#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 3.61 0.19 1.43 1.00 -1.26 -5.11 119.30 119.16 2ku7 s MET 2 Ca 0.00 -0.20 0.10 0.00 0.00 0.00 0.00 55.69 55.60 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 0.62 -0.21 -1.64 0.00 0.00 0.00 175.02 173.79 2ku7 s MET 3 N -0.58 1.42 0.08 2.03 1.00 -1.26 -5.15 119.30 116.84 2ku7 s MET 3 Ca 0.12 -1.49 0.04 0.00 0.00 0.00 0.00 55.69 54.36 2ku7 s MET 3 Cb -0.12 -1.59 -0.04 0.00 0.00 0.00 0.00 34.83 33.08 2ku7 s MET 3 CO 0.02 0.33 0.05 -0.65 0.00 0.00 0.00 175.02 174.77 2ku7 s GLN 4 N -2.80 2.76 0.18 2.03 -0.21 -1.26 -5.04 119.66 115.32 2ku7 s GLN 4 Ca 0.19 -0.74 -0.04 0.00 0.02 0.00 0.00 55.36 54.79 2ku7 s GLN 4 Cb -0.07 -2.66 0.08 0.00 1.00 0.00 0.00 33.01 31.37 2ku7 s GLN 4 CO 0.09 0.56 1.49 0.00 -2.12 0.00 0.00 175.29 175.30 2ku7 n GLY 6 N 0.29 -1.83 0.24 0.00 0.00 -1.26 -4.50 105.19 98.13 2ku7 n GLY 6 Ca -0.03 -1.83 0.02 0.00 0.00 0.00 0.00 46.02 44.18 2ku7 n GLY 6 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ku7 h LYS 7 N 0.00 0.24 -5.77 1.61 6.56 -2.08 -3.42 116.57 113.71 2ku7 h LYS 7 Ca 0.00 -0.06 -0.57 0.00 -1.06 0.00 0.00 60.65 58.96 2ku7 h LYS 7 Cb 0.00 -0.03 -0.08 0.00 -0.57 0.00 0.00 32.23 31.55 2ku7 h LYS 7 CO 0.00 0.39 -0.11 0.00 -2.06 0.00 0.00 179.45 177.67 2ku7 s ASP 9 N 0.63 7.16 0.00 0.00 1.01 -1.26 -4.95 116.67 119.26 2ku7 s ASP 9 Ca 0.27 1.47 0.25 0.00 0.71 0.00 0.00 52.55 55.25 2ku7 s ASP 9 Cb -0.15 -2.44 0.68 0.00 1.01 0.00 0.00 42.92 42.02 2ku7 s ASP 9 CO 0.11 0.11 1.53 -1.14 0.21 0.00 0.00 175.17 176.00 2ku7 n ARG 10 N 1.09 1.96 -3.62 8.23 0.63 -1.26 -4.91 116.66 118.77 2ku7 n ARG 10 Ca -0.04 -1.41 -0.37 0.00 -0.92 0.00 0.00 57.85 55.10 2ku7 n ARG 10 Cb 0.50 -1.46 -0.06 0.00 0.45 0.00 0.00 32.46 31.89 2ku7 n ARG 10 CO 0.00 0.00 0.00 -1.58 -2.51 0.00 0.00 177.63 173.54 2ku7 s TRP 11 N -1.88 3.68 0.06 -0.14 0.52 -1.26 -5.10 118.94 114.82 2ku7 s TRP 11 Ca 0.34 0.84 0.05 0.00 0.02 0.00 0.00 56.10 57.35 2ku7 s TRP 11 Cb 0.20 -2.17 -0.03 0.00 -1.15 0.00 0.00 33.47 30.32 2ku7 s TRP 11 CO 0.31 0.66 -0.13 0.14 0.02 0.00 0.00 176.95 177.95 2ku7 s VAL 12 N -1.09 1.04 0.40 4.03 -7.23 -1.26 -5.05 120.40 111.23 2ku7 s VAL 12 Ca 0.22 -1.23 0.17 0.00 -1.81 0.00 0.00 61.98 59.33 2ku7 s VAL 12 Cb -0.15 -1.00 0.18 0.00 0.56 0.00 0.00 36.38 35.96 2ku7 s VAL 12 CO 0.11 -0.21 1.95 0.45 -0.31 0.00 0.00 175.10 177.08 2ku7 h HIS 13 N 4.41 0.00 -0.77 2.82 3.86 -2.02 -3.12 115.15 120.33 2ku7 h HIS 13 Ca -0.40 0.00 0.03 0.00 -1.16 0.00 0.00 60.37 58.84 2ku7 h HIS 13 Cb 1.19 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 29.62 2ku7 h HIS 13 CO 0.62 0.24 0.51 1.03 0.86 0.00 0.00 177.93 181.18 2ku7 h SER 14 N 0.00 0.83 -0.41 2.45 0.87 -2.00 -2.61 113.55 112.68 2ku7 h SER 14 Ca -0.00 -0.01 -0.05 0.00 -1.23 0.00 0.00 61.79 60.50 2ku7 h SER 14 Cb 0.46 -0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 62.20 2ku7 h SER 14 CO 0.03 0.58 0.10 0.11 -0.53 0.00 0.00 176.83 177.12 2ku7 h LYS 15 N 0.97 0.73 -0.10 2.24 1.57 -1.99 -2.92 116.57 117.06 2ku7 h LYS 15 Ca 0.30 -0.15 -0.17 0.00 -1.87 0.00 0.00 60.65 58.77 2ku7 h LYS 15 Cb 0.01 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.20 2ku7 h LYS 15 CO -0.08 0.68 -0.65 0.00 -0.57 0.00 0.00 179.45 178.82 2ku7 h GLU 17 N 0.28 0.00 -0.76 0.00 4.81 -1.32 -3.10 114.58 114.49 2ku7 h GLU 17 Ca -0.02 0.00 0.06 0.00 -0.13 0.00 0.00 59.36 59.28 2ku7 h GLU 17 Cb 1.20 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.53 2ku7 h GLU 17 CO 0.11 0.22 0.50 -0.91 -0.73 0.00 0.00 179.01 178.20 2ku7 h ASN 18 N 0.00 0.71 -2.76 1.04 2.35 -1.52 -3.42 115.58 111.98 2ku7 h ASN 18 Ca -0.00 0.00 -0.58 0.00 -0.55 0.00 0.00 56.30 55.17 2ku7 h ASN 18 Cb 0.49 -0.15 -0.04 0.00 0.05 0.00 0.00 38.32 38.68 2ku7 h ASN 18 CO 0.03 0.46 -0.49 -0.76 -1.65 0.00 0.00 177.43 175.01 2ku7 s LEU 19 N -9.76 4.29 0.37 1.61 1.43 -1.17 -5.12 118.68 110.34 2ku7 s LEU 19 Ca -0.10 0.19 -0.04 0.00 -1.03 0.00 0.00 54.13 53.15 2ku7 s LEU 19 Cb 0.19 -2.89 -0.04 0.00 0.03 0.00 0.00 46.19 43.49 2ku7 s LEU 19 CO 0.78 0.11 0.64 -0.44 0.23 0.00 0.00 176.35 177.67 2ku7 s SER 20 N -2.85 6.36 0.36 2.29 0.01 -1.26 -4.98 113.70 113.63 2ku7 s SER 20 Ca 0.34 0.74 0.03 0.00 1.31 0.00 0.00 55.95 58.38 2ku7 s SER 20 Cb -0.12 -2.16 0.67 0.00 0.21 0.00 0.00 66.02 64.62 2ku7 s SER 20 CO 0.28 -0.36 2.00 0.44 0.41 0.00 0.00 173.24 176.01 2ku7 h ASP 21 N 0.95 0.65 -0.11 2.44 3.32 -1.97 -1.84 116.42 119.85 2ku7 h