#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 3.37 -0.01 1.43 1.00 -1.26 -5.11 119.30 118.72 2ku7 s MET 2 Ca 0.00 -0.33 0.06 0.00 0.00 0.00 0.00 55.69 55.41 2ku7 s MET 2 Cb 0.00 -2.99 -0.03 0.00 0.00 0.00 0.00 34.83 31.81 2ku7 s MET 2 CO 0.00 0.59 -0.17 -1.64 0.00 0.00 0.00 175.02 173.80 2ku7 s MET 3 N -0.55 2.28 0.30 2.03 1.00 -1.26 -5.04 119.30 118.07 2ku7 s MET 3 Ca 0.10 -0.84 0.05 0.00 0.00 0.00 0.00 55.69 55.00 2ku7 s MET 3 Cb -0.12 -2.26 0.49 0.00 0.00 0.00 0.00 34.83 32.94 2ku7 s MET 3 CO 0.02 0.58 1.75 1.96 0.00 0.00 0.00 175.02 179.33 2ku7 h GLN 4 N 5.01 0.37 -6.15 2.03 4.20 -2.09 -3.43 115.11 115.06 2ku7 h GLN 4 Ca -0.47 -0.14 -0.69 0.00 0.06 0.00 0.00 58.65 57.42 2ku7 h GLN 4 Cb 1.15 -0.02 -0.29 0.00 0.30 0.00 0.00 27.48 28.62 2ku7 h GLN 4 CO 0.49 0.62 -0.84 0.00 -0.67 0.00 0.00 178.83 178.42 2ku7 n GLY 6 N 2.74 4.20 3.90 0.00 0.00 -1.26 -5.14 105.19 109.62 2ku7 n GLY 6 Ca -0.17 -0.99 -0.32 0.00 0.00 0.00 0.00 46.02 44.54 2ku7 n GLY 6 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ku7 s LYS 7 N 4.63 3.57 -0.15 1.61 1.02 -1.26 -5.03 119.74 124.14 2ku7 s LYS 7 Ca 0.00 -0.17 -0.02 0.00 0.02 0.00 0.00 55.97 55.80 2ku7 s LYS 7 Cb 0.00 -2.91 -0.24 0.00 -0.52 0.00 0.00 37.83 34.16 2ku7 s LYS 7 CO 0.00 0.51 0.25 0.00 -0.92 0.00 0.00 175.35 175.19 2ku7 s ASP 9 N -6.80 6.72 0.35 0.00 2.15 -1.26 -4.97 116.67 112.85 2ku7 s ASP 9 Ca -0.23 0.87 0.06 0.00 0.43 0.00 0.00 52.55 53.68 2ku7 s ASP 9 Cb 0.07 -2.35 0.66 0.00 -0.30 0.00 0.00 42.92 41.00 2ku7 s ASP 9 CO 0.74 -0.25 1.87 0.03 -0.17 0.00 0.00 175.17 177.39 2ku7 h ARG 10 N 7.37 0.39 -5.81 4.34 3.08 -2.06 -3.43 114.38 118.27 2ku7 h ARG 10 Ca -0.33 -0.09 -0.64 0.00 0.07 0.00 0.00 59.98 58.99 2ku7 h ARG 10 Cb 1.15 -0.05 -0.06 0.00 0.08 0.00 0.00 29.97 31.09 2ku7 h ARG 10 CO 0.77 0.49 -0.43 -1.58 -1.07 0.00 0.00 179.97 178.15 2ku7 s TRP 11 N -4.80 3.58 0.00 3.04 0.52 -1.26 -4.97 118.94 115.05 2ku7 s TRP 11 Ca -0.07 0.52 0.00 0.00 0.02 0.00 0.00 56.10 56.58 2ku7 s TRP 11 Cb 0.15 -1.95 0.00 0.00 -1.15 0.00 0.00 33.47 30.52 2ku7 s TRP 11 CO 0.75 0.66 0.00 1.33 0.02 0.00 0.00 176.95 179.71 2ku7 n VAL 12 N 1.35 0.00 -0.07 4.03 0.24 -1.26 -4.88 118.33 117.74 2ku7 n VAL 12 Ca -0.14 0.00 0.01 0.00 -2.04 0.00 0.00 64.34 62.18 2ku7 n VAL 12 Cb 0.53 -0.02 0.32 0.00 -1.47 0.00 0.00 33.84 33.21 2ku7 n VAL 12 CO 0.00 0.00 0.00 0.45 -2.14 0.00 0.00 176.83 175.14 2ku7 h HIS 13 N 0.00 0.68 -0.61 6.34 3.86 -2.00 -2.82 115.15 120.60 2ku7 h HIS 13 Ca 0.00 -0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.17 2ku7 h HIS 13 Cb 0.02 -0.22 -0.03 0.00 1.06 0.00 0.00 27.41 28.24 2ku7 h HIS 13 CO 0.00 0.49 0.28 1.03 0.86 0.00 0.00 177.93 180.60 2ku7 h SER 14 N 0.69 0.77 -0.53 2.45 0.87 -1.99 -1.27 113.55 114.55 2ku7 h SER 14 Ca 0.18 -0.08 -0.04 0.00 -1.23 0.00 0.00 61.79 60.62 2ku7 h SER 14 Cb 0.06 -0.20 -0.03 0.00 -0.44 0.00 0.00 62.40 61.79 2ku7 h SER 14 CO -0.03 0.66 0.21 0.11 -0.53 0.00 0.00 176.83 177.25 2ku7 h LYS 15 N 0.85 0.85 0.00 2.24 1.57 -1.85 -2.78 116.57 117.46 2ku7 h LYS 15 Ca 0.21 -0.14 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 2ku7 h LYS 15 Cb 0.10 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.27 2ku7 h LYS 15 CO -0.03 0.71 -0.83 0.00 -0.57 0.00 0.00 179.45 178.74 2ku7 h GLU 17 N 0.00 0.00 -0.84 0.00 4.81 -0.94 -3.13 114.58 114.48 2ku7 h GLU 17 Ca 0.00 0.00 0.06 0.00 -0.13 0.00 0.00 59.36 59.29 2ku7 h GLU 17 Cb 0.91 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.24 2ku7 h GLU 17 CO 0.00 0.09 0.55 -0.91 -0.73 0.00 0.00 179.01 178.01 2ku7 h ASN 