#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 3.59 0.07 1.43 1.00 -1.26 -5.11 119.30 119.03 2ku7 s MET 2 Ca 0.00 -0.18 -0.01 0.00 0.00 0.00 0.00 55.69 55.50 2ku7 s MET 2 Cb 0.00 -3.21 -0.04 0.00 0.00 0.00 0.00 34.83 31.58 2ku7 s MET 2 CO 0.00 0.64 0.23 -1.64 0.00 0.00 0.00 175.02 174.25 2ku7 s MET 3 N -0.64 3.46 0.11 2.03 -1.94 -1.26 -5.12 119.30 115.95 2ku7 s MET 3 Ca 0.13 -0.39 0.06 0.00 -1.71 0.00 0.00 55.69 53.78 2ku7 s MET 3 Cb -0.12 -3.02 -0.04 0.00 2.01 0.00 0.00 34.83 33.66 2ku7 s MET 3 CO 0.02 0.60 -0.04 -0.65 -0.01 0.00 0.00 175.02 174.94 2ku7 s GLN 4 N -2.49 2.34 -0.05 2.03 -0.21 -1.26 -5.13 119.66 114.88 2ku7 s GLN 4 Ca 0.35 -0.98 0.04 0.00 0.02 0.00 0.00 55.36 54.80 2ku7 s GLN 4 Cb -0.13 -2.40 0.00 0.00 1.00 0.00 0.00 33.01 31.48 2ku7 s GLN 4 CO 0.27 0.51 -0.17 0.00 -2.12 0.00 0.00 175.29 173.78 2ku7 h GLY 6 N 6.42 1.19 -5.63 0.00 0.00 -2.08 -3.42 103.07 99.55 2ku7 h GLY 6 Ca -0.31 -0.80 -0.65 0.00 0.00 0.00 0.00 47.33 45.57 2ku7 h GLY 6 CO 0.48 0.74 -0.68 0.54 0.00 0.00 0.00 176.54 177.62 2ku7 s LYS 7 N -5.19 3.40 -0.06 4.80 1.02 -1.26 -5.11 119.74 117.34 2ku7 s LYS 7 Ca -0.12 -0.53 0.01 0.00 0.02 0.00 0.00 55.97 55.35 2ku7 s LYS 7 Cb 0.14 -2.81 0.02 0.00 -0.52 0.00 0.00 37.83 34.66 2ku7 s LYS 7 CO 0.85 0.37 -0.06 0.00 -0.92 0.00 0.00 175.35 175.59 2ku7 h ASP 9 N 7.33 0.30 -3.82 0.00 3.58 -2.01 -3.45 116.42 118.35 2ku7 h ASP 9 Ca -0.34 -0.11 -0.50 0.00 0.42 0.00 0.00 57.03 56.51 2ku7 h ASP 9 Cb 1.16 -0.08 0.03 0.00 1.72 0.00 0.00 39.33 42.16 2ku7 h ASP 9 CO 0.45 0.62 0.20 -0.13 -2.88 0.00 0.00 179.24 177.50 2ku7 s ARG 10 N -4.30 3.63 0.50 0.28 0.52 -1.26 -5.06 118.95 113.26 2ku7 s ARG 10 Ca -0.05 0.43 -0.21 0.00 -0.52 0.00 0.00 55.73 55.38 2ku7 s ARG 10 Cb 0.14 -2.30 -0.07 0.00 0.52 0.00 0.00 34.95 33.24 2ku7 s ARG 10 CO 0.77 -0.26 1.11 -1.58 0.02 0.00 0.00 175.30 175.36 2ku7 s TRP 11 N -2.76 2.83 0.20 -0.53 0.52 -1.26 -5.07 118.94 112.87 2ku7 s TRP 11 Ca 0.51 1.56 0.09 0.00 0.02 0.00 0.00 56.10 58.27 2ku7 s TRP 11 Cb -0.10 -3.24 -0.04 0.00 -1.15 0.00 0.00 33.47 28.93 2ku7 s TRP 11 CO 0.43 -1.30 -0.18 0.14 0.02 0.00 0.00 176.95 176.06 2ku7 s VAL 12 N -1.77 1.92 0.41 4.03 -7.23 -1.26 -5.05 120.40 111.45 2ku7 s VAL 12 Ca 0.69 -2.09 0.18 0.00 -1.81 0.00 0.00 61.98 58.95 2ku7 s VAL 12 Cb -0.23 -1.99 0.19 0.00 0.56 0.00 0.00 36.38 34.92 2ku7 s VAL 12 CO 0.27 -0.40 1.97 0.45 -0.31 0.00 0.00 175.10 177.08 2ku7 h HIS 13 N 2.90 0.00 -0.69 2.82 3.86 -2.01 -3.09 115.15 118.93 2ku7 h HIS 13 Ca -0.41 0.00 0.02 0.00 -1.16 0.00 0.00 60.37 58.82 2ku7 h HIS 13 Cb 1.22 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 29.65 2ku7 h HIS 13 CO 0.71 0.21 0.46 0.66 0.86 0.00 0.00 177.93 180.83 2ku7 h SER 14 N 0.00 0.76 0.32 2.45 4.64 -2.02 -2.36 113.55 117.34 2ku7 h SER 14 Ca -0.00 -0.02 -0.08 0.00 -0.47 0.00 0.00 61.79 61.22 2ku7 h SER 14 Cb 0.42 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.32 2ku7 h SER 14 CO 0.03 0.54 -0.36 0.11 -0.87 0.00 0.00 176.83 176.28 2ku7 h LYS 15 N 0.90 0.06 0.00 4.77 1.57 -1.97 -2.71 116.57 119.19 2ku7 h LYS 15 Ca 0.26 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 2ku7 h LYS 15 Cb -0.04 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.27 2ku7 h LYS 15 CO -0.06 0.41 0.00 0.00 -0.57 0.00 0.00 179.45 179.23 2ku7 h GLU 17 N 0.00 0.00 -5.49 0.00 5.08 -1.48 -3.42 114.58 109.27 2ku7 h GLU 17 Ca 0.00 0.00 -0.60 0.00 -1.00 0.00 0.00 59.36 57.76 2ku7 h GLU 17 Cb 0.26 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 29.40 2ku7 h GLU 17 CO 0.00 0.26 -0.17 -0.80 -1.00 0.00 0.00 179.01 177.31 2ku7 s ASN 18 N -6.96 6.49 0.10 1.42 0.01 -1.23 -5.08 114.94 109.69 2ku7 s ASN 18 Ca -0.03 0.58 0.05 0.00 -0.71 0.00 0.00 52.86 52.75 2ku7 s ASN 18 Cb 0.15 -2.25 -0.04 0.00 0.41 0.00 0.00 41.25 39.52 2ku7 s ASN 18 CO 0.71 -0.08 0.03 -0.22 -1.51 0.00 0.00 177.10 176.03 2ku7 s LEU 19 N 1.23 3.57 0.73 0.60 2.96 -1.26 -5.09 118.68 121.42 2ku7 s LEU 19 Ca 0.21 -0.14 -0.11 0.00 -0.22 0.00 0.00 54.13 53.86 2ku7 s LEU 19 Cb -0.15 -2.28 0.03 0.00 0.50 0.00 0.00 46.19 44.30 2ku7 s LEU 19 CO 0.08 0.16 1.08 -0.94 -1.32 0.00 0.00 176.35 175.41 2ku7 s SER 20 N -2.45 4.87 0.33 3.68 1.04 -1.26 -4.90 113.70 115.01 2ku7 s SER 20 Ca 0.27 1.78 0.04 0.00 0.48 0.00 0.00 55.95 58.52 2ku7 s SER 20 Cb -0.11 -2.52 0.58 0.00 0.10 0.00 0.00 66.02 64.07 2ku7 s SER 20 CO 0.20 -1.79 1.86 -0.78 0.98 0.00 0.00 173.24 173.71 2ku7 h ASP 21 N -0.83 0.49 -0.09 7.02 1.82 -1.99 -2.14 