ASP 21 Ca -0.48 -0.03 -0.08 0.00 0.02 0.00 0.00 57.03 56.45 2ku7 h ASP 21 Cb 1.20 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.59 2ku7 h ASP 21 CO 0.63 0.50 -0.26 1.05 -1.72 0.00 0.00 179.24 179.44 2ku7 h GLU 22 N 0.75 0.37 -0.50 3.56 4.11 -2.00 -2.80 114.58 118.07 2ku7 h GLU 22 Ca 0.20 -0.25 -0.09 0.00 0.07 0.00 0.00 59.36 59.29 2ku7 h GLU 22 Cb -0.03 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 2ku7 h GLU 22 CO -0.04 0.86 -0.04 1.98 0.07 0.00 0.00 179.01 181.84 2ku7 h MET 23 N -0.06 0.87 -0.58 1.06 4.05 -1.94 -2.52 114.93 115.80 2ku7 h MET 23 Ca -0.00 -0.27 -0.08 0.00 -0.28 0.00 0.00 59.70 59.07 2ku7 h MET 23 Cb 0.86 -0.08 -0.02 0.00 -0.80 0.00 0.00 31.60 31.56 2ku7 h MET 23 CO 0.06 0.89 0.04 -0.92 0.23 0.00 0.00 176.91 177.21 2ku7 h TYR 24 N 0.80 1.08 -0.37 1.39 3.20 -1.40 -2.79 116.97 118.88 2ku7 h TYR 24 Ca 0.14 -0.17 -0.14 0.00 3.14 0.00 0.00 58.73 61.70 2ku7 h TYR 24 Cb 0.54 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 38.51 2ku7 h TYR 24 CO 0.03 0.95 -0.34 0.93 -1.64 0.00 0.00 178.16 178.10 2ku7 h GLU 25 N 0.89 0.84 0.13 1.82 4.39 -1.39 -1.76 114.58 119.50 2ku7 h GLU 25 Ca 0.17 -0.41 -0.01 0.00 0.34 0.00 0.00 59.36 59.46 2ku7 h GLU 25 Cb 0.50 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.15 2ku7 h GLU 25 CO 0.02 1.04 -0.06 0.82 -1.16 0.00 0.00 179.01 179.67 2ku7 h ILE 26 N 0.70 1.00 -0.37 3.13 2.04 -1.43 -1.09 117.51 121.49 2ku7 h ILE 26 Ca 0.07 -0.53 -0.16 0.00 1.00 0.00 0.00 64.86 65.24 2ku7 h ILE 26 Cb 0.89 1.33 -0.01 0.00 -0.74 0.00 0.00 36.82 38.30 2ku7 h ILE 26 CO 0.08 0.13 -0.40 -0.07 0.00 0.00 0.00 178.15 177.89 2ku7 h LEU 27 N -0.42 0.98 -0.76 1.44 3.38 -1.57 -3.02 115.31 115.34 2ku7 h LEU 27 Ca -0.02 -0.46 -0.11 0.00 0.09 0.00 0.00 57.88 57.38 2ku7 h LEU 27 Cb 0.34 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 2ku7 h LEU 27 CO 0.03 1.25 -0.29 0.28 0.09 0.00 0.00 178.44 179.80 2ku7 h SER 28 N 0.74 0.63 -2.04 -0.43 0.02 -1.37 -3.16 113.55 107.94 2ku7 h SER 28 Ca 0.06 -0.24 -0.73 0.00 -0.84 0.00 0.00 61.79 60.03 2ku7 h SER 28 Cb 0.99 -0.17 -0.31 0.00 0.14 0.00 0.00 62.40 63.05 2ku7 h SER 28 CO 0.10 0.89 0.57 0.59 -1.14 0.00 0.00 176.83 177.84 2ku7 n ASN 29 N -4.09 6.68 -4.33 3.07 3.02 -0.41 -4.97 115.26 114.23 2ku7 n ASN 29 Ca -0.01 -3.76 -0.46 0.00 -0.03 0.00 0.00 54.58 50.33 2ku7 n ASN 29 Cb 0.45 -0.94 -0.04 0.00 -0.61 0.00 0.00 39.78 38.63 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 -4.00 6.12 0.09 3.41 1.98 -1.14 -4.84 118.68 120.29 2ku7 s LEU 30 Ca 0.47 -1.87 -0.31 0.00 -2.89 0.00 0.00 54.13 49.53 2ku7 s LEU 30 Cb 0.34 -2.23 -0.07 0.00 0.66 0.00 0.00 46.19 44.89 2ku7 s LEU 30 CO -0.26 -0.86 1.28 -2.84 -1.89 0.00 0.00 176.35 171.77 2ku7 s PRO 31 N 1.59 4.39 0.44 0.98 0.02 -1.26 -4.93 135.00 136.23 2ku7 s PRO 31 Ca 0.07 1.90 0.22 0.00 0.02 0.00 0.00 61.00 63.21 2ku7 s PRO 31 Cb -0.25 -3.30 1.20 0.00 0.02 0.00 0.00 34.50 32.16 2ku7 s PRO 31 CO 0.01 -0.32 1.84 0.93 -0.33 0.00 0.00 177.00 179.13 2ku7 h GLU 32 N 6.72 0.29 0.21 5.54 5.08 -1.98 -1.08 114.58 129.35 2ku7 h GLU 32 Ca -0.42 -0.02 -0.33 0.00 -1.00 0.00 0.00 59.36 57.60 2ku7 h GLU 32 Cb 1.21 -0.07 0.02 0.00 0.50 0.00 0.00 28.75 30.42 2ku7 h GLU 32 CO 0.83 0.19 -1.54 0.77 -1.00 0.00 0.00 179.01 178.26 2ku7 h SER 33 N 0.30 0.69 0.14 1.42 0.02 -1.92 -3.35 113.55 110.84 2ku7 h SER 33 Ca 0.50 -0.93 -0.08 0.00 -0.84 0.00 0.00 61.79 60.44 2ku7 h SER 33 Cb 1.42 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 63.73 2ku7 h SER 33 CO -0.16 1.71 -0.27 0.58 -1.14 0.00 0.00 176.83 177.55 2ku7 h VAL 34 N 0.05 1.24 -0.07 2.27 2.07 -1.64 -2.63 116.25 117.54 2ku7 h VAL 34 Ca -0.29 -1.15 -0.06 0.00 0.82 0.00 0.00 66.70 66.02 2ku7 h VAL 34 Cb 2.06 1.46 -0.01 0.00 -1.52 0.00 0.00 31.29 33.28 2ku7 h VAL 34 CO 0.21 0.35 -0.25 0.00 0.02 0.00 0.00 177.57 177.89 2ku7 h ALA 35 N 1.53 1.45 -2.59 1.67 0.00 -1.41 -3.43 119.26 116.47 2ku7 h ALA 35 Ca 0.03 -0.27 -0.11 0.00 0.00 0.00 0.00 54.91 54.57 2ku7 h ALA 35 Cb 0.59 -0.07 -0.27 0.00 0.00 0.00 0.00 17.79 18.05 2ku7 h ALA 35 CO 0.04 0.39 -0.32 1.52 0.00 0.00 0.00 179.25 180.89 2ku7 s TYR 36 N -4.47 -0.67 0.13 0.00 -0.85 -0.99 -5.10 117.35 105.40 2ku7 s TYR 36 Ca -0.04 1.38 0.07 0.00 -0.52 0.00 0.00 57.07 57.96 2ku7 s TYR 36 Cb 0.15 0.28 -0.04 0.00 0.38 0.00 0.00 41.96 42.73 2ku7 s TYR 36 CO 0.73 -0.39 -0.16 0.95 -1.52 0.00 0.00 175.55 175.16 2ku7 s THR 37 N 1.82 1.51 0.00 -3.49 -4.23 -1.25 -4.65 115.64 