18 N 0.00 0.84 -3.50 1.04 4.21 -1.69 -3.42 115.58 113.06 2ku7 h ASN 18 Ca -0.00 0.00 -0.68 0.00 1.21 0.00 0.00 56.30 56.83 2ku7 h ASN 18 Cb 0.36 -0.18 -0.17 0.00 -1.12 0.00 0.00 38.32 37.21 2ku7 h ASN 18 CO 0.01 0.55 -0.66 -0.22 -1.29 0.00 0.00 177.43 175.82 2ku7 s LEU 19 N -9.90 3.37 0.72 1.61 2.96 -1.18 -5.11 118.68 111.13 2ku7 s LEU 19 Ca -0.11 0.04 -0.13 0.00 -0.22 0.00 0.00 54.13 53.72 2ku7 s LEU 19 Cb 0.19 -1.78 0.03 0.00 0.50 0.00 0.00 46.19 45.14 2ku7 s LEU 19 CO 0.79 0.36 1.10 -0.44 -1.32 0.00 0.00 176.35 176.84 2ku7 s SER 20 N -0.93 4.82 0.41 3.68 0.01 -1.26 -4.90 113.70 115.53 2ku7 s SER 20 Ca 0.14 1.90 0.13 0.00 1.31 0.00 0.00 55.95 59.42 2ku7 s SER 20 Cb -0.11 -2.53 0.88 0.00 0.21 0.00 0.00 66.02 64.46 2ku7 s SER 20 CO 0.03 -1.82 1.93 -2.24 0.41 0.00 0.00 173.24 171.55 2ku7 h ASP 21 N -0.56 0.06 -0.13 2.44 3.04 -1.96 -2.32 116.42 116.99 2ku7 h ASP 21 Ca -0.45 -0.01 -0.11 0.00 -3.24 0.00 0.00 57.03 53.21 2ku7 h ASP 21 Cb 1.24 -0.02 0.00 0.00 -1.04 0.00 0.00 39.33 39.51 2ku7 h ASP 21 CO 0.53 0.28 -0.36 1.05 -2.04 0.00 0.00 179.24 178.70 2ku7 h GLU 22 N 0.06 0.48 -0.29 4.15 4.11 -2.00 -2.83 114.58 118.26 2ku7 h GLU 22 Ca 0.01 -0.34 -0.15 0.00 0.07 0.00 0.00 59.36 58.95 2ku7 h GLU 22 Cb 0.41 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 2ku7 h GLU 22 CO 0.03 0.96 -0.42 0.52 0.07 0.00 0.00 179.01 180.16 2ku7 h MET 23 N 0.08 0.71 -0.60 1.06 2.86 -1.94 -2.65 114.93 114.47 2ku7 h MET 23 Ca -0.01 -0.38 -0.07 0.00 -2.06 0.00 0.00 59.70 57.18 2ku7 h MET 23 Cb 0.98 0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.63 2ku7 h MET 23 CO 0.08 1.00 0.10 -0.92 1.06 0.00 0.00 176.91 178.23 2ku7 h TYR 24 N 0.58 1.05 -0.18 -0.22 3.20 -1.49 -0.98 116.97 118.92 2ku7 h TYR 24 Ca 0.04 -0.14 -0.09 0.00 3.14 0.00 0.00 58.73 61.68 2ku7 h TYR 24 Cb 0.97 -0.29 -0.00 0.00 1.54 0.00 0.00 36.73 38.95 2ku7 h TYR 24 CO 0.05 0.90 -0.22 1.49 -1.64 0.00 0.00 178.16 178.74 2ku7 h GLU 25 N 0.89 0.47 -0.12 1.82 4.81 -1.50 -2.22 114.58 118.73 2ku7 h GLU 25 Ca 0.18 -0.27 -0.05 0.00 -0.13 0.00 0.00 59.36 59.09 2ku7 h GLU 25 Cb 0.42 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.81 2ku7 h GLU 25 CO 0.01 0.85 -0.13 0.82 -0.73 0.00 0.00 179.01 179.83 2ku7 h ILE 26 N 0.13 1.36 -0.35 2.32 2.04 -1.48 -2.84 117.51 118.69 2ku7 h ILE 26 Ca 0.02 -1.31 -0.13 0.00 1.00 0.00 0.00 64.86 64.44 2ku7 h ILE 26 Cb 0.78 1.96 -0.01 0.00 -0.74 0.00 0.00 36.82 38.80 2ku7 h ILE 26 CO 0.05 0.38 -0.31 -0.07 0.00 0.00 0.00 178.15 178.20 2ku7 h LEU 27 N -0.10 0.79 -0.55 1.44 3.38 -1.28 -3.15 115.31 115.83 2ku7 h LEU 27 Ca 0.02 -0.32 -0.12 0.00 0.09 0.00 0.00 57.88 57.54 2ku7 h LEU 27 Cb 0.67 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 2ku7 h LEU 27 CO 0.03 1.04 -0.17 0.28 0.09 0.00 0.00 178.44 179.72 2ku7 h SER 28 N 0.64 1.00 -3.21 -0.43 0.02 -1.48 -3.40 113.55 106.68 2ku7 h SER 28 Ca 0.07 -0.36 -0.55 0.00 -0.84 0.00 0.00 61.79 60.12 2ku7 h SER 28 Cb 0.84 -0.27 -0.40 0.00 0.14 0.00 0.00 62.40 62.71 2ku7 h SER 28 CO 0.07 1.14 -0.76 0.54 -1.14 0.00 0.00 176.83 176.68 2ku7 s ASN 29 N -6.70 3.46 -0.07 3.07 2.20 -1.07 -5.10 114.94 110.73 2ku7 s ASN 29 Ca -0.11 -1.20 -0.01 0.00 -0.94 0.00 0.00 52.86 50.60 2ku7 s ASN 29 Cb 0.13 -0.72 -0.03 0.00 -2.00 0.00 0.00 41.25 38.62 2ku7 s ASN 29 CO 0.86 -0.35 -0.00 -0.76 -2.94 0.00 0.00 177.10 173.91 2ku7 s LEU 30 N 1.75 3.55 0.25 3.54 1.02 -1.20 -4.49 118.68 123.11 2ku7 s LEU 30 Ca 0.04 0.10 -0.31 0.00 0.02 0.00 0.00 54.13 53.98 2ku7 s LEU 30 Cb -0.17 -1.86 -0.11 0.00 0.02 0.00 0.00 46.19 44.07 2ku7 s LEU 30 CO -0.17 0.36 