116.42 120.70 2ku7 h ASP 21 Ca -0.44 -0.10 -0.06 0.00 -0.39 0.00 0.00 57.03 56.04 2ku7 h ASP 21 Cb 1.23 -0.13 0.00 0.00 0.68 0.00 0.00 39.33 41.11 2ku7 h ASP 21 CO 0.53 0.58 -0.17 1.05 -1.61 0.00 0.00 179.24 179.62 2ku7 h GLU 22 N 0.50 0.28 -0.39 0.28 4.11 -2.00 -2.82 114.58 114.53 2ku7 h GLU 22 Ca 0.10 -0.18 -0.11 0.00 0.07 0.00 0.00 59.36 59.25 2ku7 h GLU 22 Cb 0.36 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.62 2ku7 h GLU 22 CO 0.01 0.76 -0.19 0.52 0.07 0.00 0.00 179.01 180.19 2ku7 h MET 23 N -0.18 0.75 -0.54 1.06 2.86 -1.95 -2.69 114.93 114.25 2ku7 h MET 23 Ca 0.00 -0.28 -0.05 0.00 -2.06 0.00 0.00 59.70 57.31 2ku7 h MET 23 Cb 0.75 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 32.34 2ku7 h MET 23 CO 0.04 0.89 0.13 -0.92 1.06 0.00 0.00 176.91 178.10 2ku7 h TYR 24 N 0.67 0.92 -0.34 -0.22 3.20 -1.45 -2.39 116.97 117.35 2ku7 h TYR 24 Ca 0.10 -0.11 -0.15 0.00 3.14 0.00 0.00 58.73 61.70 2ku7 h TYR 24 Cb 0.68 -0.26 -0.00 0.00 1.54 0.00 0.00 36.73 38.69 2ku7 h TYR 24 CO 0.03 0.80 -0.39 0.93 -1.64 0.00 0.00 178.16 177.90 2ku7 h GLU 25 N 0.77 0.87 -0.01 1.82 4.39 -1.46 -1.96 114.58 119.00 2ku7 h GLU 25 Ca 0.17 -0.48 -0.00 0.00 0.34 0.00 0.00 59.36 59.39 2ku7 h GLU 25 Cb 0.35 0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 29.03 2ku7 h GLU 25 CO 0.00 1.12 -0.00 0.82 -1.16 0.00 0.00 179.01 179.79 2ku7 h ILE 26 N 0.66 1.27 -0.26 3.13 2.04 -1.47 -1.96 117.51 120.92 2ku7 h ILE 26 Ca 0.05 -0.80 -0.13 0.00 1.00 0.00 0.00 64.86 64.98 2ku7 h ILE 26 Cb 0.98 1.80 -0.01 0.00 -0.74 0.00 0.00 36.82 38.85 2ku7 h ILE 26 CO 0.09 0.21 -0.39 -0.07 0.00 0.00 0.00 178.15 177.99 2ku7 h LEU 27 N -0.32 0.64 -0.62 1.44 3.38 -1.52 -1.34 115.31 116.98 2ku7 h LEU 27 Ca 0.00 -0.28 -0.08 0.00 0.09 0.00 0.00 57.88 57.61 2ku7 h LEU 27 Cb 0.34 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 2ku7 h LEU 27 CO 0.00 0.96 -0.40 0.77 0.09 0.00 0.00 178.44 179.87 2ku7 h SER 28 N 0.50 0.00 -0.57 -0.43 4.64 -1.40 -3.02 113.55 113.28 2ku7 h SER 28 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 2ku7 h SER 28 Cb 0.90 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 2ku7 h SER 28 CO 0.08 0.40 0.00 0.59 -0.87 0.00 0.00 176.83 177.03 2ku7 n ASN 29 N -3.39 3.58 -4.65 4.97 3.02 -0.74 -4.94 115.26 113.11 2ku7 n ASN 29 Ca 0.01 -1.98 -0.42 0.00 -0.03 0.00 0.00 54.58 52.15 2ku7 n ASN 29 Cb 0.58 -0.38 -0.04 0.00 -0.61 0.00 0.00 39.78 39.34 2ku7 n ASN 29 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2ku7 s LEU 30 N -1.08 4.09 0.04 3.41 2.96 -0.51 -5.02 118.68 122.57 2ku7 s LEU 30 Ca 0.40 1.13 -0.31 0.00 -0.22 0.00 0.00 54.13 55.14 2ku7 s LEU 30 Cb 0.21 -3.28 -0.07 0.00 0.50 0.00 0.00 46.19 43.56 2ku7 s LEU 30 CO 0.28 -0.55 1.45 -2.84 -1.32 0.00 0.00 176.35 173.37 2ku7 s PRO 31 N 2.89 4.27 0.44 0.98 0.02 -1.26 -4.92 135.00 137.43 2ku7 s PRO 31 Ca 0.37 2.06 0.23 0.00 0.02 0.00 0.00 61.00 63.69 2ku7 s PRO 31 Cb -0.15 -3.50 1.23 0.00 0.02 0.00 0.00 34.50 32.09 2ku7 s PRO 31 CO 0.07 -0.58 1.80 1.49 -0.33 0.00 0.00 177.00 179.46 2ku7 h GLU 32 N 7.69 0.27 0.17 5.54 4.81 -1.96 -1.17 114.58 129.93 2ku7 h GLU 32 Ca -0.40 -0.02 -0.35 0.00 -0.13 0.00 0.00 59.36 58.47 2ku7 h GLU 32 Cb 1.19 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.51 2ku7 h GLU 32 CO 0.90 0.18 -1.74 0.66 -0.73 0.00 0.00 179.01 178.27 2ku7 h SER 33 N 0.28 0.56 0.11 1.04 4.64 -1.92 -3.34 113.55 114.92 2ku7 h SER 33 Ca 0.55 -0.86 -0.08 0.00 -0.47 0.00 0.00 61.79 60.94 2ku7 h SER 33 Cb 1.63 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 63.53 2ku7 h SER 33 CO -0.19 1.73 -0.26 0.58 -0.87 0.00 0.00 176.83 177.81 2ku7 h VAL 34 N 0.10 1.25 0.00 0.95 2.07 -1.65 -2.64 116.25 116.32 2ku7 h VAL 34 Ca -0.34 -1.16 -0.10 0.00 0.82 0.00 0.00 66.70 65.92 2ku7 h VAL 34 Cb 2.08 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 33.27 2ku7 h VAL 34 CO 0.17 0.35 -0.48 0.00 0.02 0.00 0.00 177.57 177.62 2ku7 h ALA 35 N 1.50 1.10 -2.27 1.67 0.00 -1.45 -3.47 119.26 116.35 2ku7 h ALA 35 Ca 0.04 -0.44 -0.05 0.00 0.00 0.00 0.00 54.91 54.45 2ku7 h ALA 35 Cb 0.60 -0.08 -0.17 0.00 0.00 0.00 0.00 17.79 18.14 2ku7 h ALA 35 CO 0.04 0.61 0.18 1.52 0.00 0.00 0.00 179.25 181.60 2ku7 s TYR 36 N -3.78 -0.61 0.32 0.00 1.13 -0.99 -5.10 117.35 108.31 2ku7 s TYR 36 Ca -0.01 0.90 0.05 0.00 -1.41 0.00 0.00 57.07 56.59 2ku7 s TYR 36 Cb 0.13 0.44 -0.02 0.00 -1.10 0.00 0.00 41.96 41.41 2ku7 s TYR 36 CO 0.73 -0.67 0.47 0.95 -2.51 0.00 0.00 175.55 174.53 2ku7 s THR 37 