105.35 2ku7 s THR 37 Ca -0.07 -1.75 0.00 0.00 -1.18 0.00 0.00 61.69 58.69 2ku7 s THR 37 Cb -0.10 -1.61 0.00 0.00 1.34 0.00 0.00 72.50 72.13 2ku7 s THR 37 CO -0.13 -0.34 0.00 0.00 -0.54 0.00 0.00 174.62 173.61 2ku7 s VAL 39 N -1.71 1.92 0.34 0.00 1.01 -1.26 -5.14 120.40 115.57 2ku7 s VAL 39 Ca 0.00 -1.25 -0.13 0.00 0.00 0.00 0.00 61.98 60.60 2ku7 s VAL 39 Cb 0.00 -1.64 -0.08 0.00 0.00 0.00 0.00 36.38 34.65 2ku7 s VAL 39 CO 0.00 0.35 0.74 0.20 0.00 0.00 0.00 175.10 176.39 2ku7 s ASN 40 N -1.08 6.69 -0.04 3.32 0.01 -1.26 -5.09 114.94 117.49 2ku7 s ASN 40 Ca 0.10 1.23 0.07 0.00 -0.71 0.00 0.00 52.86 53.54 2ku7 s ASN 40 Cb -0.09 -2.35 -0.01 0.00 0.41 0.00 0.00 41.25 39.20 2ku7 s ASN 40 CO 0.01 -0.26 -0.24 0.00 -1.51 0.00 0.00 177.10 175.10 2ku7 n THR 42 N 2.78 5.28 -1.89 0.00 -2.24 -1.26 -5.03 114.28 111.92 2ku7 n THR 42 Ca -0.17 -5.49 -0.41 0.00 -2.27 0.00 0.00 64.05 55.71 2ku7 n THR 42 Cb 0.52 -1.45 -0.01 0.00 -2.10 0.00 0.00 70.33 67.28 2ku7 n THR 42 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2ku7 s GLU 43 N -4.23 4.18 0.25 -0.78 2.02 -1.26 -4.94 118.70 113.95 2ku7 s GLU 43 Ca 0.43 2.47 0.03 0.00 0.02 0.00 0.00 54.97 57.91 2ku7 s GLU 43 Cb 0.27 -3.01 0.32 0.00 0.10 0.00 0.00 34.13 31.81 2ku7 s GLU 43 CO -0.21 -0.44 1.63 0.00 0.02 0.00 0.00 175.26 176.25 2ku7 h ARG 44 N 3.36 0.37 -5.74 1.61 3.08 -2.08 -3.43 114.38 111.55 2ku7 h ARG 44 Ca -0.50 -0.19 -0.66 0.00 0.07 0.00 0.00 59.98 58.70 2ku7 h ARG 44 Cb 1.23 0.01 -0.15 0.00 0.08 0.00 0.00 29.97 31.14 2ku7 h ARG 44 CO 0.66 0.75 -0.59 -1.01 -1.07 0.00 0.00 179.97 178.71 2ku7 s HIS 45 N -4.11 3.23 0.11 3.04 3.76 -1.26 -5.12 115.29 114.94 2ku7 s HIS 45 Ca -0.06 0.17 0.05 0.00 -0.15 0.00 0.00 55.06 55.08 2ku7 s HIS 45 Cb 0.13 -1.88 -0.04 0.00 1.11 0.00 0.00 32.58 31.90 2ku7 s HIS 45 CO 0.80 0.40 -0.12 0.14 -0.85 0.00 0.00 174.74 175.11 2ku7 s VAL 46 N -0.56 1.17 0.19 -0.90 -7.23 -1.26 -5.17 120.40 106.65 2ku7 s VAL 46 Ca 0.10 -1.67 0.05 0.00 -1.81 0.00 0.00 61.98 58.65 2ku7 s VAL 46 Cb -0.12 -1.44 -0.04 0.00 0.56 0.00 0.00 36.38 35.34 2ku7 s VAL 46 CO 0.02 -0.46 0.20 1.51 -0.31 0.00 0.00 175.10 176.06 2ku7 s ASP 47 N -2.42 5.75 0.00 4.85 1.47 -1.26 -5.12 116.67 119.94 2ku7 s ASP 47 Ca 0.07 -0.09 0.00 0.00 1.18 0.00 0.00 52.55 53.71 2ku7 s ASP 47 Cb -0.04 -1.56 0.00 0.00 -0.34 0.00 0.00 42.92 40.98 2ku7 s ASP 47 CO 0.02 0.02 0.00 0.61 0.68 0.00 0.00 175.17 176.50 2ku7 n GLY 48 N -0.71 1.32 2.67 2.12 0.00 -1.26 -5.13 105.19 104.20 2ku7 n GLY 48 Ca -0.08 0.19 -0.03 0.00 0.00 0.00 0.00 46.02 46.09 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 -0.05 -1.76 3.33 -0.02 0.00 -1.26 -5.17 105.19 100.27 2ku7 n GLY 49 Ca 0.00 1.31 -0.27 0.00 0.00 0.00 0.00 46.02 47.06 2ku7 n GLY 49 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ku7 s SER 50 N 0.90 2.97 0.36 1.61 0.01 -1.26 -5.14 113.70 113.15 2ku7 s SER 50 Ca 0.23 -0.67 -0.16 0.00 1.31 0.00 0.00 55.95 56.66 2ku7 s SER 50 Cb 0.14 -0.21 0.06 0.00 0.21 0.00 0.00 66.02 66.21 2ku7 s SER 50 CO -0.11 0.16 0.81 -0.83 0.41 0.00 0.00 173.24 173.69 2ku7 s GLY 51 N -1.71 0.33 0.00 3.44 0.00 -1.26 -5.15 107.32 102.96 2ku7 s GLY 51 Ca 0.11 -0.70 0.00 0.00 0.00 0.00 0.00 44.72 44.13 2ku7 s GLY 51 CO 0.04 -0.04 0.00 0.61 0.00 0.00 0.00 173.10 173.71 2ku7 n GLY 52 N -0.54 -0.01 0.28 0.20 0.00 -1.26 -4.93 105.19 98.92 2ku7 n GLY 52 Ca -0.08 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.40 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 0.00 0.49 -3.96 1.61 0.02 -2.02 -3.45 113.55 106.24 2ku7 h SER 53 Ca 0.00 -0.08 -0.37 0.00 -0.84 0.00 0.00 61.79 60.50 2ku7 h SER 53 Cb 0.00 -0.13 -0.14 0.00 0.14 0.00 0.00 62.40 62.27 2ku7 h SER 53 CO 0.00 0.53 -0.65 -0.83 -1.14 0.00 0.00 176.83 174.74 2ku7 s GLY 54 N -3.82 1.57 -0.16 -3.77 0.00 -1.26 -5.09 107.32 94.79 2ku7 s GLY 54 Ca -0.08 -1.78 -0.22 0.00 0.00 0.00 0.00 44.72 42.65 2ku7 s GLY 54 CO 0.76 -1.65 0.45 -1.33 0.00 0.00 0.00 173.10 171.33 2ku7 h GLY 55 N 2.46 0.08 -3.42 0.20 0.00 -1.98 -3.48 103.07 96.94 2ku7 h GLY 55 Ca -0.38 -0.20 -0.61 0.00 0.00 0.00 0.00 47.33 46.14 2ku7 h GLY 55 CO 0.64 0.17 -0.82 -1.35 0.00 0.00 0.00 176.54 175.19 2ku7 s SER 56 N -6.74 3.10 0.36 0.19 1.04 -1.26 -5.06 113.70 105.34 2ku7 s SER 56 Ca -0.24 -0.83 -0.13 0.00 0.48 0.00 0.00 55.95 55.23 2ku7 s SER 56 Cb 0.03 -0.21 0.05 0.00 0.10 0.00 0.00 66.02 65.99 2ku7 s SER 56 CO 0.67 0.08 0.72 0.61 0.98 0.00 0.00 173.24 176.29 2ku7 