1.60 -2.84 0.02 0.00 0.00 176.35 175.32 2ku7 s PRO 31 N -1.02 4.15 0.47 1.29 0.02 -1.26 -4.79 135.00 133.85 2ku7 s PRO 31 Ca 0.15 2.53 0.34 0.00 0.02 0.00 0.00 61.00 64.04 2ku7 s PRO 31 Cb -0.11 -3.06 1.49 0.00 0.02 0.00 0.00 34.50 32.84 2ku7 s PRO 31 CO 0.04 -0.63 1.63 0.93 -0.33 0.00 0.00 177.00 178.64 2ku7 h GLU 32 N 5.53 0.07 0.04 5.54 5.08 -1.99 0.14 114.58 128.98 2ku7 h GLU 32 Ca -0.45 -0.00 -0.38 0.00 -1.00 0.00 0.00 59.36 57.52 2ku7 h GLU 32 Cb 1.21 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 30.39 2ku7 h GLU 32 CO 0.84 0.04 -2.33 0.43 -1.00 0.00 0.00 179.01 177.00 2ku7 n SER 33 N -4.51 1.95 0.21 1.42 7.64 -1.26 -4.44 113.62 114.64 2ku7 n SER 33 Ca 0.38 -0.03 0.08 0.00 1.01 0.00 0.00 58.87 60.31 2ku7 n SER 33 Cb 1.52 -0.50 0.47 0.00 -1.01 0.00 0.00 64.21 64.69 2ku7 n SER 33 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 2ku7 h VAL 34 N 0.02 0.83 0.00 0.44 2.07 -1.47 -2.88 116.25 115.27 2ku7 h VAL 34 Ca -0.53 -1.13 -0.04 0.00 0.82 0.00 0.00 66.70 65.82 2ku7 h VAL 34 Cb 1.95 1.68 -0.01 0.00 -1.52 0.00 0.00 31.29 33.40 2ku7 h VAL 34 CO -0.03 0.28 -0.21 0.00 0.02 0.00 0.00 177.57 177.62 2ku7 h ALA 35 N 1.72 1.50 -2.77 1.67 0.00 -1.02 -3.46 119.26 116.89 2ku7 h ALA 35 Ca -0.00 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.66 2ku7 h ALA 35 Cb 0.66 -0.03 -0.12 0.00 0.00 0.00 0.00 17.79 18.30 2ku7 h ALA 35 CO 0.04 0.27 -0.08 1.52 0.00 0.00 0.00 179.25 181.00 2ku7 s TYR 36 N -4.39 -0.08 0.26 0.00 1.13 -1.09 -5.04 117.35 108.14 2ku7 s TYR 36 Ca -0.03 -0.25 0.09 0.00 -1.41 0.00 0.00 57.07 55.46 2ku7 s TYR 36 Cb 0.15 0.25 -0.04 0.00 -1.10 0.00 0.00 41.96 41.22 2ku7 s TYR 36 CO 0.67 -0.78 0.04 0.95 -2.51 0.00 0.00 175.55 173.93 2ku7 s THR 37 N -3.85 3.71 0.22 -3.49 -4.23 -1.26 -4.79 115.64 101.95 2ku7 s THR 37 Ca 0.07 -1.76 0.05 0.00 -1.18 0.00 0.00 61.69 58.87 2ku7 s THR 37 Cb 0.01 -2.98 -0.05 0.00 1.34 0.00 0.00 72.50 70.82 2ku7 s THR 37 CO -0.07 -0.35 -0.06 0.00 -0.54 0.00 0.00 174.62 173.60 2ku7 s VAL 39 N -3.22 2.13 0.11 0.00 -7.23 -1.26 -5.15 120.40 105.77 2ku7 s VAL 39 Ca 0.26 -1.83 0.03 0.00 -1.81 0.00 0.00 61.98 58.62 2ku7 s VAL 39 Cb 0.04 -1.94 -0.04 0.00 0.56 0.00 0.00 36.38 35.00 2ku7 s VAL 39 CO 0.08 -0.06 0.16 0.21 -0.31 0.00 0.00 175.10 175.17 2ku7 s ASN 40 N -2.32 5.85 -0.03 4.85 2.47 -1.26 -5.11 114.94 119.39 2ku7 s ASN 40 Ca 0.15 0.06 -0.15 0.00 0.42 0.00 0.00 52.86 53.34 2ku7 s ASN 40 Cb -0.09 -1.65 -0.05 0.00 -1.45 0.00 0.00 41.25 38.01 2ku7 s ASN 40 CO 0.07 0.13 0.39 0.00 -3.72 0.00 0.00 177.10 173.97 2ku7 h THR 42 N 3.88 1.25 -0.56 0.00 2.02 -1.99 -1.88 112.91 115.62 2ku7 h THR 42 Ca -0.50 -0.87 -0.10 0.00 0.77 0.00 0.00 66.41 65.71 2ku7 h THR 42 Cb 1.21 0.49 -0.02 0.00 -1.74 0.00 0.00 68.15 68.09 2ku7 h THR 42 CO 0.63 0.34 -0.04 -0.08 0.37 0.00 0.00 175.52 176.74 2ku7 h GLU 43 N 1.02 1.02 -0.03 6.66 4.81 -2.01 -3.06 114.58 123.00 2ku7 h GLU 43 Ca 0.23 -0.35 -0.14 0.00 -0.13 0.00 0.00 59.36 58.97 2ku7 h GLU 43 Cb 0.29 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.57 2ku7 h GLU 43 CO -0.01 1.03 -0.62 0.00 -0.73 0.00 0.00 179.01 178.68 2ku7 h ARG 44 N 0.91 0.10 -0.72 1.92 3.08 -1.86 -3.24 114.38 114.57 2ku7 h ARG 44 Ca 0.15 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 2ku7 h ARG 44 Cb 0.60 0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.63 2ku7 h ARG 44 CO 0.04 0.69 0.42 1.25 -1.07 0.00 0.00 179.97 181.30 2ku7 h HIS 45 N 0.08 0.95 -0.32 3.04 2.76 -1.24 -3.00 115.15 117.42 2ku7 h HIS 45 Ca -0.01 -0.01 -0.07 0.00 -2.20 0.00 0.00 60.37 58.09 2ku7 h HIS 45 Cb 1.12 -0.31 -0.01 0.00 1.55 0.00 0.00 27.41 29.76 2ku7 h HIS 45 CO 0.01 0.65 -0.07 0.28 -1.30 0.00 0.00 177.93 177.50 2ku7 h VAL 46 N 0.99 1.28 -3.50 5.26 2.07 -1.57 -3.43 116.25 117.36 2ku7 h VAL 46 Ca 0.26 -1.10 -0.60 0.00 0.82 0.00 0.00 66.70 66.07 2ku7 h VAL 46 Cb -0.01 1.34 -0.11 0.00 -1.52 0.00 0.00 31.29 30.98 2ku7 h VAL 46 CO -0.05 0.36 -0.12 -1.81 0.02 0.00 0.00 177.57 175.97 2ku7 s ASP 47 N -6.20 6.48 0.00 0.57 1.01 -1.13 -4.95 116.67 112.44 2ku7 s ASP 47 Ca -0.13 0.57 0.00 0.00 0.71 0.00 0.00 52.55 53.70 2ku7 s ASP 47 Cb 0.09 -2.26 0.00 0.00 1.01 0.00 0.00 42.92 41.76 2ku7 s ASP 47 CO 0.79 -0.14 0.00 0.61 0.21 0.00 0.00 175.17 176.64 2ku7 n GLY 48 N 3.99 -1.79 3.15 0.21 0.00 -1.26 -4.86 105.19 104.63 2ku7 n GLY 48 Ca -0.07 -1.54 0.04 0.00 0.00 0.00 0.00 46.02 44.46 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 -0.34 -1.11 0.37 -0.02 0.00 -1.26 -4.99 107.32 99.96 2ku7 s GLY 49 Ca 0.00 1.49 0.17 0.00 0.00 0.00 0.00 44.72 46.38 2ku7 s GLY 49 CO 0.00 3.59 1.76 1.48 0.00 0.00 0.00 173.10 179.93 2ku7 h SER 50 N 7.97 0.00 -0.41 1.64 4.64 -1.94 -3.49 113.55 121.96 2ku7 h SER 50 Ca -0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.21 2ku7 h SER 50 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 2ku7 h SER 50 CO 0.17 0.40 0.00 0.61 -0.87 0.00 0.00 176.83 177.14 2ku7 n GLY 51 N -0.01 -1.70 0.00 -0.77 0.00 -1.26 -5.04 105.19 96.41 2ku7 n GLY 51 Ca -0.01 -1.62 0.00 0.00 0.00 0.00 0.00 46.02 44.39 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 0.00 0.97 0.24 -0.02 0.00 -1.26 -5.05 105.19 100.08 2ku7 n GLY 52 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.33 -0.58 1.61 0.02 -2.02 -3.47 113.55 109.43 2ku7 h SER 53 Ca 0.00 -0.08 0.00 0.00 -0.84 0.00 0.00 61.79 60.87 2ku7 h SER 53 Cb 0.00 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.45 2ku7 h SER 53 CO 0.00 0.51 0.00 0.61 -1.14 0.00 0.00 176.83 176.81 2ku7 n GLY 54 N -0.70 0.83 0.24 -3.77 0.00 -1.26 -5.00 105.19 95.53 2ku7 n GLY 54 Ca -0.00 -0.27 0.08 0.00 0.00 0.00 0.00 46.02 45.82 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 0.00 -4.16 -0.02 0.00 -2.06 -3.43 103.07 93.41 2ku7 h GLY 55 Ca 0.00 0.00 -0.60 0.00 0.00 0.00 0.00 47.33 46.73 2ku7 h GLY 55 CO 0.00 0.00 -0.57 -1.35 0.00 0.00 0.00 176.54 174.62 2ku7 s SER 56 N -6.78 5.58 0.11 0.19 1.04 -1.26 -5.11 113.70 107.47 2ku7 s SER 56 Ca -0.04 -0.06 -0.09 0.00 0.48 0.00 0.00 55.95 56.24 2ku7 s SER 56 Cb 0.15 -1.49 0.03 0.00 0.10 0.00 0.00 66.02 64.81 2ku7 s SER 56 CO 0.66 0.11 0.45 0.61 0.98 0.00 0.00 173.24 176.05 2ku7 n GLY 57 N -0.02 1.12 1.24 7.32 0.00 -1.26 -5.18 105.19 108.41 2ku7 n GLY 57 Ca -0.08 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 44.89 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 -0.31 0.67 3.39 -0.02 0.00 -1.26 -5.17 105.19 102.48 2ku7 n GLY 58 Ca -0.02 -0.93 -0.30 0.00 0.00 0.00 0.00 46.02 44.77 2ku7 n GLY 58 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ku7 s SER 59 N -1.86 3.40 0.13 1.61 0.01 -1.26 -5.14 113.70 110.60 2ku7 s SER 59 Ca 0.09 -0.57 0.07 0.00 1.31 0.00 0.00 55.95 56.85 2ku7 s SER 59 Cb -0.00 -0.38 -0.04 0.00 0.21 0.00 0.00 66.02 65.81 2ku7 s SER 59 CO 0.00 0.24 -0.07 0.00 0.41 0.00 0.00 173.24 173.82 2ku7 s ALA 60 N -0.90 3.02 0.53 1.44 0.00 -1.26 -5.14 121.76 119.45 2ku7 s ALA 60 Ca 0.13 -1.31 -0.04 0.00 0.00 0.00 0.00 51.96 50.74 2ku7 s ALA 60 Cb -0.10 -0.90 -0.01 0.00 0.00 0.00 0.00 23.12 22.11 2ku7 s ALA 60 CO 0.04 0.58 0.82 0.95 0.00 0.00 0.00 175.76 178.15 2ku7 s THR 61 N -1.42 4.10 -0.19 0.00 -4.23 -1.26 -5.03 115.64 107.62 