N -1.86 4.50 0.30 -3.49 -4.23 -1.26 -4.49 115.64 105.12 2ku7 s THR 37 Ca -0.08 -0.88 0.07 0.00 -1.18 0.00 0.00 61.69 59.61 2ku7 s THR 37 Cb -0.00 -3.59 0.04 0.00 1.34 0.00 0.00 72.50 70.29 2ku7 s THR 37 CO 0.04 -0.27 1.71 0.00 -0.54 0.00 0.00 174.62 175.56 2ku7 s VAL 39 N -4.17 5.16 -2.35 0.00 1.01 -1.26 -4.99 120.40 113.80 2ku7 s VAL 39 Ca -0.05 0.09 0.22 0.00 0.00 0.00 0.00 61.98 62.25 2ku7 s VAL 39 Cb 0.13 -3.31 0.46 0.00 0.00 0.00 0.00 36.38 33.66 2ku7 s VAL 39 CO 0.77 0.50 1.56 0.59 0.00 0.00 0.00 175.10 178.51 2ku7 n ASN 40 N 3.11 1.83 -4.68 3.32 4.13 -1.26 -4.86 115.26 116.85 2ku7 n ASN 40 Ca -0.17 -1.71 -0.36 0.00 1.68 0.00 0.00 54.58 54.02 2ku7 n ASN 40 Cb 0.53 -0.10 -0.09 0.00 -1.54 0.00 0.00 39.78 38.58 2ku7 n ASN 40 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2ku7 n THR 42 N 4.07 0.00 -0.04 0.00 5.66 -1.26 -4.71 114.28 118.00 2ku7 n THR 42 Ca -0.15 -0.50 -0.12 0.00 -3.05 0.00 0.00 64.05 60.24 2ku7 n THR 42 Cb 0.52 1.01 0.01 0.00 -1.55 0.00 0.00 70.33 70.33 2ku7 n THR 42 CO 0.00 0.00 0.00 -0.33 -3.05 0.00 0.00 175.07 171.69 2ku7 h GLU 43 N 0.12 0.73 -0.23 1.09 4.39 -2.00 -3.27 114.58 115.41 2ku7 h GLU 43 Ca 0.00 -0.44 -0.17 0.00 0.34 0.00 0.00 59.36 59.08 2ku7 h GLU 43 Cb 0.03 0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 28.72 2ku7 h GLU 43 CO 0.00 1.07 -0.55 0.00 -1.16 0.00 0.00 179.01 178.36 2ku7 h ARG 44 N 0.57 0.69 -5.24 2.33 3.08 -2.02 -3.43 114.38 110.35 2ku7 h ARG 44 Ca 0.02 -0.44 -0.66 0.00 0.07 0.00 0.00 59.98 58.97 2ku7 h ARG 44 Cb 1.09 0.05 -0.29 0.00 0.08 0.00 0.00 29.97 30.90 2ku7 h ARG 44 CO 0.11 1.06 -0.80 -1.01 -1.07 0.00 0.00 179.97 178.26 2ku7 s HIS 45 N -4.04 2.77 -0.12 3.04 3.76 -1.23 -5.02 115.29 114.45 2ku7 s HIS 45 Ca -0.09 -0.92 -0.21 0.00 -0.15 0.00 0.00 55.06 53.70 2ku7 s HIS 45 Cb 0.11 -1.86 -0.26 0.00 1.11 0.00 0.00 32.58 31.67 2ku7 s HIS 45 CO 0.86 -0.39 0.60 0.28 -0.85 0.00 0.00 174.74 175.24 2ku7 h VAL 46 N 5.59 1.25 -2.84 -0.90 2.07 -1.84 -3.44 116.25 116.13 2ku7 h VAL 46 Ca -0.29 -2.38 -0.64 0.00 0.82 0.00 0.00 66.70 64.21 2ku7 h VAL 46 Cb 1.20 2.85 -0.06 0.00 -1.52 0.00 0.00 31.29 33.76 2ku7 h VAL 46 CO 0.56 0.62 -0.50 -0.62 0.02 0.00 0.00 177.57 177.64 2ku7 s ASP 47 N -6.83 6.27 0.00 0.57 2.15 -1.26 -5.06 116.67 112.50 2ku7 s ASP 47 Ca -0.20 0.32 0.00 0.00 0.43 0.00 0.00 52.55 53.10 2ku7 s ASP 47 Cb 0.03 -1.95 0.00 0.00 -0.30 0.00 0.00 42.92 40.70 2ku7 s ASP 47 CO 0.73 0.27 0.00 0.61 -0.17 0.00 0.00 175.17 176.61 2ku7 n GLY 48 N 1.04 -0.25 0.00 2.66 0.00 -1.26 -5.14 105.19 102.24 2ku7 n GLY 48 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.90 2ku7 n GLY 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ku7 n GLY 49 N 1.95 1.38 0.25 -0.02 0.00 -1.26 -5.00 105.19 102.48 2ku7 n GLY 49 Ca 0.00 -1.05 -0.04 0.00 0.00 0.00 0.00 46.02 44.93 2ku7 n GLY 49 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2ku7 h SER 50 N 0.00 0.53 0.00 1.61 0.02 -2.08 -3.47 113.55 110.16 2ku7 h SER 50 Ca 0.00 -0.17 0.00 0.00 -0.84 0.00 0.00 61.79 60.78 2ku7 h SER 50 Cb 0.00 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 62.40 2ku7 h SER 50 CO 0.00 0.75 0.00 0.61 -1.14 0.00 0.00 176.83 177.05 2ku7 n GLY 51 N -0.42 0.71 0.00 -3.77 0.00 -1.26 -4.96 105.19 95.49 2ku7 n GLY 51 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -2.08 -0.13 3.25 -0.02 0.00 -1.26 -5.05 105.19 99.91 2ku7 n GLY 52 Ca 0.00 -1.85 -0.19 0.00 0.00 0.00 0.00 46.02 43.98 2ku7 n GLY 52 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ku7 s SER 53 N -1.32 2.11 0.17 1.61 1.04 -1.26 -5.17 113.70 110.88 2ku7 s SER 53 Ca 0.00 -0.81 0.02 0.00 0.48 0.00 0.00 55.95 55.64 2ku7 s SER 53 Cb 0.00 -0.08 -0.05 0.00 0.10 0.00 0.00 66.02 65.99 2ku7 s SER 53 CO 0.00 -0.12 0.01 -0.83 0.98 0.00 0.00 173.24 173.28 2ku7 s GLY 54 N -2.45 1.23 -0.16 7.32 0.00 -1.26 -5.09 107.32 106.91 2ku7 s GLY 54 Ca 0.10 -1.60 -0.16 0.00 0.00 0.00 0.00 44.72 43.06 2ku7 s GLY 54 CO 0.04 -1.52 0.16 -1.33 0.00 0.00 0.00 173.10 170.44 2ku7 h GLY 55 N 2.69 0.00 -3.72 0.20 0.00 -2.08 -3.48 103.07 96.69 2ku7 h GLY 55 Ca -0.37 0.00 -0.60 0.00 0.00 0.00 0.00 47.33 46.37 2ku7 h GLY 55 CO 0.62 0.00 -0.82 -1.35 0.00 0.00 0.00 176.54 174.99 2ku7 s SER 56 N -6.19 2.91 0.00 0.19 1.04 -1.26 -5.13 113.70 105.27 2ku7 s SER 56 Ca -0.18 -0.78 0.00 0.00 0.48 0.00 0.00 55.95 55.47 2ku7 s SER 56 Cb 0.02 -0.18 0.00 0.00 0.10 0.00 0.00 66.02 65.96 2ku7 s SER 56 CO 0.40 0.07 0.00 0.61 0.98 0.00 0.00 173.24 175.30 