23 -0.02 0.00 0.21 0.00 0.00 66.02 66.13 2ku7 s SER 128 CO -0.13 0.09 0.54 -0.70 0.41 0.00 0.00 173.24 173.45 2ku7 s GLU 129 N -2.63 4.01 -0.08 12.44 2.12 -1.26 -0.86 118.70 132.43 2ku7 s GLU 129 Ca 0.19 0.29 0.02 0.00 0.36 0.00 0.00 54.97 55.83 2ku7 s GLU 129 Cb -0.08 -3.68 0.01 0.00 0.26 0.00 0.00 34.13 30.65 2ku7 s GLU 129 CO 0.09 -0.41 -0.12 -1.17 -0.54 0.00 0.00 175.26 173.10 2ku7 s LEU 130 N 2.37 1.60 -1.19 2.70 2.96 0.89 -4.75 118.68 123.26 2ku7 s LEU 130 Ca 0.22 -0.33 0.00 0.00 -0.22 0.00 0.00 54.13 53.80 2ku7 s LEU 130 Cb -0.15 -0.90 0.00 0.00 0.50 0.00 0.00 46.19 45.64 2ku7 s LEU 130 CO 0.10 0.01 0.00 0.33 -1.32 0.00 0.00 176.35 175.47 2ku7 n PHE 131 N 4.07 0.00 -0.01 5.38 7.35 -1.26 -1.44 117.46 131.55 2ku7 n PHE 131 Ca -0.20 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.49 2ku7 n PHE 131 Cb 0.51 -2.64 0.00 0.00 0.35 0.00 0.00 39.48 37.70 2ku7 n PHE 131 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2ku7 n GLY 132 N -0.12 0.26 3.56 7.13 0.00 -1.26 -5.03 105.19 109.73 2ku7 n GLY 132 Ca -0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.61 2ku7 n GLY 132 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2ku7 s ARG 133 N -0.92 2.09 0.20 1.61 3.52 -0.52 -5.08 118.95 119.84 2ku7 s ARG 133 Ca 0.00 -1.03 -0.29 0.00 -0.13 0.00 0.00 55.73 54.27 2ku7 s ARG 133 Cb 0.00 -2.28 -0.08 0.00 -1.56 0.00 0.00 34.95 31.03 2ku7 s ARG 133 CO 0.00 0.51 0.93 0.99 -0.81 0.00 0.00 175.30 176.92 2ku7 s THR 134 N -1.19 4.22 0.23 4.11 2.01 -1.26 -0.08 115.64 123.69 2ku7 s THR 134 Ca 0.20 2.04 0.12 0.00 0.31 0.00 0.00 61.69 64.36 2ku7 s THR 134 Cb -0.11 -4.31 -0.05 0.00 0.01 0.00 0.00 72.50 68.05 2ku7 s THR 134 CO 0.13 0.45 -0.22 0.27 -0.69 0.00 0.00 174.62 174.56 2ku7 s ILE 135 N -0.84 2.40 -0.04 1.82 -4.36 -0.04 -4.61 121.20 115.53 2ku7 s ILE 135 Ca 0.42 -2.21 0.03 0.00 -0.26 0.00 0.00 60.65 58.63 2ku7 s ILE 135 Cb -0.25 -2.20 0.00 0.00 1.25 0.00 0.00 42.46 41.26 2ku7 s ILE 135 CO 0.31 -0.26 -0.14 0.00 0.24 0.00 0.00 174.94 175.09 2ku7 s ARG 136 N -3.07 1.55 0.02 0.37 1.70 0.87 -3.21 118.95 117.18 2ku7 s ARG 136 Ca 0.25 -0.48 0.05 0.00 -0.47 0.00 0.00 55.73 55.08 2ku7 s ARG 136 Cb -0.06 -1.34 -0.02 0.00 -0.57 0.00 0.00 34.95 32.95 2ku7 s ARG 136 CO 0.12 0.15 -0.15 0.14 -1.08 0.00 0.00 175.30 174.49 2ku7 s VAL 137 N 0.24 1.17 0.22 4.99 -7.23 -1.19 -0.56 120.40 118.05 2ku7 s VAL 137 Ca -0.06 -0.88 -0.02 0.00 -1.81 0.00 0.00 61.98 59.20 2ku7 s VAL 137 Cb -0.12 -1.03 -0.03 0.00 0.56 0.00 0.00 36.38 35.76 2ku7 s VAL 137 CO 0.02 0.14 0.20 0.20 -0.31 0.00 0.00 175.10 175.35 2ku7 s ASN 138 N -0.86 0.28 -0.11 4.85 -0.87 -0.00 -4.58 114.94 113.65 2ku7 s ASN 138 Ca 0.04 -1.37 -0.28 0.00 -1.57 0.00 0.00 52.86 49.68 2ku7 s ASN 138 Cb -0.07 0.43 -0.02 0.00 -0.02 0.00 0.00 41.25 41.58 2ku7 s ASN 138 CO 0.01 -0.91 0.94 -0.22 -2.57 0.00 0.00 177.10 174.35 2ku7 s LEU 139 N -3.16 4.24 0.00 0.60 0.20 -1.26 0.89 118.68 120.19 2ku7 s LEU 139 Ca 0.37 1.43 0.25 0.00 0.69 0.00 0.00 54.13 56.86 2ku7 s LEU 139 Cb 0.05 -3.45 0.34 0.00 -0.43 0.00 0.00 46.19 42.71 2ku7 s LEU 139 CO 0.13 -0.40 1.35 0.00 -0.29 0.00 0.00 176.35 177.14