n GLY 57 N 0.44 1.13 3.48 7.32 0.00 -1.26 -5.14 105.19 111.16 2ku7 n GLY 57 Ca -0.14 -1.26 -0.42 0.00 0.00 0.00 0.00 46.02 44.19 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 -2.93 1.98 0.43 -0.02 0.00 -1.26 -4.94 107.32 100.58 2ku7 s GLY 58 Ca 0.16 -1.61 0.23 0.00 0.00 0.00 0.00 44.72 43.50 2ku7 s GLY 58 CO 0.12 0.95 1.64 1.48 0.00 0.00 0.00 173.10 177.28 2ku7 h SER 59 N 8.62 0.00 -0.20 1.64 4.64 -1.99 -3.27 113.55 122.99 2ku7 h SER 59 Ca -0.28 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 60.91 2ku7 h SER 59 Cb 1.12 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.20 2ku7 h SER 59 CO 0.73 0.10 -0.33 0.00 -0.87 0.00 0.00 176.83 176.46 2ku7 h ALA 60 N 1.90 0.82 0.00 5.18 0.00 -1.92 0.13 119.26 125.36 2ku7 h ALA 60 Ca -0.00 -0.41 -0.12 0.00 0.00 0.00 0.00 54.91 54.37 2ku7 h ALA 60 Cb 0.99 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 2ku7 h ALA 60 CO 0.01 0.64 -0.58 1.79 0.00 0.00 0.00 179.25 181.11 2ku7 h THR 61 N 0.59 1.02 0.07 0.00 1.35 -1.89 -3.36 112.91 110.71 2ku7 h THR 61 Ca 0.06 -2.40 -0.29 0.00 -0.55 0.00 0.00 66.41 63.24 2ku7 h THR 61 Cb 0.85 2.47 -0.02 0.00 -1.73 0.00 0.00 68.15 69.72 2ku7 h THR 61 CO 0.07 0.57 -1.54 0.74 -0.25 0.00 0.00 175.52 175.11 2ku7 h THR 62 N 0.00 0.86 -3.29 6.82 2.02 -1.60 -3.47 112.91 114.25 2ku7 h THR 62 Ca -0.01 -2.30 -0.59 0.00 0.77 0.00 0.00 66.41 64.29 2ku7 h THR 62 Cb 1.43 2.47 -0.10 0.00 -1.74 0.00 0.00 68.15 70.20 2ku7 h THR 62 CO 0.08 0.63 -0.33 -0.54 0.37 0.00 0.00 175.52 175.72 2ku7 s LYS 63 N -2.46 4.25 0.00 6.66 1.02 0.45 -4.96 119.74 124.70 2ku7 s LYS 63 Ca -0.24 0.08 0.08 0.00 0.02 0.00 0.00 55.97 55.91 2ku7 s LYS 63 Cb 0.06 -3.43 0.16 0.00 -0.52 0.00 0.00 37.83 34.10 2ku7 s LYS 63 CO 0.70 0.24 1.02 0.54 -0.92 0.00 0.00 175.35 176.93 2ku7 n ARG 64 N 3.58 1.86 -4.19 1.68 1.74 -1.26 -4.60 116.66 115.47 2ku7 n ARG 64 Ca -0.12 -1.55 -0.35 0.00 -0.77 0.00 0.00 57.85 55.06 2ku7 n ARG 64 Cb 0.52 -1.18 -0.09 0.00 -1.02 0.00 0.00 32.46 30.69 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 -0.87 4.63 0.18 1.55 1.01 -1.26 -1.30 120.40 124.34 2ku7 s VAL 65 Ca 0.14 -0.11 0.09 0.00 0.00 0.00 0.00 61.98 62.10 2ku7 s VAL 65 Cb 0.08 -3.00 -0.04 0.00 0.00 0.00 0.00 36.38 33.41 2ku7 s VAL 65 CO 0.11 0.56 -0.19 -0.76 0.00 0.00 0.00 175.10 174.82 2ku7 s LEU 66 N -0.49 2.46 -0.06 3.92 1.43 0.71 -0.15 118.68 126.49 2ku7 s LEU 66 Ca 0.10 -0.89 -0.16 0.00 -1.03 0.00 0.00 54.13 52.14 2ku7 s LEU 66 Cb -0.12 -0.89 -0.05 0.00 0.03 0.00 0.00 46.19 45.16 2ku7 s LEU 66 CO 0.02 -0.02 0.44 -0.47 0.23 0.00 0.00 176.35 176.55 2ku7 s TYR 67 N -2.12 3.62 -0.13 0.29 5.04 0.32 -0.35 117.35 124.01 2ku7 s TYR 67 Ca 0.19 0.93 -0.02 0.00 -2.44 0.00 0.00 57.07 55.72 2ku7 s TYR 67 Cb -0.06 -2.42 0.04 0.00 0.35 0.00 0.00 41.96 39.88 2ku7 s TYR 67 CO 0.08 0.40 0.01 0.14 -1.34 0.00 0.00 175.55 174.84 2ku7 s VAL 68 N -0.21 0.49 0.07 3.14 -7.23 0.05 -2.36 120.40 114.36 2ku7 s VAL 68 Ca 0.24 -0.24 0.04 0.00 -1.81 0.00 0.00 61.98 60.21 2ku7 s VAL 68 Cb -0.16 -0.81 -0.03 0.00 0.56 0.00 0.00 36.38 35.94 2ku7 s VAL 68 CO 0.11 0.04 -0.11 -0.83 -0.31 0.00 0.00 175.10 174.01 2ku7 s GLY 69 N 1.90 0.75 0.00 2.32 0.00 -0.92 -0.21 107.32 111.16 2ku7 s GLY 69 Ca 0.02 -1.01 0.00 0.00 0.00 0.00 0.00 44.72 43.73 2ku7 s GLY 69 CO -0.07 -1.07 0.00 0.61 0.00 0.00 0.00 173.10 172.57 2ku7 n GLY 70 N 1.02 1.48 3.95 0.20 0.00 0.65 -1.66 105.19 110.83 2ku7 n GLY 70 Ca -0.19 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.59 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 3.56 0.33 0.99 1.02 -0.05 -4.52 118.68 120.00 2ku7 s LEU 71 Ca 0.00 0.35 -0.05 0.00 0.02 0.00 0.00 54.13 54.44 2ku7 s LEU 71 Cb 0.00 -3.22 -0.05 0.00 0.02 0.00 0.00 46.19 42.94 2ku7 s LEU 71 CO 0.00 -0.78 0.61 0.00 0.02 0.00 0.00 176.35 176.19 2ku7 s ALA 72 N -2.64 3.57 0.47 4.21 0.00 -1.26 -4.15 121.76 121.96 2ku7 s ALA 72 Ca 0.50 -0.53 0.25 0.00 0.00 0.00 0.00 51.96 52.18 2ku7 s ALA 72 Cb -0.10 -2.37 1.46 0.00 0.00 0.00 0.00 23.12 22.11 2ku7 s ALA 72 CO 0.39 0.14 2.11 0.93 0.00 0.00 0.00 175.76 179.33 2ku7 h GLU 73 N 1.43 0.00 0.00 0.00 5.08 -1.93 -1.31 114.58 117.85 2ku7 h GLU 73 Ca -0.48 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 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 0.65 0.09 0.00 0.39 -1.00 0.00 0.00 179.01 179.14 2ku7 n GLU 74 N -3.87 0.55 -3.07 2.33 1.02 -1.26 -4.80 120.64 111.54 2ku7 n GLU 74 Ca -0.02 0.03 -0.39 0.00 -0.02 0.00 