2ku7 n GLY 57 N 0.70 -1.25 3.30 7.32 0.00 -1.26 -5.18 105.19 108.82 2ku7 n GLY 57 Ca -0.16 -0.85 -0.17 0.00 0.00 0.00 0.00 46.02 44.83 2ku7 n GLY 57 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ku7 s GLY 58 N 0.00 1.27 0.09 -0.02 0.00 -1.26 -5.16 107.32 102.24 2ku7 s GLY 58 Ca 0.00 -1.54 0.09 0.00 0.00 0.00 0.00 44.72 43.27 2ku7 s GLY 58 CO 0.00 -1.63 -0.23 -0.56 0.00 0.00 0.00 173.10 170.68 2ku7 s SER 59 N -3.09 2.80 -0.10 1.64 0.01 -1.26 -5.14 113.70 108.56 2ku7 s SER 59 Ca 0.18 -0.66 -0.05 0.00 1.31 0.00 0.00 55.95 56.72 2ku7 s SER 59 Cb -0.01 -0.19 -0.04 0.00 0.21 0.00 0.00 66.02 66.00 2ku7 s SER 59 CO 0.04 0.13 0.11 0.00 0.41 0.00 0.00 173.24 173.93 2ku7 s ALA 60 N -1.03 3.74 -0.11 1.44 0.00 -1.26 -5.04 121.76 119.50 2ku7 s ALA 60 Ca 0.09 -0.69 -0.10 0.00 0.00 0.00 0.00 51.96 51.27 2ku7 s ALA 60 Cb -0.10 -1.84 -0.03 0.00 0.00 0.00 0.00 23.12 21.15 2ku7 s ALA 60 CO 0.04 0.62 -0.19 2.41 0.00 0.00 0.00 175.76 178.65 2ku7 n THR 61 N 1.94 1.02 -3.69 0.00 -1.04 -1.26 -5.01 114.28 106.23 2ku7 n THR 61 Ca -0.19 0.28 -0.14 0.00 -2.04 0.00 0.00 64.05 61.96 2ku7 n THR 61 Cb 0.54 -2.11 -0.14 0.00 -1.82 0.00 0.00 70.33 66.81 2ku7 n THR 61 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 2ku7 s THR 62 N -2.11 -0.27 0.02 12.58 -4.23 -1.26 -5.16 115.64 115.21 2ku7 s THR 62 Ca -0.15 0.25 0.04 0.00 -1.18 0.00 0.00 61.69 60.64 2ku7 s THR 62 Cb 0.02 -0.39 -0.01 0.00 1.34 0.00 0.00 72.50 73.45 2ku7 s THR 62 CO 0.23 0.11 -0.11 -0.54 -0.54 0.00 0.00 174.62 173.76 2ku7 s LYS 63 N 2.02 0.83 0.00 3.99 1.02 -1.26 -5.03 119.74 121.30 2ku7 s LYS 63 Ca -0.02 -0.56 0.28 0.00 0.02 0.00 0.00 55.97 55.70 2ku7 s LYS 63 Cb -0.12 -0.79 1.25 0.00 -0.52 0.00 0.00 37.83 37.65 2ku7 s LYS 63 CO -0.08 0.20 1.92 0.54 -0.92 0.00 0.00 175.35 177.02 2ku7 n ARG 64 N 2.32 0.06 -3.84 1.68 1.74 -1.26 -4.76 116.66 112.60 2ku7 n ARG 64 Ca -0.16 0.01 -0.35 0.00 -0.77 0.00 0.00 57.85 56.58 2ku7 n ARG 64 Cb 0.56 -1.50 -0.09 0.00 -1.02 0.00 0.00 32.46 30.41 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 -2.94 5.13 0.18 1.55 1.01 -1.26 -1.06 120.40 123.01 2ku7 s VAL 65 Ca 0.16 0.09 0.09 0.00 0.00 0.00 0.00 61.98 62.32 2ku7 s VAL 65 Cb 0.19 -3.34 -0.04 0.00 0.00 0.00 0.00 36.38 33.19 2ku7 s VAL 65 CO 0.51 0.44 -0.19 -0.76 0.00 0.00 0.00 175.10 175.09 2ku7 s LEU 66 N 0.44 2.45 -0.12 3.92 1.43 0.00 -0.36 118.68 126.43 2ku7 s LEU 66 Ca 0.06 -0.87 -0.17 0.00 -1.03 0.00 0.00 54.13 52.11 2ku7 s LEU 66 Cb -0.12 -0.91 -0.04 0.00 0.03 0.00 0.00 46.19 45.15 2ku7 s LEU 66 CO -0.01 -0.00 0.44 -0.47 0.23 0.00 0.00 176.35 176.54 2ku7 s TYR 67 N -2.01 3.51 -0.14 0.29 6.14 0.17 -0.60 117.35 124.71 2ku7 s TYR 67 Ca 0.18 0.84 -0.01 0.00 0.64 0.00 0.00 57.07 58.72 2ku7 s TYR 67 Cb -0.06 -2.50 0.04 0.00 0.42 0.00 0.00 41.96 39.85 2ku7 s TYR 67 CO 0.08 0.20 -0.04 0.14 0.64 0.00 0.00 175.55 176.56 2ku7 s VAL 68 N 0.53 0.90 0.13 3.14 -7.23 0.34 -1.72 120.40 116.50 2ku7 s VAL 68 Ca 0.24 -0.41 0.04 0.00 -1.81 0.00 0.00 61.98 60.04 2ku7 s VAL 68 Cb -0.15 -1.07 -0.04 0.00 0.56 0.00 0.00 36.38 35.68 2ku7 s VAL 68 CO 0.09 0.17 -0.11 -0.83 -0.31 0.00 0.00 175.10 174.12 2ku7 s GLY 69 N 1.73 1.00 0.00 2.32 0.00 -0.11 -0.33 107.32 111.94 2ku7 s GLY 69 Ca 0.02 -1.37 0.00 0.00 0.00 0.00 0.00 44.72 43.37 2ku7 s GLY 69 CO -0.07 -1.46 0.00 0.61 0.00 0.00 0.00 173.10 172.17 2ku7 n GLY 70 N 0.13 1.68 3.92 0.20 0.00 0.34 -0.19 105.19 111.27 2ku7 n GLY 70 Ca -0.13 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.64 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 3.70 0.56 0.99 1.02 -0.56 -4.30 118.68 120.10 2ku7 s LEU 71 Ca 0.00 0.71 -0.13 0.00 0.02 0.00 0.00 54.13 54.73 2ku7 s LEU 71 Cb 0.00 -3.62 -0.06 0.00 0.02 0.00 0.00 46.19 42.54 2ku7 s LEU 71 CO 0.00 -0.55 0.99 0.00 0.02 0.00 0.00 176.35 176.80 2ku7 s ALA 72 N -2.62 3.11 0.39 4.21 0.00 -1.26 -4.50 121.76 121.08 2ku7 s ALA 72 Ca 0.46 -0.01 0.19 0.00 0.00 0.00 0.00 51.96 52.61 2ku7 s ALA 72 Cb -0.10 -3.05 1.07 0.00 0.00 0.00 0.00 23.12 21.04 2ku7 s ALA 72 CO 0.42 -0.46 1.96 0.93 0.00 0.00 0.00 175.76 178.61 2ku7 h GLU 73 N 0.29 0.00 -0.13 0.00 5.08 -1.98 -2.17 114.58 115.67 2ku7 h GLU 73 Ca -0.45 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 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 0.62 0.22 0.00 -1.91 -1.00 0.00 0.00 179.01 176.94 2ku7 n GLU 74 N -3.92 1.35 -3.35 2.33 2.13 -1.26 -4.87 120.64 113.05 2ku7 n GLU 74 Ca -0.02 -0.54 -0.37 0.00 0.66 0.00 0.00 57.16 56.90 2ku7 