2ku7 s THR 61 Ca 0.24 -0.05 -0.29 0.00 -1.18 0.00 0.00 61.69 60.41 2ku7 s THR 61 Cb -0.10 -3.58 -0.02 0.00 1.34 0.00 0.00 72.50 70.13 2ku7 s THR 61 CO 0.15 -0.55 1.45 0.42 -0.54 0.00 0.00 174.62 175.55 2ku7 s THR 62 N -2.82 3.95 0.02 3.99 -4.23 -1.26 -5.01 115.64 110.28 2ku7 s THR 62 Ca 0.51 1.11 0.04 0.00 -1.18 0.00 0.00 61.69 62.17 2ku7 s THR 62 Cb -0.10 -3.85 -0.01 0.00 1.34 0.00 0.00 72.50 69.88 2ku7 s THR 62 CO 0.43 -0.24 -0.11 -0.54 -0.54 0.00 0.00 174.62 173.62 2ku7 s LYS 63 N 4.08 0.81 0.00 3.99 1.02 -1.26 -5.03 119.74 123.34 2ku7 s LYS 63 Ca 0.63 -0.56 0.28 0.00 0.02 0.00 0.00 55.97 56.35 2ku7 s LYS 63 Cb -0.24 -0.77 1.08 0.00 -0.52 0.00 0.00 37.83 37.38 2ku7 s LYS 63 CO 0.23 0.20 1.76 0.54 -0.92 0.00 0.00 175.35 177.17 2ku7 n ARG 64 N 2.30 0.98 -4.27 1.68 1.74 -1.26 -4.74 116.66 113.10 2ku7 n ARG 64 Ca -0.16 -0.47 -0.34 0.00 -0.77 0.00 0.00 57.85 56.11 2ku7 n ARG 64 Cb 0.56 -1.49 -0.12 0.00 -1.02 0.00 0.00 32.46 30.39 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 -2.34 4.10 0.20 1.55 1.01 -1.26 -0.47 120.40 123.19 2ku7 s VAL 65 Ca 0.31 -0.28 0.10 0.00 0.00 0.00 0.00 61.98 62.11 2ku7 s VAL 65 Cb 0.20 -2.82 -0.04 0.00 0.00 0.00 0.00 36.38 33.72 2ku7 s VAL 65 CO 0.45 0.48 -0.19 -0.76 0.00 0.00 0.00 175.10 175.08 2ku7 s LEU 66 N 0.45 2.49 -0.11 3.92 1.43 -0.14 -0.33 118.68 126.39 2ku7 s LEU 66 Ca -0.02 -0.93 -0.17 0.00 -1.03 0.00 0.00 54.13 51.99 2ku7 s LEU 66 Cb -0.14 -0.92 -0.05 0.00 0.03 0.00 0.00 46.19 45.12 2ku7 s LEU 66 CO 0.02 -0.01 0.43 -0.47 0.23 0.00 0.00 176.35 176.55 2ku7 s TYR 67 N -2.24 3.53 -0.14 0.29 6.14 0.31 -1.46 117.35 123.78 2ku7 s TYR 67 Ca 0.21 0.85 -0.02 0.00 0.64 0.00 0.00 57.07 58.74 2ku7 s TYR 67 Cb -0.05 -2.47 0.04 0.00 0.42 0.00 0.00 41.96 39.90 2ku7 s TYR 67 CO 0.09 0.25 0.01 0.14 0.64 0.00 0.00 175.55 176.68 2ku7 s VAL 68 N 0.34 0.54 0.11 3.14 -7.23 -0.23 -2.39 120.40 114.69 2ku7 s VAL 68 Ca 0.24 -0.29 0.01 0.00 -1.81 0.00 0.00 61.98 60.12 2ku7 s VAL 68 Cb -0.15 -0.86 -0.04 0.00 0.56 0.00 0.00 36.38 35.88 2ku7 s VAL 68 CO 0.09 0.02 -0.02 -0.83 -0.31 0.00 0.00 175.10 174.06 2ku7 s GLY 69 N 1.88 0.86 0.00 2.32 0.00 -1.06 -0.27 107.32 111.04 2ku7 s GLY 69 Ca 0.02 -1.40 0.00 0.00 0.00 0.00 0.00 44.72 43.34 2ku7 s GLY 69 CO -0.07 -1.43 0.00 0.61 0.00 0.00 0.00 173.10 172.21 2ku7 n GLY 70 N -0.07 1.42 3.94 0.20 0.00 -0.42 -1.78 105.19 108.48 2ku7 n GLY 70 Ca -0.10 -0.21 -0.24 0.00 0.00 0.00 0.00 46.02 45.47 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 -0.07 3.50 0.59 0.99 1.02 -0.56 -4.02 118.68 120.13 2ku7 s LEU 71 Ca 0.00 0.40 -0.07 0.00 0.02 0.00 0.00 54.13 54.48 2ku7 s LEU 71 Cb 0.00 -3.26 -0.00 0.00 0.02 0.00 0.00 46.19 42.94 2ku7 s LEU 71 CO 0.00 -0.84 0.93 0.00 0.02 0.00 0.00 176.35 176.46 2ku7 s ALA 72 N -2.70 3.23 0.22 4.21 0.00 -1.26 -4.66 121.76 120.80 2ku7 s ALA 72 Ca 0.51 -0.53 -0.02 0.00 0.00 0.00 0.00 51.96 51.91 2ku7 s ALA 72 Cb -0.10 -2.72 0.21 0.00 0.00 0.00 0.00 23.12 20.51 2ku7 s ALA 72 CO 0.40 -0.76 1.60 0.93 0.00 0.00 0.00 175.76 177.94 2ku7 h GLU 73 N -0.20 0.62 0.00 0.00 5.08 -1.99 -2.91 114.58 115.19 2ku7 h GLU 73 Ca -0.45 -0.29 0.00 0.00 -1.00 0.00 0.00 59.36 57.61 2ku7 h GLU 73 Cb 1.24 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.48 2ku7 h GLU 73 CO 0.62 0.88 0.00 0.39 -1.00 0.00 0.00 179.01 179.90 2ku7 n GLU 74 N -4.06 0.04 -2.47 2.33 1.02 -1.26 -4.83 120.64 111.41 2ku7 n GLU 74 Ca -0.01 0.16 -0.40 0.00 -0.02 0.00 0.00 57.16 56.89 2ku7 n GLU 74 Cb 0.49 -1.56 -0.04 0.00 -0.02 0.00 0.00 31.44 30.31 2ku7 n GLU 74 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2ku7 