0.00 57.16 56.76 2ku7 n GLU 74 Cb 0.19 -1.50 -0.05 0.00 -0.02 0.00 0.00 31.44 30.06 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 -2.30 4.76 0.49 2.62 -7.23 -0.50 -5.08 120.40 113.16 2ku7 s VAL 75 Ca 0.30 1.49 0.06 0.00 -1.81 0.00 0.00 61.98 62.02 2ku7 s VAL 75 Cb 0.17 -4.04 0.01 0.00 0.56 0.00 0.00 36.38 33.07 2ku7 s VAL 75 CO 0.33 0.41 0.37 -1.81 -0.31 0.00 0.00 175.10 174.09 2ku7 s ASP 76 N -0.26 4.72 0.52 4.85 1.01 -1.26 -4.98 116.67 121.26 2ku7 s ASP 76 Ca 0.35 -1.08 0.17 0.00 0.71 0.00 0.00 52.55 52.70 2ku7 s ASP 76 Cb -0.20 0.00 1.27 0.00 1.01 0.00 0.00 42.92 45.01 2ku7 s ASP 76 CO 0.21 -0.90 2.14 -2.24 0.21 0.00 0.00 175.17 174.59 2ku7 h ASP 77 N 0.92 0.00 -0.04 0.27 2.03 -1.96 -1.58 116.42 116.06 2ku7 h ASP 77 Ca -0.39 0.00 -0.12 0.00 -0.73 0.00 0.00 57.03 55.79 2ku7 h ASP 77 Cb 1.28 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 39.77 2ku7 h ASP 77 CO 0.59 0.03 -0.35 0.11 -1.03 0.00 0.00 179.24 178.58 2ku7 h LYS 78 N 0.00 0.53 -0.14 4.15 1.79 -1.98 -1.36 116.57 119.56 2ku7 h LYS 78 Ca -0.00 -0.25 -0.03 0.00 -2.18 0.00 0.00 60.65 58.19 2ku7 h LYS 78 Cb 0.05 -0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 30.68 2ku7 h LYS 78 CO 0.00 0.81 -0.05 0.28 -1.08 0.00 0.00 179.45 179.42 2ku7 h VAL 79 N 0.45 1.30 -0.47 0.50 2.07 -1.69 -1.09 116.25 117.32 2ku7 h VAL 79 Ca 0.05 -1.03 -0.12 0.00 0.82 0.00 0.00 66.70 66.42 2ku7 h VAL 79 Cb 0.83 1.70 -0.02 0.00 -1.52 0.00 0.00 31.29 32.28 2ku7 h VAL 79 CO 0.07 0.30 -0.18 0.25 0.02 0.00 0.00 177.57 178.03 2ku7 h LEU 80 N -0.05 0.93 -0.06 2.57 6.46 -1.43 -1.76 115.31 121.98 2ku7 h LEU 80 Ca 0.03 -0.33 -0.01 0.00 -0.12 0.00 0.00 57.88 57.45 2ku7 h LEU 80 Cb 0.49 -0.25 -0.00 0.00 -0.73 0.00 0.00 40.66 40.16 2ku7 h LEU 80 CO 0.02 1.09 -0.02 -0.74 -0.62 0.00 0.00 178.44 178.17 2ku7 h HIS 81 N 0.80 0.12 0.00 1.25 2.76 -1.27 -2.71 115.15 116.11 2ku7 h HIS 81 Ca 0.12 -0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.25 2ku7 h HIS 81 Cb 0.72 -0.03 -0.00 0.00 1.55 0.00 0.00 27.41 29.65 2ku7 h HIS 81 CO 0.04 0.46 -0.02 0.00 -1.30 0.00 0.00 177.93 177.11 2ku7 h ALA 82 N 0.65 1.00 0.08 5.26 0.00 -1.21 -0.13 119.26 124.92 2ku7 h ALA 82 Ca 0.01 -0.02 -0.28 0.00 0.00 0.00 0.00 54.91 54.62 2ku7 h ALA 82 Cb 0.42 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2ku7 h ALA 82 CO 0.01 0.02 -1.43 0.00 0.00 0.00 0.00 179.25 177.85 2ku7 h ALA 83 N 1.98 0.33 -0.04 0.00 0.00 -1.29 -3.34 119.26 116.91 2ku7 h ALA 83 Ca -0.00 -1.10 0.00 0.00 0.00 0.00 0.00 54.91 53.81 2ku7 h ALA 83 Cb 0.54 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.54 2ku7 h ALA 83 CO 0.00 1.20 0.00 1.19 0.00 0.00 0.00 179.25 181.64 2ku7 n PHE 84 N -3.39 0.02 0.08 0.00 3.72 -1.03 -4.53 117.46 112.33 2ku7 n PHE 84 Ca -0.13 -0.01 -0.02 0.00 -0.05 0.00 0.00 57.45 57.24 2ku7 n PHE 84 Cb 1.02 -0.00 0.22 0.00 -0.94 0.00 0.00 39.48 39.78 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 4.15 1.30 -0.05 4.37 6.09 -1.13 -3.20 117.51 129.05 2ku7 h ILE 85 Ca 0.00 -1.50 0.01 0.00 -1.37 0.00 0.00 64.86 62.01 2ku7 h ILE 85 Cb 0.88 1.65 -0.00 0.00 0.47 0.00 0.00 36.82 39.82 2ku7 h ILE 85 CO 0.00 0.45 0.08 1.55 -3.07 0.00 0.00 178.15 177.16 2ku7 h PRO 86 N 0.23 0.00 0.02 2.19 0.13 -1.80 -2.03 132.00 130.75 2ku7 h PRO 86 Ca 0.02 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.94 2ku7 h PRO 86 Cb 0.81 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.92 2ku7 h PRO 86 CO 0.06 0.00 -0.97 0.74 -0.23 0.00 0.00 178.00 177.60 2ku7 h PHE 87 N 0.00 0.14 0.00 1.56 0.04 -1.90 -3.50 116.94 113.29 2ku7 h PHE 87 Ca 0.02 -0.09 0.00 0.00 2.80 0.00 0.00 57.97 60.70 2ku7 h PHE 87 Cb 0.18 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.32 2ku7 h PHE 87 CO 0.00 1.00 0.00 0.41 -0.60 0.00 0.00 178.31 179.12 2ku7 n GLY 88 N 1.16 -0.68 3.74 -1.45 0.00 -0.76 -4.81 105.19 102.39 2ku7 n GLY 88 Ca -0.02 -0.86 -0.40 0.00 0.00 0.00 0.00 46.02 44.73 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 -0.05 1.61 1.01 -1.26 -4.53 116.67 116.73 2ku7 s ASP 89 Ca 0.00 1.53 0.05 0.00 0.71 0.00 0.00 52.55 54.84 2ku7 s ASP 89 Cb 0.00 -2.49 -0.02 0.00 1.01 0.00 0.00 42.92 41.41 2ku7 s ASP 89 CO 0.00 0.01 -0.19 -0.63 0.21 0.00 0.00 175.17 174.57 2ku7 s ILE 90 N -0.09 2.63 -0.14 0.77 1.01 -1.26 -2.65 121.20 121.47 2ku7 s ILE 90 Ca 0.40 -0.88 -0.12 0.00 0.00 0.00 0.00 60.65 60.06 2ku7 s ILE 90 Cb -0.21 -2.00 -0.04 0.00 0.01 0.00 0.00 42.46 40.22 2ku7 s ILE 90 CO 