n GLU 74 Cb 0.31 -1.20 -0.06 0.00 0.27 0.00 0.00 31.44 30.76 2ku7 n GLU 74 CO 0.00 0.00 0.00 0.14 -0.41 0.00 0.00 177.13 176.86 2ku7 s VAL 75 N -1.83 4.84 0.28 6.31 -7.23 -0.82 -5.05 120.40 116.91 2ku7 s VAL 75 Ca 0.18 0.94 0.02 0.00 -1.81 0.00 0.00 61.98 61.31 2ku7 s VAL 75 Cb 0.09 -3.78 -0.01 0.00 0.56 0.00 0.00 36.38 33.24 2ku7 s VAL 75 CO 0.13 0.38 0.07 0.47 -0.31 0.00 0.00 175.10 175.84 2ku7 n ASP 76 N 1.20 1.53 0.12 4.85 8.00 -1.26 -4.99 116.55 126.00 2ku7 n ASP 76 Ca -0.08 -2.43 0.09 0.00 0.71 0.00 0.00 54.79 53.08 2ku7 n ASP 76 Cb 0.52 0.58 0.57 0.00 -0.02 0.00 0.00 41.12 42.76 2ku7 n ASP 76 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 2ku7 h ASP 77 N 1.01 0.17 -0.43 -2.24 3.32 -1.96 -1.47 116.42 114.82 2ku7 h ASP 77 Ca -0.22 -0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.70 2ku7 h ASP 77 Cb 0.80 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.30 2ku7 h ASP 77 CO 0.36 0.12 -0.22 0.11 -1.72 0.00 0.00 179.24 177.89 2ku7 h LYS 78 N 0.20 0.90 -0.15 3.56 1.57 -1.98 -0.91 116.57 119.76 2ku7 h LYS 78 Ca 0.10 -0.40 -0.03 0.00 -1.87 0.00 0.00 60.65 58.45 2ku7 h LYS 78 Cb 0.15 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 2ku7 h LYS 78 CO -0.02 1.05 -0.02 0.28 -0.57 0.00 0.00 179.45 180.18 2ku7 h VAL 79 N 0.73 1.27 -0.49 0.50 2.07 -1.75 -1.35 116.25 117.23 2ku7 h VAL 79 Ca 0.09 -0.91 -0.10 0.00 0.82 0.00 0.00 66.70 66.61 2ku7 h VAL 79 Cb 0.79 1.57 -0.02 0.00 -1.52 0.00 0.00 31.29 32.11 2ku7 h VAL 79 CO 0.07 0.27 -0.09 0.25 0.02 0.00 0.00 177.57 178.08 2ku7 h LEU 80 N -0.00 0.87 -0.04 2.57 6.46 -1.30 -1.75 115.31 122.11 2ku7 h LEU 80 Ca 0.04 -0.26 -0.01 0.00 -0.12 0.00 0.00 57.88 57.53 2ku7 h LEU 80 Cb 0.42 -0.23 -0.00 0.00 -0.73 0.00 0.00 40.66 40.11 2ku7 h LEU 80 CO 0.01 0.98 -0.02 -0.74 -0.62 0.00 0.00 178.44 178.06 2ku7 h HIS 81 N 0.80 0.09 0.00 1.25 2.76 -1.16 -2.67 115.15 116.22 2ku7 h HIS 81 Ca 0.13 -0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.28 2ku7 h HIS 81 Cb 0.60 -0.02 -0.00 0.00 1.55 0.00 0.00 27.41 29.54 2ku7 h HIS 81 CO 0.03 0.46 -0.02 0.00 -1.30 0.00 0.00 177.93 177.11 2ku7 h ALA 82 N 0.61 1.00 0.08 5.26 0.00 -1.25 -0.05 119.26 124.92 2ku7 h ALA 82 Ca 0.01 -0.02 -0.29 0.00 0.00 0.00 0.00 54.91 54.62 2ku7 h ALA 82 Cb 0.44 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 2ku7 h ALA 82 CO 0.01 0.02 -1.47 0.00 0.00 0.00 0.00 179.25 177.81 2ku7 h ALA 83 N 1.98 0.37 -0.11 0.00 0.00 -1.30 -3.34 119.26 116.86 2ku7 h ALA 83 Ca -0.00 -1.13 0.00 0.00 0.00 0.00 0.00 54.91 53.78 2ku7 h ALA 83 Cb 0.53 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.56 2ku7 h ALA 83 CO 0.00 1.23 0.00 1.19 0.00 0.00 0.00 179.25 181.67 2ku7 n PHE 84 N -3.37 0.12 0.11 0.00 3.72 -1.01 -4.50 117.46 112.53 2ku7 n PHE 84 Ca -0.14 -0.07 -0.02 0.00 -0.05 0.00 0.00 57.45 57.18 2ku7 n PHE 84 Cb 1.03 -0.00 0.23 0.00 -0.94 0.00 0.00 39.48 39.79 2ku7 n PHE 84 CO 0.00 0.00 0.00 0.97 -0.05 0.00 0.00 176.76 177.68 2ku7 h ILE 85 N 4.07 1.33 -0.03 4.37 6.09 -1.12 -3.20 117.51 129.02 2ku7 h ILE 85 Ca 0.00 -1.61 0.01 0.00 -1.37 0.00 0.00 64.86 61.89 2ku7 h ILE 85 Cb 0.88 1.78 -0.00 0.00 0.47 0.00 0.00 36.82 39.95 2ku7 h ILE 85 CO 0.00 0.47 0.06 -0.65 -3.07 0.00 0.00 178.15 174.96 2ku7 h PRO 86 N 0.14 0.00 0.01 2.19 0.11 -1.80 -2.15 132.00 130.50 2ku7 h PRO 86 Ca 0.01 0.00 -0.20 0.00 0.11 0.00 0.00 66.00 65.92 2ku7 h PRO 86 Cb 0.86 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.95 2ku7 h PRO 86 CO 0.07 0.00 -0.92 0.74 -0.21 0.00 0.00 178.00 177.68 2ku7 h PHE 87 N 0.00 0.15 0.00 0.65 0.04 -1.89 -3.50 116.94 112.40 2ku7 h PHE 87 Ca 0.02 -0.09 0.00 0.00 2.80 0.00 0.00 57.97 60.69 2ku7 h PHE 87 Cb 0.13 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.26 2ku7 h PHE 87 CO 0.00 0.96 0.00 0.41 -0.60 0.00 0.00 178.31 179.08 2ku7 n GLY 88 N 1.02 -0.54 3.74 -1.45 0.00 -0.81 -4.79 105.19 102.36 2ku7 n GLY 88 Ca -0.02 -0.90 -0.40 0.00 0.00 0.00 0.00 46.02 44.70 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 7.28 -0.06 1.61 1.01 -1.26 -4.54 116.67 116.71 2ku7 s ASP 89 Ca 0.00 1.53 0.04 0.00 0.71 0.00 0.00 52.55 54.83 2ku7 s ASP 89 Cb 0.00 -2.50 -0.02 0.00 1.01 0.00 0.00 42.92 41.41 2ku7 s ASP 89 CO 0.00 -0.00 -0.17 -0.63 0.21 0.00 0.00 175.17 174.58 2ku7 s ILE 90 N -0.05 2.78 -0.15 0.77 1.01 -1.26 -2.52 121.20 121.77 2ku7 s ILE 90 Ca 0.41 -0.81 -0.12 0.00 0.00 0.00 0.00 60.65 60.13 2ku7 s ILE 90 Cb -0.21 -2.08 -0.05 0.00 0.01 0.00 0.00 42.46 40.13 2ku7 s ILE 90 CO 