s VAL 75 N -3.04 3.48 0.45 2.62 0.11 -1.10 -5.06 120.40 117.87 2ku7 s VAL 75 Ca 0.10 1.49 0.03 0.00 -2.93 0.00 0.00 61.98 60.67 2ku7 s VAL 75 Cb 0.13 -3.95 -0.02 0.00 -1.53 0.00 0.00 36.38 31.02 2ku7 s VAL 75 CO 0.40 0.35 0.09 -1.81 -3.33 0.00 0.00 175.10 170.81 2ku7 s ASP 76 N -0.89 3.30 0.33 3.54 1.01 -1.26 -4.95 116.67 117.75 2ku7 s ASP 76 Ca 0.45 -1.70 0.02 0.00 0.71 0.00 0.00 52.55 52.02 2ku7 s ASP 76 Cb -0.32 0.58 0.57 0.00 1.01 0.00 0.00 42.92 44.76 2ku7 s ASP 76 CO 0.41 -0.94 1.91 -0.78 0.21 0.00 0.00 175.17 175.98 2ku7 h ASP 77 N 1.60 0.64 -0.24 0.27 3.58 -1.97 -2.73 116.42 117.57 2ku7 h ASP 77 Ca -0.38 -0.08 -0.07 0.00 0.42 0.00 0.00 57.03 56.92 2ku7 h ASP 77 Cb 1.29 -0.17 -0.02 0.00 1.72 0.00 0.00 39.33 42.16 2ku7 h ASP 77 CO 0.61 0.60 -0.07 0.11 -2.88 0.00 0.00 179.24 177.61 2ku7 h LYS 78 N 0.70 0.60 -0.56 0.28 1.79 -2.00 -2.78 116.57 114.59 2ku7 h LYS 78 Ca 0.17 -0.16 -0.11 0.00 -2.18 0.00 0.00 60.65 58.37 2ku7 h LYS 78 Cb 0.17 -0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 30.73 2ku7 h LYS 78 CO -0.01 0.67 -0.06 0.28 -1.08 0.00 0.00 179.45 179.25 2ku7 h VAL 79 N 0.56 1.27 -0.38 0.50 2.07 -1.90 -2.72 116.25 115.64 2ku7 h VAL 79 Ca 0.11 -1.21 -0.12 0.00 0.82 0.00 0.00 66.70 66.30 2ku7 h VAL 79 Cb 0.46 0.89 -0.01 0.00 -1.52 0.00 0.00 31.29 31.11 2ku7 h VAL 79 CO 0.02 0.43 -0.23 0.25 0.02 0.00 0.00 177.57 178.07 2ku7 h LEU 80 N 0.93 0.78 -0.02 2.57 6.46 -1.35 -1.85 115.31 122.83 2ku7 h LEU 80 Ca 0.15 -0.28 -0.00 0.00 -0.12 0.00 0.00 57.88 57.63 2ku7 h LEU 80 Cb 0.62 -0.21 -0.00 0.00 -0.73 0.00 0.00 40.66 40.34 2ku7 h LEU 80 CO 0.04 0.99 -0.01 -0.74 -0.62 0.00 0.00 178.44 178.10 2ku7 h HIS 81 N 0.67 0.04 0.00 1.25 2.76 -1.47 -2.57 115.15 115.83 2ku7 h HIS 81 Ca 0.09 -0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.24 2ku7 h HIS 81 Cb 0.74 -0.01 -0.00 0.00 1.55 0.00 0.00 27.41 29.69 2ku7 h HIS 81 CO 0.04 0.44 -0.05 0.00 -1.30 0.00 0.00 177.93 177.06 2ku7 h ALA 82 N 0.59 1.01 0.09 5.26 0.00 -1.51 -0.35 119.26 124.34 2ku7 h ALA 82 Ca 0.00 -0.05 -0.30 0.00 0.00 0.00 0.00 54.91 54.57 2ku7 h ALA 82 Cb 0.43 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 2ku7 h ALA 82 CO 0.00 0.06 -1.52 0.00 0.00 0.00 0.00 179.25 177.79 2ku7 h ALA 83 N 1.95 0.37 -0.02 0.00 0.00 -1.34 -3.33 119.26 116.88 2ku7 h ALA 83 Ca -0.00 -1.16 0.00 0.00 0.00 0.00 0.00 54.91 53.75 2ku7 h ALA 83 Cb 0.58 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.65 2ku7 h ALA 83 CO 0.01 1.23 -0.13 1.19 0.00 0.00 0.00 179.25 181.55 2ku7 n PHE 84 N -3.38 0.00 0.11 0.00 3.72 -0.97 -4.43 117.46 112.51 2ku7 n PHE 84 Ca -0.15 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.23 2ku7 n PHE 84 Cb 1.03 -0.00 0.24 0.00 -0.94 0.00 0.00 39.48 39.81 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 3.78 1.31 -0.02 4.37 6.09 -1.17 -3.20 117.51 128.67 2ku7 h ILE 85 Ca 0.00 -1.54 0.01 0.00 -1.37 0.00 0.00 64.86 61.96 2ku7 h ILE 85 Cb 0.87 1.73 -0.00 0.00 0.47 0.00 0.00 36.82 39.89 2ku7 h ILE 85 CO 0.00 0.45 0.03 -0.65 -3.07 0.00 0.00 178.15 174.92 2ku7 h PRO 86 N 0.15 0.00 0.02 2.19 0.11 -1.80 -2.16 132.00 130.52 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 0.82 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.91 2ku7 h PRO 86 CO 0.06 0.00 -0.97 0.74 -0.21 0.00 0.00 178.00 177.63 2ku7 h PHE 87 N 0.00 0.14 0.00 0.65 0.04 -1.88 -3.50 116.94 112.39 2ku7 h PHE 87 Ca 0.01 -0.09 0.00 0.00 2.80 0.00 0.00 57.97 60.69 2ku7 h PHE 87 Cb 0.07 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.21 