0.25 0.58 -0.23 0.35 0.00 0.00 0.00 174.94 175.89 2ku7 n THR 91 N 2.52 1.33 -3.91 2.92 -2.24 -0.04 -4.88 114.28 109.97 2ku7 n THR 91 Ca -0.17 0.21 -0.10 0.00 -2.27 0.00 0.00 64.05 61.72 2ku7 n THR 91 Cb 0.52 -2.31 -0.10 0.00 -2.10 0.00 0.00 70.33 66.35 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 -5.64 0.14 -0.15 3.42 1.01 -1.25 -5.03 116.67 109.17 2ku7 s ASP 92 Ca -0.19 -0.44 0.02 0.00 0.71 0.00 0.00 52.55 52.65 2ku7 s ASP 92 Cb 0.03 0.21 0.01 0.00 1.01 0.00 0.00 42.92 44.18 2ku7 s ASP 92 CO 0.28 -0.46 -0.21 -0.63 0.21 0.00 0.00 175.17 174.36 2ku7 s ILE 93 N -2.20 2.15 -0.14 0.77 -1.09 -1.26 -1.61 121.20 117.82 2ku7 s ILE 93 Ca -0.08 -0.95 0.01 0.00 -2.23 0.00 0.00 60.65 57.40 2ku7 s ILE 93 Cb -0.03 -1.87 -0.00 0.00 -1.58 0.00 0.00 42.46 38.97 2ku7 s ILE 93 CO -0.03 0.54 -0.17 -1.10 -1.23 0.00 0.00 174.94 172.96 2ku7 s GLN 94 N 0.86 3.22 -0.18 2.79 -1.52 -0.74 -4.99 119.66 119.10 2ku7 s GLN 94 Ca -0.06 -0.76 -0.00 0.00 -1.95 0.00 0.00 55.36 52.59 2ku7 s GLN 94 Cb -0.15 -2.56 0.04 0.00 -0.22 0.00 0.00 33.01 30.13 2ku7 s GLN 94 CO -0.03 0.10 -0.06 0.42 -0.25 0.00 0.00 175.29 175.47 2ku7 s ILE 95 N 0.59 1.27 0.22 1.08 1.09 -1.26 -0.51 121.20 123.67 2ku7 s ILE 95 Ca -0.10 -0.78 -0.32 0.00 -1.10 0.00 0.00 60.65 58.35 2ku7 s ILE 95 Cb -0.16 -1.44 -0.12 0.00 -1.06 0.00 0.00 42.46 39.68 2ku7 s ILE 95 CO 0.03 0.10 1.69 -2.65 -0.10 0.00 0.00 174.94 174.01 2ku7 n PRO 96 N 4.81 2.69 -4.73 2.79 -0.02 -1.26 -5.01 135.00 134.27 2ku7 n PRO 96 Ca -0.13 0.97 -0.26 0.00 -2.02 0.00 0.00 63.50 62.07 2ku7 n PRO 96 Cb 0.47 -2.80 -0.16 0.00 -0.02 0.00 0.00 33.50 30.99 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 0.87 1.81 0.03 2.45 2.96 -1.26 -4.57 118.68 120.97 2ku7 s LEU 97 Ca 0.74 -0.34 -0.12 0.00 -0.22 0.00 0.00 54.13 54.19 2ku7 s LEU 97 Cb -0.52 -0.92 -0.06 0.00 0.50 0.00 0.00 46.19 45.19 2ku7 s LEU 97 CO 0.36 0.09 0.38 -1.81 -1.32 0.00 0.00 176.35 174.06 2ku7 s ASP 98 N 0.35 6.69 0.33 3.68 1.01 -1.26 -4.95 116.67 122.52 2ku7 s ASP 98 Ca -0.10 0.84 0.04 0.00 0.71 0.00 0.00 52.55 54.04 2ku7 s ASP 98 Cb -0.14 -2.20 0.58 0.00 1.01 0.00 0.00 42.92 42.17 2ku7 s ASP 98 CO 0.03 0.25 1.85 1.88 0.21 0.00 0.00 175.17 179.39 2ku7 h TYR 99 N 4.19 0.52 -0.38 4.23 0.05 -1.97 0.72 116.97 124.32 2ku7 h TYR 99 Ca -0.50 -0.06 -0.09 0.00 0.05 0.00 0.00 58.73 58.12 2ku7 h TYR 99 Cb 1.21 -0.14 -0.01 0.00 1.01 0.00 0.00 36.73 38.79 2ku7 h TYR 99 CO 0.69 0.55 -0.13 1.49 -1.05 0.00 0.00 178.16 179.71 2ku7 h GLU 100 N 0.46 0.76 0.00 4.88 4.81 -2.00 -3.37 114.58 120.12 2ku7 h GLU 100 Ca 0.09 -0.31 -0.09 0.00 -0.13 0.00 0.00 59.36 58.92 2ku7 h GLU 100 Cb 0.40 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.73 2ku7 h GLU 100 CO 0.02 0.92 -1.46 0.25 -0.73 0.00 0.00 179.01 178.00 2ku7 n THR 101 N -4.32 0.34 -1.56 0.32 -2.24 -1.22 -5.01 114.28 100.59 2ku7 n THR 101 Ca -0.02 -0.27 -0.19 0.00 -2.27 0.00 0.00 64.05 61.30 2ku7 n THR 101 Cb 0.38 -0.43 -0.08 0.00 -2.10 0.00 0.00 70.33 68.09 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 -2.11 -1.42 -4.38 -0.78 1.02 0.25 -4.97 120.64 108.24 2ku7 n GLU 102 Ca -0.09 1.18 -0.24 0.00 -0.02 0.00 0.00 57.16 57.99 2ku7 n GLU 102 Cb 0.57 -5.54 -0.11 0.00 -0.02 0.00 0.00 31.44 26.34 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 -3.64 1.42 0.22 3.49 1.02 -1.26 -4.84 119.74 116.15 2ku7 s LYS 103 Ca 0.00 -1.50 0.07 0.00 0.02 0.00 0.00 55.97 54.56 2ku7 s LYS 103 Cb 0.00 -1.59 -0.04 0.00 -0.52 0.00 0.00 37.83 35.68 2ku7 s LYS 103 CO 0.00 0.33 0.14 -3.38 -0.92 0.00 0.00 175.35 171.52 2ku7 s HIS 104 N -1.95 3.05 -1.98 3.18 -3.43 -1.26 -4.30 115.29 108.60 2ku7 s HIS 104 Ca 0.19 -0.10 0.30 0.00 -0.80 0.00 0.00 55.06 54.66 2ku7 s HIS 104 Cb -0.06 -1.41 1.59 0.00 -1.43 0.00 0.00 32.58 31.26 2ku7 s HIS 104 CO 0.09 0.53 2.05 -2.13 -2.00 0.00 0.00 174.74 173.28 2ku7 n ARG 105 N -0.78 1.02 0.00 -0.38 0.63 -1.26 -4.76 116.66 111.12 2ku7 n ARG 105 Ca -0.08 -0.23 0.00 0.00 -0.92 0.00 0.00 57.85 56.62 2ku7 n ARG 105 Cb 0.57 -1.50 0.00 0.00 0.45 0.00 0.00 32.46 31.98 2ku7 n ARG 105 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2ku7 n GLY 106 N 1.11 0.92 3.17 5.14 0.00 -1.26 -4.85 105.19 109.42 2ku7 n GLY 106 Ca 0.20 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.10 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 -1.82 -0.13 0.30 1.61 -0.71 -1.26 -0.25 117.98 115.71 2ku7 s PHE 107 Ca 0.00 0.23 -0.14 0.00 -1.04 0.00 0.00 56.93 