0.25 0.57 -0.20 0.35 0.00 0.00 0.00 174.94 175.91 2ku7 n THR 91 N 2.67 1.44 -3.85 2.92 -2.24 -0.44 -4.87 114.28 109.91 2ku7 n THR 91 Ca -0.17 0.18 -0.10 0.00 -2.27 0.00 0.00 64.05 61.68 2ku7 n THR 91 Cb 0.52 -2.36 -0.08 0.00 -2.10 0.00 0.00 70.33 66.31 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 -5.85 0.04 -0.19 3.42 1.01 -1.24 -5.04 116.67 108.82 2ku7 s ASP 92 Ca -0.19 -0.38 -0.01 0.00 0.71 0.00 0.00 52.55 52.69 2ku7 s ASP 92 Cb 0.03 0.28 0.01 0.00 1.01 0.00 0.00 42.92 44.25 2ku7 s ASP 92 CO 0.29 -0.55 -0.14 -0.63 0.21 0.00 0.00 175.17 174.35 2ku7 s ILE 93 N -2.54 2.57 -0.18 0.77 -1.09 -1.26 -1.40 121.20 118.07 2ku7 s ILE 93 Ca -0.05 -0.77 -0.03 0.00 -2.23 0.00 0.00 60.65 57.58 2ku7 s ILE 93 Cb -0.01 -2.12 -0.01 0.00 -1.58 0.00 0.00 42.46 38.73 2ku7 s ILE 93 CO -0.04 0.50 -0.07 -1.58 -1.23 0.00 0.00 174.94 172.51 2ku7 s GLN 94 N 1.35 3.43 -0.23 2.79 2.00 -0.71 -4.99 119.66 123.29 2ku7 s GLN 94 Ca 0.05 -0.63 0.00 0.00 -2.00 0.00 0.00 55.36 52.78 2ku7 s GLN 94 Cb -0.14 -2.86 0.06 0.00 0.80 0.00 0.00 33.01 30.88 2ku7 s GLN 94 CO -0.09 0.02 -0.03 0.42 -0.50 0.00 0.00 175.29 175.11 2ku7 s ILE 95 N 0.88 1.35 0.12 -2.34 1.09 -1.26 -0.21 121.20 120.83 2ku7 s ILE 95 Ca -0.02 -1.14 -0.31 0.00 -1.10 0.00 0.00 60.65 58.09 2ku7 s ILE 95 Cb -0.15 -1.68 -0.10 0.00 -1.06 0.00 0.00 42.46 39.48 2ku7 s ILE 95 CO 0.01 -0.15 1.73 -2.84 -0.10 0.00 0.00 174.94 173.58 2ku7 s PRO 96 N 1.47 4.16 -0.04 2.79 0.02 -1.26 -5.01 135.00 137.14 2ku7 s PRO 96 Ca -0.04 2.48 0.05 0.00 0.02 0.00 0.00 61.00 63.51 2ku7 s PRO 96 Cb -0.18 -3.49 -0.01 0.00 0.02 0.00 0.00 34.50 30.84 2ku7 s PRO 96 CO -0.07 -0.77 -0.18 -1.17 -0.33 0.00 0.00 177.00 174.47 2ku7 s LEU 97 N 2.36 1.97 0.09 -5.54 2.96 -1.26 -4.69 118.68 114.56 2ku7 s LEU 97 Ca 0.77 -0.37 -0.14 0.00 -0.22 0.00 0.00 54.13 54.17 2ku7 s LEU 97 Cb -0.44 -1.01 -0.06 0.00 0.50 0.00 0.00 46.19 45.17 2ku7 s LEU 97 CO 0.34 0.19 0.49 -1.81 -1.32 0.00 0.00 176.35 174.23 2ku7 s ASP 98 N -0.13 6.81 0.31 3.68 1.01 -1.26 -4.95 116.67 122.15 2ku7 s ASP 98 Ca -0.00 1.01 0.03 0.00 0.71 0.00 0.00 52.55 54.29 2ku7 s ASP 98 Cb -0.10 -2.26 0.52 0.00 1.01 0.00 0.00 42.92 42.08 2ku7 s ASP 98 CO 0.01 0.19 1.83 1.88 0.21 0.00 0.00 175.17 179.29 2ku7 h TYR 99 N 3.96 0.60 -0.02 4.23 0.05 -1.98 0.60 116.97 124.41 2ku7 h TYR 99 Ca -0.49 -0.07 -0.03 0.00 0.05 0.00 0.00 58.73 58.19 2ku7 h TYR 99 Cb 1.20 -0.17 0.00 0.00 1.01 0.00 0.00 36.73 38.77 2ku7 h TYR 99 CO 0.67 0.60 -0.09 1.49 -1.05 0.00 0.00 178.16 179.78 2ku7 h GLU 100 N 0.54 0.10 0.00 4.88 4.81 -2.02 -3.37 114.58 119.52 2ku7 h GLU 100 Ca 0.11 -0.08 -0.27 0.00 -0.13 0.00 0.00 59.36 58.99 2ku7 h GLU 100 Cb 0.40 0.02 -0.05 0.00 0.63 0.00 0.00 28.75 29.75 2ku7 h GLU 100 CO 0.02 0.73 -1.87 0.25 -0.73 0.00 0.00 179.01 177.40 2ku7 n THR 101 N -4.67 1.36 -1.84 0.32 -2.24 -1.23 -4.97 114.28 101.00 2ku7 n THR 101 Ca -0.09 -0.78 -0.13 0.00 -2.27 0.00 0.00 64.05 60.79 2ku7 n THR 101 Cb 0.37 -0.73 -0.03 0.00 -2.10 0.00 0.00 70.33 67.84 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 -2.87 -1.68 -4.16 -0.78 1.02 0.21 -4.95 120.64 107.43 2ku7 n GLU 102 Ca -0.20 0.70 -0.30 0.00 -0.02 0.00 0.00 57.16 57.34 2ku7 n GLU 102 Cb 1.01 -5.10 -0.08 0.00 -0.02 0.00 0.00 31.44 27.25 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 -3.94 2.53 0.14 3.49 1.02 -1.26 -4.90 119.74 116.82 2ku7 s LYS 103 Ca 0.00 -0.84 0.25 0.00 0.02 0.00 0.00 55.97 55.41 2ku7 s LYS 103 Cb 0.00 -2.53 0.57 0.00 -0.52 0.00 0.00 37.83 35.35 2ku7 s LYS 103 CO 0.00 0.54 1.53 -2.39 -0.92 0.00 0.00 175.35 174.11 2ku7 n HIS 104 N 0.66 0.64 -0.17 3.18 1.44 -1.26 -4.28 115.22 115.44 2ku7 n HIS 104 Ca -0.11 0.19 0.00 0.00 -2.01 0.00 0.00 57.72 55.78 2ku7 n HIS 104 Cb 0.52 -0.74 0.00 0.00 0.12 0.00 0.00 29.99 29.89 2ku7 n HIS 104 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 2ku7 n ARG 105 N -2.11 0.00 -0.05 -1.40 1.74 -1.26 -2.99 116.66 110.59 2ku7 n ARG 105 Ca 0.04 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.12 2ku7 n ARG 105 Cb 0.43 -3.20 0.00 0.00 -1.02 0.00 0.00 32.46 28.66 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 -2.00 1.34 3.10 -0.13 0.00 -1.26 -4.95 105.19 101.29 2ku7 n GLY 106 Ca 0.00 -0.04 -0.10 0.00 0.00 0.00 0.00 46.02 45.88 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 0.13 0.29 1.61 -0.12 -1.16 -0.50 117.98 116.22 2ku7 s PHE 107 Ca 0.00 -0.33 -0.20 0.00 -0.05 0.00 0.00 56.93 56.35 2ku7 s PHE 107 Cb 0.00 -0.10 0.02 0.00 -0.63 0.00 