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 1.15 -0.72 3.75 -1.45 0.00 -0.81 -4.82 105.19 102.28 2ku7 n GLY 88 Ca -0.02 -0.93 -0.40 0.00 0.00 0.00 0.00 46.02 44.66 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 7.45 -0.04 1.61 1.01 -1.26 -4.49 116.67 116.94 2ku7 s ASP 89 Ca 0.00 1.73 0.05 0.00 0.71 0.00 0.00 52.55 55.04 2ku7 s ASP 89 Cb 0.00 -2.55 -0.02 0.00 1.01 0.00 0.00 42.92 41.35 2ku7 s ASP 89 CO 0.00 0.06 -0.18 -0.63 0.21 0.00 0.00 175.17 174.63 2ku7 s ILE 90 N -0.51 2.78 -0.14 0.77 1.01 -1.26 -2.87 121.20 120.97 2ku7 s ILE 90 Ca 0.42 -0.83 -0.11 0.00 0.00 0.00 0.00 60.65 60.13 2ku7 s ILE 90 Cb -0.23 -2.06 -0.04 0.00 0.01 0.00 0.00 42.46 40.14 2ku7 s ILE 90 CO 0.28 0.59 -0.21 0.35 0.00 0.00 0.00 174.94 175.95 2ku7 n THR 91 N 2.40 1.33 -3.86 2.92 -2.24 -0.50 -4.84 114.28 109.50 2ku7 n THR 91 Ca -0.17 0.22 -0.11 0.00 -2.27 0.00 0.00 64.05 61.72 2ku7 n THR 91 Cb 0.52 -2.31 -0.09 0.00 -2.10 0.00 0.00 70.33 66.34 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 -5.62 0.03 -0.19 3.42 1.01 -1.23 -5.04 116.67 109.06 2ku7 s ASP 92 Ca -0.17 -0.31 0.01 0.00 0.71 0.00 0.00 52.55 52.79 2ku7 s ASP 92 Cb 0.02 0.26 0.02 0.00 1.01 0.00 0.00 42.92 44.24 2ku7 s ASP 92 CO 0.26 -0.49 -0.19 -0.63 0.21 0.00 0.00 175.17 174.32 2ku7 s ILE 93 N -2.15 2.07 -0.11 0.77 -1.09 -1.26 -1.55 121.20 117.87 2ku7 s ILE 93 Ca -0.08 -0.99 0.03 0.00 -2.23 0.00 0.00 60.65 57.38 2ku7 s ILE 93 Cb -0.03 -1.89 -0.00 0.00 -1.58 0.00 0.00 42.46 38.96 2ku7 s ILE 93 CO -0.02 0.50 -0.21 -1.10 -1.23 0.00 0.00 174.94 172.88 2ku7 s GLN 94 N 1.28 3.13 -0.18 2.79 -0.21 -1.08 -5.03 119.66 120.35 2ku7 s GLN 94 Ca 0.04 -0.83 -0.00 0.00 0.02 0.00 0.00 55.36 54.59 2ku7 s GLN 94 Cb -0.13 -2.40 0.04 0.00 1.00 0.00 0.00 33.01 31.52 2ku7 s GLN 94 CO -0.12 0.16 -0.06 0.42 -2.12 0.00 0.00 175.29 173.56 2ku7 s ILE 95 N 0.41 1.24 -0.08 1.08 1.01 -1.26 -1.52 121.20 122.08 2ku7 s ILE 95 Ca -0.15 -0.75 -0.30 0.00 0.00 0.00 0.00 60.65 59.44 2ku7 s ILE 95 Cb -0.17 -1.41 -0.08 0.00 0.01 0.00 0.00 42.46 40.81 2ku7 s ILE 95 CO 0.07 0.11 2.05 -2.65 0.00 0.00 0.00 174.94 174.52 2ku7 n PRO 96 N 4.82 2.41 -4.76 2.79 -0.02 -1.26 -4.98 135.00 133.99 2ku7 n PRO 96 Ca -0.12 0.82 -0.25 0.00 -2.02 0.00 0.00 63.50 61.93 2ku7 n PRO 96 Cb 0.47 -3.00 -0.16 0.00 -0.02 0.00 0.00 33.50 30.79 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 5.74 1.91 0.13 2.45 2.96 -1.26 -4.58 118.68 126.02 2ku7 s LEU 97 Ca 0.94 -0.32 -0.10 0.00 -0.22 0.00 0.00 54.13 54.43 2ku7 s LEU 97 Cb -0.46 -0.90 -0.06 0.00 0.50 0.00 0.00 46.19 45.27 2ku7 s LEU 97 CO 0.42 0.15 0.45 -1.81 -1.32 0.00 0.00 176.35 174.24 2ku7 s ASP 98 N 0.02 6.66 0.29 3.68 1.01 -1.26 -4.94 116.67 122.13 2ku7 s ASP 98 Ca -0.03 0.85 0.00 0.00 0.71 0.00 0.00 52.55 54.09 2ku7 s ASP 98 Cb -0.11 -2.20 0.43 0.00 1.01 0.00 0.00 42.92 42.05 2ku7 s ASP 98 CO 0.02 0.10 1.81 1.88 0.21 0.00 0.00 175.17 179.19 2ku7 h TYR 99 N 3.39 0.75 0.01 4.23 0.05 -1.98 0.52 116.97 123.95 2ku7 h TYR 99 Ca -0.48 -0.09 -0.03 0.00 0.05 0.00 0.00 58.73 58.18 2ku7 h TYR 99 Cb 1.19 -0.21 0.00 0.00 1.01 0.00 0.00 36.73 38.71 2ku7 h TYR 99 CO 0.65 0.69 -0.11 1.49 -1.05 0.00 0.00 178.16 179.83 2ku7 h GLU 100 N 0.68 0.06 0.00 4.88 4.81 -2.02 -3.38 114.58 119.62 2ku7 h GLU 100 Ca 0.14 -0.08 -0.24 0.00 -0.13 0.00 0.00 59.36 59.05 2ku7 h GLU 100 Cb 0.38 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.74 2ku7 h GLU 100 CO 0.01 0.90 -1.52 1.79 -0.73 0.00 0.00 179.01 179.46 2ku7 h THR 101 N -0.74 0.82 -2.84 0.32 1.35 -1.98 -3.48 112.91 106.35 2ku7 h THR 101 Ca -0.02 -2.54 -0.21 0.00 -0.55 