55.98 2ku7 s PHE 107 Cb 0.00 0.05 0.01 0.00 -1.21 0.00 0.00 43.02 41.87 2ku7 s PHE 107 CO 0.00 -0.29 0.61 0.00 -1.34 0.00 0.00 175.22 174.20 2ku7 s ALA 108 N -0.98 -0.49 -0.01 1.99 0.00 0.71 -4.45 121.76 118.52 2ku7 s ALA 108 Ca -0.11 -0.77 0.06 0.00 0.00 0.00 0.00 51.96 51.14 2ku7 s ALA 108 Cb -0.05 0.94 -0.03 0.00 0.00 0.00 0.00 23.12 23.98 2ku7 s ALA 108 CO 0.02 -0.93 -0.17 -0.06 0.00 0.00 0.00 175.76 174.63 2ku7 s PHE 109 N -3.54 2.60 -0.09 0.00 0.08 0.33 -0.77 117.98 116.59 2ku7 s PHE 109 Ca 0.19 -0.23 0.02 0.00 0.12 0.00 0.00 56.93 57.02 2ku7 s PHE 109 Cb -0.03 -1.54 -0.02 0.00 -0.57 0.00 0.00 43.02 40.86 2ku7 s PHE 109 CO 0.10 0.19 -0.14 0.54 -0.10 0.00 0.00 175.22 175.82 2ku7 s VAL 110 N -0.81 3.07 -0.19 -0.44 0.11 0.52 -1.80 120.40 120.86 2ku7 s VAL 110 Ca 0.13 -0.69 -0.05 0.00 -2.93 0.00 0.00 61.98 58.44 2ku7 s VAL 110 Cb -0.10 -2.25 -0.03 0.00 -1.53 0.00 0.00 36.38 32.47 2ku7 s VAL 110 CO 0.03 0.55 -0.00 -0.70 -3.33 0.00 0.00 175.10 171.65 2ku7 s GLU 111 N -0.14 3.65 -0.08 1.54 2.12 -0.63 -0.21 118.70 124.94 2ku7 s GLU 111 Ca -0.01 -0.51 0.01 0.00 0.36 0.00 0.00 54.97 54.83 2ku7 s GLU 111 Cb -0.14 -3.07 -0.03 0.00 0.26 0.00 0.00 34.13 31.16 2ku7 s GLU 111 CO 0.03 0.06 -0.11 -0.06 -0.54 0.00 0.00 175.26 174.64 2ku7 s PHE 112 N 0.88 2.83 0.26 5.30 0.40 -0.42 -0.86 117.98 126.37 2ku7 s PHE 112 Ca 0.01 -0.18 -0.01 0.00 -0.60 0.00 0.00 56.93 56.14 2ku7 s PHE 112 Cb -0.14 -1.72 0.34 0.00 0.51 0.00 0.00 43.02 42.01 2ku7 s PHE 112 CO 0.02 0.16 1.75 1.49 0.70 0.00 0.00 175.22 179.34 2ku7 h GLU 113 N 5.63 0.75 -5.92 0.44 4.81 -1.81 -3.43 114.58 115.04 2ku7 h GLU 113 Ca -0.43 -0.21 -0.68 0.00 -0.13 0.00 0.00 59.36 57.91 2ku7 h GLU 113 Cb 1.17 -0.08 -0.13 0.00 0.63 0.00 0.00 28.75 30.34 2ku7 h GLU 113 CO 0.53 0.79 -0.60 -0.51 -0.73 0.00 0.00 179.01 178.49 2ku7 s LEU 114 N -9.09 3.72 0.42 1.64 1.02 -1.26 -5.00 118.68 110.13 2ku7 s LEU 114 Ca -0.09 0.20 0.23 0.00 0.02 0.00 0.00 54.13 54.49 2ku7 s LEU 114 Cb 0.14 -1.87 0.65 0.00 0.02 0.00 0.00 46.19 45.13 2ku7 s LEU 114 CO 0.81 0.38 1.71 0.00 0.02 0.00 0.00 176.35 179.27 2ku7 h ALA 115 N 5.08 0.93 -0.01 4.21 0.00 -1.87 -3.04 119.26 124.56 2ku7 h ALA 115 Ca -0.51 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.21 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 0.24 -0.03 0.93 0.00 0.00 0.00 179.25 180.94 2ku7 h GLU 116 N 0.00 0.04 -0.13 0.00 4.39 -1.95 -2.81 114.58 114.12 2ku7 h GLU 116 Ca -0.00 -0.03 -0.08 0.00 0.34 0.00 0.00 59.36 59.59 2ku7 h GLU 116 Cb 0.92 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.56 2ku7 h GLU 116 CO 0.03 0.67 -0.29 0.38 -1.16 0.00 0.00 179.01 178.63 2ku7 h ASP 117 N -0.59 0.24 -0.48 1.42 3.04 -1.88 -2.54 116.42 115.65 2ku7 h ASP 117 Ca -0.00 -0.08 -0.06 0.00 -3.24 0.00 0.00 57.03 53.65 2ku7 h ASP 117 Cb 0.67 -0.07 -0.02 0.00 -1.04 0.00 0.00 39.33 38.88 2ku7 h ASP 117 CO 0.01 0.54 0.05 0.00 -2.04 0.00 0.00 179.24 177.79 2ku7 h ALA 118 N 1.49 0.64 0.00 4.15 0.00 -1.60 -2.12 119.26 121.81 2ku7 h ALA 118 Ca 0.03 -0.25 -0.06 0.00 0.00 0.00 0.00 54.91 54.63 2ku7 h ALA 118 Cb 0.63 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2ku7 h ALA 118 CO 0.05 0.39 -0.27 0.00 0.00 0.00 0.00 179.25 179.42 2ku7 h ALA 119 N 0.94 1.46 -0.31 0.00 0.00 -1.33 -2.45 119.26 117.58 2ku7 h ALA 119 Ca 0.14 -0.25 -0.14 0.00 0.00 0.00 0.00 54.91 54.67 2ku7 h ALA 119 Cb 0.44 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 2ku7 h ALA 119 CO 0.02 0.34 -0.36 0.00 0.00 0.00 0.00 179.25 179.25 2ku7 h ALA 120 N 1.73 0.78 -0.51 0.00 0.00 -1.07 -2.66 119.26 117.54 2ku7 h ALA 120 Ca -0.00 -0.43 -0.09 0.00 0.00 0.00 0.00 54.91 54.39 2ku7 h ALA 120 Cb 0.51 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 2ku7 h ALA 120 CO 0.04 0.65 -0.04 0.00 0.00 0.00 0.00 179.25 179.89 2ku7 h ALA 121 N 1.01 0.97 -0.11 0.00 0.00 -0.92 -2.70 119.26 117.50 2ku7 h ALA 121 Ca 0.06 -0.30 -0.12 0.00 0.00 0.00 0.00 54.91 54.54 2ku7 h ALA 121 Cb 0.89 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 2ku7 h ALA 121 CO 0.08 0.62 -0.48 0.82 0.00 0.00 0.00 179.25 180.28 2ku7 h ILE 122 N 0.81 1.34 -0.28 0.00 2.04 -1.43 0.31 117.51 120.29 2ku7 h ILE 122 Ca 0.14 -1.70 -0.12 0.00 1.00 0.00 0.00 64.86 64.18 2ku7 h ILE 122 Cb 0.55 1.79 -0.01 0.00 -0.74 0.00 0.00 36.82 38.40 2ku7 h ILE 122 CO 0.03 0.51 -0.34 -0.78 0.00 0.00 0.00 178.15 177.57 2ku7 h ASP 123 N 0.22 0.63 0.00 1.72 1.82 -1.25 -3.07 116.42 116.50 2ku7 h ASP 