0.00 43.02 42.31 2ku7 s PHE 107 CO 0.00 -0.32 0.71 0.00 -0.05 0.00 0.00 175.22 175.57 2ku7 s ALA 108 N -1.96 -1.13 0.03 1.99 0.00 0.55 -4.67 121.76 116.57 2ku7 s ALA 108 Ca -0.10 -0.37 0.05 0.00 0.00 0.00 0.00 51.96 51.54 2ku7 s ALA 108 Cb -0.05 0.85 -0.03 0.00 0.00 0.00 0.00 23.12 23.88 2ku7 s ALA 108 CO -0.01 -1.03 -0.12 -0.06 0.00 0.00 0.00 175.76 174.54 2ku7 s PHE 109 N -3.79 2.72 -0.10 0.00 0.40 0.71 -0.50 117.98 117.42 2ku7 s PHE 109 Ca 0.12 -0.15 0.03 0.00 -0.60 0.00 0.00 56.93 56.33 2ku7 s PHE 109 Cb -0.06 -1.52 -0.01 0.00 0.51 0.00 0.00 43.02 41.94 2ku7 s PHE 109 CO 0.07 0.32 -0.20 0.54 0.70 0.00 0.00 175.22 176.66 2ku7 s VAL 110 N -0.99 2.47 -0.22 -0.44 0.11 0.23 -1.74 120.40 119.82 2ku7 s VAL 110 Ca 0.16 -0.88 -0.08 0.00 -2.93 0.00 0.00 61.98 58.25 2ku7 s VAL 110 Cb -0.11 -1.97 -0.04 0.00 -1.53 0.00 0.00 36.38 32.73 2ku7 s VAL 110 CO 0.07 0.55 0.08 -0.70 -3.33 0.00 0.00 175.10 171.77 2ku7 s GLU 111 N 0.20 3.85 -0.01 1.54 2.12 -0.50 -0.82 118.70 125.09 2ku7 s GLU 111 Ca -0.12 -0.39 0.04 0.00 0.36 0.00 0.00 54.97 54.86 2ku7 s GLU 111 Cb -0.16 -3.31 -0.03 0.00 0.26 0.00 0.00 34.13 30.88 2ku7 s GLU 111 CO 0.06 0.05 -0.10 -0.06 -0.54 0.00 0.00 175.26 174.67 2ku7 s PHE 112 N 1.01 2.81 0.21 5.30 0.08 -0.23 -1.33 117.98 125.83 2ku7 s PHE 112 Ca 0.05 -0.09 -0.03 0.00 0.12 0.00 0.00 56.93 56.97 2ku7 s PHE 112 Cb -0.14 -1.60 0.16 0.00 -0.57 0.00 0.00 43.02 40.87 2ku7 s PHE 112 CO 0.03 0.32 1.57 1.49 -0.10 0.00 0.00 175.22 178.53 2ku7 h GLU 113 N 4.76 0.65 -5.91 0.44 4.81 -1.81 -3.44 114.58 114.09 2ku7 h GLU 113 Ca -0.48 -0.33 -0.68 0.00 -0.13 0.00 0.00 59.36 57.74 2ku7 h GLU 113 Cb 1.16 0.00 -0.13 0.00 0.63 0.00 0.00 28.75 30.41 2ku7 h GLU 113 CO 0.52 0.93 -0.60 -0.51 -0.73 0.00 0.00 179.01 178.62 2ku7 s LEU 114 N -8.63 3.73 0.43 1.64 1.02 -1.26 -4.99 118.68 110.62 2ku7 s LEU 114 Ca -0.08 0.20 0.24 0.00 0.02 0.00 0.00 54.13 54.51 2ku7 s LEU 114 Cb 0.12 -1.87 0.67 0.00 0.02 0.00 0.00 46.19 45.14 2ku7 s LEU 114 CO 0.84 0.38 1.72 0.00 0.02 0.00 0.00 176.35 179.31 2ku7 h ALA 115 N 5.13 0.94 -0.02 4.21 0.00 -1.93 -3.12 119.26 124.46 2ku7 h ALA 115 Ca -0.52 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.22 2ku7 h ALA 115 Cb 1.20 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 2ku7 h ALA 115 CO 0.55 0.22 -0.03 1.49 0.00 0.00 0.00 179.25 181.48 2ku7 h GLU 116 N 0.00 0.06 -0.10 0.00 4.57 -1.97 -2.88 114.58 114.26 2ku7 h GLU 116 Ca -0.00 -0.03 -0.08 0.00 -1.18 0.00 0.00 59.36 58.06 2ku7 h GLU 116 Cb 0.90 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.48 2ku7 h GLU 116 CO 0.02 0.54 -0.32 0.38 -1.18 0.00 0.00 179.01 178.46 2ku7 h ASP 117 N -0.42 0.20 -0.39 1.04 3.04 -1.87 -2.51 116.42 115.51 2ku7 h ASP 117 Ca 0.00 -0.07 -0.03 0.00 -3.24 0.00 0.00 57.03 53.69 2ku7 h ASP 117 Cb 0.53 -0.05 -0.02 0.00 -1.04 0.00 0.00 39.33 38.75 2ku7 h ASP 117 CO 0.01 0.52 0.11 0.00 -2.04 0.00 0.00 179.24 177.83 2ku7 h ALA 118 N 1.50 0.51 0.00 4.15 0.00 -1.58 -1.06 119.26 122.78 2ku7 h ALA 118 Ca 0.02 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.70 2ku7 h ALA 118 Cb 0.66 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 2ku7 h ALA 118 CO 0.05 0.17 -0.25 0.00 0.00 0.00 0.00 179.25 179.21 2ku7 h ALA 119 N 0.96 1.45 -0.18 0.00 0.00 -1.38 -2.45 119.26 117.65 2ku7 h ALA 119 Ca 0.12 -0.23 -0.16 0.00 0.00 0.00 0.00 54.91 54.65 2ku7 h ALA 119 Cb 0.28 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2ku7 h ALA 119 CO -0.00 0.32 -0.54 0.00 0.00 0.00 0.00 179.25 179.03 2ku7 h ALA 120 N 1.75 0.73 -0.50 0.00 0.00 -0.99 -2.79 119.26 117.46 2ku7 h ALA 120 Ca -0.00 -0.51 -0.11 0.00 0.00 0.00 0.00 54.91 54.29 2ku7 h ALA 120 Cb 0.49 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 2ku7 h ALA 120 CO 0.03 0.69 -0.13 0.00 0.00 0.00 0.00 179.25 179.84 2ku7 h ALA 121 N 1.01 0.69 -0.24 0.00 0.00 -0.73 -1.52 119.26 118.46 2ku7 h ALA 121 Ca 0.01 -0.36 -0.16 0.00 0.00 0.00 0.00 54.91 54.40 2ku7 h ALA 121 Cb 1.07 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.68 2ku7 h ALA 121 CO 0.10 0.62 -0.51 0.82 0.00 0.00 0.00 179.25 180.27 2ku7 h ILE 122 N 0.83 1.30 0.00 0.00 2.04 -1.53 -2.35 117.51 117.80 2ku7 h ILE 122 Ca 0.13 -1.73 0.00 0.00 1.00 0.00 0.00 64.86 64.26 2ku7 h ILE 122 Cb 0.70 1.66 0.00 0.00 -0.74 0.00 0.00 36.82 38.44 2ku7 h ILE 122 CO 0.05 0.55 -0.26 -0.78 0.00 0.00 0.00 178.15 177.72 2ku7 h ASP 123 N 0.54 0.00 0.02 1.72 1.82 -1.49 -3.17 116.42 115.87 2ku7 h ASP 123 Ca 0.02 -0.02 -0.39 0.00 -0.39 0.00 0.00 57.03 56.25 2ku7 h ASP 123 Cb 1.08 0.00 -0.06 0.00 0.68 0.00 0.00 39.33 41.03 2ku7 h ASP 123 CO 0.10 0.01 -2.30 0.59 -1.61 0.00 0.00 179.24 176.04 2ku7 n ASN 124 N -2.79 1.99 -2.69 2.28 3.02 -0.58 -4.74 115.26 111.75 2ku7 n ASN 124 Ca 0.03 0.10 -0.17 0.00 -0.03 0.00 0.00 54.58 54.51 2ku7 n ASN 124 Cb 0.51 -0.65 0.01 0.00 -0.61 0.00 0.00 39.78 39.03 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 -3.67 2.01 -0.27 3.52 2.81 -0.89 -4.89 117.12 115.74 2ku7 n MET 125 Ca -0.44 -3.79 -0.07 0.00 -1.81 0.00 0.00 57.70 51.59 2ku7 n MET 125 Cb 0.94 -1.70 0.05 0.00 -0.71 0.00 0.00 33.22 31.81 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 2.87 1.08 -2.21 7.83 -1.24 -1.69 -3.37 115.58 118.85 2ku7 h ASN 126 Ca 0.07 -0.20 -0.56 0.00 0.71 0.00 0.00 56.30 56.32 2ku7 h ASN 126 Cb 1.02 -0.28 -0.37 0.00 0.73 0.00 0.00 38.32 39.42 2ku7 h ASN 126 CO 0.64 1.00 -0.97 -0.62 -1.29 0.00 0.00 177.43 176.18 2ku7 n GLU 127 N -4.27 0.29 -4.49 6.67 1.02 -1.24 -0.95 120.64 117.68 2ku7 n GLU 127 Ca 0.06 -3.10 -0.24 0.00 -0.02 0.00 0.00 57.16 53.86 2ku7 n GLU 127 Cb 0.22 -1.58 -0.10 0.00 -0.02 0.00 0.00 31.44 29.96 2ku7 n GLU 127 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2ku7 s SER 128 N -0.12 3.36 -0.28 1.62 1.04 -1.13 -4.89 113.70 113.31 2ku7 s SER 128 Ca 0.33 -1.17 -0.19 0.00 0.48 0.00 0.00 55.95 55.41 2ku7 s SER 128 Cb 0.06 -0.28 -0.02 0.00 0.10 0.00 0.00 66.02 65.88 2ku7 s SER 128 CO -0.18 -0.21 0.56 -0.70 0.98 0.00 0.00 173.24 173.69 2ku7 s GLU 129 N -3.63 4.00 -0.05 4.02 2.12 -1.26 -0.25 118.70 123.64 2ku7 s GLU 129 Ca 0.31 0.32 0.02 0.00 0.36 0.00 0.00 54.97 55.98 2ku7 s GLU 129 Cb 0.02 -3.68 0.01 0.00 0.26 0.00 0.00 34.13 30.74 2ku7 s GLU 129 CO 0.14 -0.44 -0.09 -1.17 -0.54 0.00 0.00 175.26 173.16 2ku7 s LEU 130 N 2.43 1.57 -1.00 2.70 2.96 0.14 -4.77 118.68 122.70 2ku7 s LEU 130 Ca 0.23 -0.22 0.00 0.00 -0.22 0.00 0.00 54.13 53.91 2ku7 s LEU 130 Cb -0.15 -0.66 0.00 0.00 0.50 0.00 0.00 46.19 45.88 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 3.80 0.00 -0.19 5.38 7.35 -1.26 -1.45 117.46 131.09 2ku7 n PHE 131 Ca -0.23 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.46 2ku7 n PHE 131 Cb 0.52 -2.46 0.00 0.00 0.35 0.00 0.00 39.48 37.88 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 -0.11 0.70 3.31 7.13 0.00 -1.26 -4.95 105.19 110.01 2ku7 n GLY 132 Ca -0.09 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.71 2ku7 n GLY 132 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ku7 s ARG 133 N -0.81 1.20 0.05 1.61 0.52 -0.53 -5.11 118.95 115.87 2ku7 s ARG 133 Ca 0.00 -1.34 -0.28 0.00 -0.52 0.00 0.00 55.73 53.59 2ku7 s ARG 133 Cb 0.00 -1.24 -0.05 0.00 0.52 0.00 0.00 34.95 34.19 2ku7 s ARG 133 CO 0.00 0.25 0.87 0.99 0.02 0.00 0.00 175.30 177.44 2ku7 s THR 134 N -1.97 4.70 0.18 0.02 2.01 -1.26 0.25 115.64 119.57 2ku7 s THR 134 Ca 0.13 1.86 0.10 0.00 0.31 0.00 0.00 61.69 64.09 2ku7 s THR 134 Cb -0.06 -4.23 -0.04 0.00 0.01 0.00 0.00 72.50 68.18 2ku7 s THR 134 CO 0.05 0.30 -0.15 0.27 -0.69 0.00 0.00 174.62 174.40 2ku7 s ILE 135 N 0.26 2.88 -0.07 1.82 -4.36 0.65 -4.37 121.20 118.00 2ku7 s ILE 135 Ca 0.44 -1.76 0.03 0.00 -0.26 0.00 0.00 60.65 59.10 2ku7 s ILE 135 Cb -0.21 -2.40 0.01 0.00 1.25 0.00 0.00 42.46 41.10 2ku7 s ILE 135 CO 0.26 -0.08 -0.16 -0.60 0.24 0.00 0.00 174.94 174.59 2ku7 s ARG 136 N -2.69 2.11 -0.02 0.37 6.06 0.73 -2.86 118.95 122.65 2ku7 s ARG 136 Ca 0.23 -0.57 0.03 0.00 -2.50 0.00 0.00 55.73 52.92 2ku7 s ARG 136 Cb -0.09 -1.69 -0.00 0.00 0.06 0.00 0.00 34.95 33.23 2ku7 s ARG 136 CO 0.13 0.10 -0.13 0.14 -2.50 0.00 0.00 175.30 173.04 2ku7 s VAL 137 N 0.49 1.04 0.26 7.11 -7.23 -0.12 -0.93 120.40 121.01 2ku7 s VAL 137 Ca -0.15 -0.52 -0.08 0.00 -1.81 0.00 0.00 61.98 59.42 2ku7 s VAL 137 Cb -0.16 -0.89 -0.01 0.00 0.56 0.00 0.00 36.38 35.88 2ku7 s VAL 137 CO 0.05 0.30 0.42 0.54 -0.31 0.00 0.00 175.10 176.10 2ku7 s ASN 138 N -0.03 0.17 0.04 4.85 4.22 -0.70 -4.74 114.94 118.75 2ku7 s ASN 138 Ca -0.00 -1.14 -0.30 0.00 -2.14 0.00 0.00 52.86 49.28 2ku7 s ASN 138 Cb -0.08 0.57 -0.06 0.00 1.28 0.00 0.00 41.25 42.95 2ku7 s ASN 138 CO 0.01 -1.13 1.43 -0.22 -2.04 0.00 0.00 177.10 175.15 2ku7 s LEU 139 N -3.09 4.34 0.00 3.54 0.20 -1.26 0.45 118.68 122.85 2ku7 s LEU 139 Ca 0.27 2.21 0.16 0.00 0.69 0.00 0.00 54.13 57.46 2ku7 s LEU 139 Cb 0.01 -3.57 0.13 0.00 -0.43 0.00 0.00 46.19 42.33 2ku7 s LEU 139 CO 0.12 -0.72 1.02 0.00 -0.29 0.00 0.00 176.35 176.48