123 Ca 0.01 -0.26 -0.27 0.00 -0.39 0.00 0.00 57.03 56.12 2ku7 h ASP 123 Cb 0.94 -0.18 -0.05 0.00 0.68 0.00 0.00 39.33 40.72 2ku7 h ASP 123 CO 0.08 0.93 -2.02 0.59 -1.61 0.00 0.00 179.24 177.20 2ku7 n ASN 124 N -4.06 1.74 -0.89 2.28 3.02 -1.04 -4.62 115.26 111.69 2ku7 n ASN 124 Ca -0.01 -0.03 0.12 0.00 -0.03 0.00 0.00 54.58 54.62 2ku7 n ASN 124 Cb 0.48 0.51 0.27 0.00 -0.61 0.00 0.00 39.78 40.43 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 -2.70 2.18 -0.26 3.52 2.81 0.11 -4.40 117.12 118.39 2ku7 n MET 125 Ca -0.27 -1.77 0.07 0.00 -1.81 0.00 0.00 57.70 53.92 2ku7 n MET 125 Cb 0.94 -1.46 0.31 0.00 -0.71 0.00 0.00 33.22 32.30 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 3.63 0.76 -2.01 7.83 -0.73 -1.64 -3.29 115.58 120.13 2ku7 h ASN 126 Ca 0.00 0.01 -0.55 0.00 1.87 0.00 0.00 56.30 57.64 2ku7 h ASN 126 Cb 0.79 -0.15 -0.37 0.00 0.27 0.00 0.00 38.32 38.86 2ku7 h ASN 126 CO 0.00 0.47 -1.04 -0.62 -0.37 0.00 0.00 177.43 175.86 2ku7 n GLU 127 N -4.51 0.57 -4.36 6.67 1.02 -1.24 -3.03 120.64 115.77 2ku7 n GLU 127 Ca 0.14 -3.13 -0.21 0.00 -0.02 0.00 0.00 57.16 53.93 2ku7 n GLU 127 Cb 0.28 -1.35 -0.11 0.00 -0.02 0.00 0.00 31.44 30.24 2ku7 n GLU 127 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2ku7 s SER 128 N -0.83 2.79 -0.25 1.62 0.15 -1.19 -4.94 113.70 111.05 2ku7 s SER 128 Ca 0.34 -0.93 -0.17 0.00 0.70 0.00 0.00 55.95 55.89 2ku7 s SER 128 Cb 0.13 -0.17 -0.03 0.00 -1.71 0.00 0.00 66.02 64.24 2ku7 s SER 128 CO -0.14 -0.06 0.45 -0.70 1.20 0.00 0.00 173.24 173.99 2ku7 s GLU 129 N -3.16 4.07 -0.08 5.44 2.12 -1.26 -0.40 118.70 125.43 2ku7 s GLU 129 Ca 0.20 0.21 0.02 0.00 0.36 0.00 0.00 54.97 55.76 2ku7 s GLU 129 Cb -0.04 -3.63 0.01 0.00 0.26 0.00 0.00 34.13 30.73 2ku7 s GLU 129 CO 0.08 -0.28 -0.12 -1.17 -0.54 0.00 0.00 175.26 173.23 2ku7 s LEU 130 N 2.07 1.59 -1.19 2.70 2.96 0.16 -4.75 118.68 122.21 2ku7 s LEU 130 Ca 0.19 -0.31 0.00 0.00 -0.22 0.00 0.00 54.13 53.79 2ku7 s LEU 130 Cb -0.16 -0.85 0.00 0.00 0.50 0.00 0.00 46.19 45.68 2ku7 s LEU 130 CO 0.09 0.01 0.00 0.33 -1.32 0.00 0.00 176.35 175.46 2ku7 n PHE 131 N 4.00 0.00 -0.15 5.38 -0.00 -1.26 -1.57 117.46 123.86 2ku7 n PHE 131 Ca -0.21 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.24 2ku7 n PHE 131 Cb 0.51 -2.63 0.00 0.00 -0.00 0.00 0.00 39.48 37.37 2ku7 n PHE 131 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2ku7 n GLY 132 N -0.16 0.78 3.27 7.13 0.00 -1.26 -4.97 105.19 109.98 2ku7 n GLY 132 Ca -0.11 0.00 -0.20 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 -0.85 1.10 0.07 1.61 0.52 -0.61 -5.11 118.95 115.69 2ku7 s ARG 133 Ca 0.00 -1.26 -0.28 0.00 -0.52 0.00 0.00 55.73 53.67 2ku7 s ARG 133 Cb 0.00 -1.10 -0.05 0.00 0.52 0.00 0.00 34.95 34.32 2ku7 s ARG 133 CO 0.00 0.23 0.88 0.99 0.02 0.00 0.00 175.30 177.41 2ku7 s THR 134 N -1.91 4.63 0.19 0.02 2.01 -1.26 0.36 115.64 119.68 2ku7 s THR 134 Ca 0.10 1.88 0.11 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 68.17 2ku7 s THR 134 CO 0.04 0.32 -0.22 0.27 -0.69 0.00 0.00 174.62 174.35 2ku7 s ILE 135 N 0.06 2.46 -0.06 1.82 -4.36 0.46 -4.51 121.20 117.08 2ku7 s ILE 135 Ca 0.44 -1.99 0.05 0.00 -0.26 0.00 0.00 60.65 58.88 2ku7 s ILE 135 Cb -0.22 -2.19 -0.01 0.00 1.25 0.00 0.00 42.46 41.30 2ku7 s ILE 135 CO 0.27 -0.12 -0.22 -0.13 0.24 0.00 0.00 174.94 174.98 2ku7 s ARG 136 N -2.71 2.34 -0.02 0.37 0.52 -0.66 -3.15 118.95 115.64 2ku7 s ARG 136 Ca 0.21 -0.79 0.03 0.00 -0.52 0.00 0.00 55.73 54.67 2ku7 s ARG 136 Cb -0.08 -1.96 -0.00 0.00 0.52 0.00 0.00 34.95 33.43 2ku7 s ARG 136 CO 0.11 0.29 -0.11 0.14 0.02 0.00 0.00 175.30 175.75 2ku7 s VAL 137 N 0.01 0.92 0.27 3.52 -7.23 -1.17 -2.16 120.40 114.57 2ku7 s VAL 137 Ca -0.06 -0.48 -0.11 0.00 -1.81 0.00 0.00 61.98 59.52 2ku7 s VAL 137 Cb -0.14 -0.79 0.00 0.00 0.56 0.00 0.00 36.38 36.02 2ku7 s VAL 137 CO 0.04 0.27 0.50 0.20 -0.31 0.00 0.00 175.10 175.80 2ku7 s ASN 138 N -0.11 0.10 0.10 4.85 0.01 -1.00 -4.54 114.94 114.35 2ku7 s ASN 138 Ca 0.02 -1.05 -0.31 0.00 -0.71 0.00 0.00 52.86 50.81 2ku7 s ASN 138 Cb -0.06 0.62 -0.07 0.00 0.41 0.00 0.00 41.25 42.14 2ku7 s ASN 138 CO 0.00 -1.21 1.35 -0.76 -1.51 0.00 0.00 177.10 174.97 2ku7 s LEU 139 N -3.06 4.37 0.00 0.60 1.43 -1.26 0.12 118.68 120.87 2ku7 s LEU 139 Ca 0.23 2.25 0.26 0.00 -1.03 0.00 0.00 54.13 55.84 2ku7 s LEU 139 Cb -0.01 -3.58 0.60 0.00 0.03 0.00 0.00 46.19 43.23 2ku7 s LEU 139 CO 0.11 -0.61 1.49 0.00 0.23 0.00 0.00 176.35 177.57