0.00 0.00 66.41 63.10 2ku7 h THR 101 Cb 0.94 2.34 -0.04 0.00 -1.73 0.00 0.00 68.15 69.66 2ku7 h THR 101 CO 0.02 0.46 -0.23 -0.62 -0.25 0.00 0.00 175.52 174.91 2ku7 n GLU 102 N -3.03 -1.82 -4.07 4.72 1.02 0.18 -4.94 120.64 112.70 2ku7 n GLU 102 Ca -0.13 0.55 -0.33 0.00 -0.02 0.00 0.00 57.16 57.24 2ku7 n GLU 102 Cb 0.97 -4.95 -0.07 0.00 -0.02 0.00 0.00 31.44 27.37 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 -4.01 3.11 0.15 3.49 1.02 -1.26 -4.88 119.74 117.34 2ku7 s LYS 103 Ca 0.00 -0.48 0.24 0.00 0.02 0.00 0.00 55.97 55.75 2ku7 s LYS 103 Cb 0.00 -2.88 0.32 0.00 -0.52 0.00 0.00 37.83 34.75 2ku7 s LYS 103 CO 0.00 0.64 1.31 1.12 -0.92 0.00 0.00 175.35 177.51 2ku7 h HIS 104 N 3.96 0.00 0.00 3.18 2.07 -1.92 -3.38 115.15 119.05 2ku7 h HIS 104 Ca -0.49 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.03 2ku7 h HIS 104 Cb 1.18 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.16 2ku7 h HIS 104 CO 0.64 0.00 0.00 0.54 -3.07 0.00 0.00 177.93 176.04 2ku7 n ARG 105 N -2.24 0.00 -0.25 5.12 1.74 -1.26 -3.18 116.66 116.59 2ku7 n ARG 105 Ca 0.03 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.11 2ku7 n ARG 105 Cb 0.46 -3.00 0.00 0.00 -1.02 0.00 0.00 32.46 28.90 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 0.87 3.10 -0.13 0.00 -1.26 -4.97 105.19 100.80 2ku7 n GLY 106 Ca 0.00 -0.27 -0.11 0.00 0.00 0.00 0.00 46.02 45.64 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 0.06 0.32 1.61 -0.71 -1.19 -1.31 117.98 114.75 2ku7 s PHE 107 Ca 0.00 -0.16 -0.15 0.00 -1.04 0.00 0.00 56.93 55.58 2ku7 s PHE 107 Cb 0.00 -0.06 0.02 0.00 -1.21 0.00 0.00 43.02 41.78 2ku7 s PHE 107 CO 0.00 -0.28 0.66 0.00 -1.34 0.00 0.00 175.22 174.25 2ku7 s ALA 108 N -1.40 -0.57 0.13 1.99 0.00 0.63 -4.58 121.76 117.96 2ku7 s ALA 108 Ca -0.15 -0.75 0.10 0.00 0.00 0.00 0.00 51.96 51.17 2ku7 s ALA 108 Cb -0.08 0.88 -0.04 0.00 0.00 0.00 0.00 23.12 23.89 2ku7 s ALA 108 CO 0.01 -0.95 -0.24 -0.06 0.00 0.00 0.00 175.76 174.53 2ku7 s PHE 109 N -3.30 2.11 -0.06 0.00 0.40 -0.58 -1.06 117.98 115.48 2ku7 s PHE 109 Ca 0.18 -0.40 0.05 0.00 -0.60 0.00 0.00 56.93 56.16 2ku7 s PHE 109 Cb -0.04 -1.12 -0.01 0.00 0.51 0.00 0.00 43.02 42.37 2ku7 s PHE 109 CO 0.11 0.32 -0.23 0.54 0.70 0.00 0.00 175.22 176.66 2ku7 s VAL 110 N -1.27 1.89 -0.15 -0.44 0.11 -0.53 -2.65 120.40 117.35 2ku7 s VAL 110 Ca 0.13 -0.97 -0.04 0.00 -2.93 0.00 0.00 61.98 58.17 2ku7 s VAL 110 Cb -0.09 -1.61 -0.03 0.00 -1.53 0.00 0.00 36.38 33.12 2ku7 s VAL 110 CO 0.06 0.53 -0.03 -0.70 -3.33 0.00 0.00 175.10 171.63 2ku7 s GLU 111 N -0.02 3.62 0.11 1.54 2.12 -0.59 -0.97 118.70 124.50 2ku7 s GLU 111 Ca -0.06 -0.50 0.09 0.00 0.36 0.00 0.00 54.97 54.86 2ku7 s GLU 111 Cb -0.14 -2.92 -0.04 0.00 0.26 0.00 0.00 34.13 31.29 2ku7 s GLU 111 CO 0.04 0.29 -0.19 -0.06 -0.54 0.00 0.00 175.26 174.81 2ku7 s PHE 112 N 0.23 2.52 0.15 5.30 0.40 0.38 -1.41 117.98 125.56 2ku7 s PHE 112 Ca -0.02 -0.27 -0.07 0.00 -0.60 0.00 0.00 56.93 55.96 2ku7 s PHE 112 Cb -0.14 -1.36 0.00 0.00 0.51 0.00 0.00 43.02 42.04 2ku7 s PHE 112 CO 0.03 0.36 1.44 1.49 0.70 0.00 0.00 175.22 179.24 2ku7 h GLU 113 N 3.88 0.71 -5.82 0.44 4.81 -1.85 -3.44 114.58 113.31 2ku7 h GLU 113 Ca -0.50 -0.47 -0.67 0.00 -0.13 0.00 0.00 59.36 57.60 2ku7 h GLU 113 Cb 1.17 0.06 -0.13 0.00 0.63 0.00 0.00 28.75 30.48 2ku7 h GLU 113 CO 0.46 1.09 -0.57 -0.51 -0.73 0.00 0.00 179.01 178.74 2ku7 s LEU 114 N -8.47 3.84 0.49 1.64 1.02 -1.26 -4.99 118.68 110.96 2ku7 s LEU 114 Ca -0.09 0.24 0.28 0.00 0.02 0.00 0.00 54.13 54.58 2ku7 s LEU 114 Cb 0.10 -1.91 0.84 0.00 0.02 0.00 0.00 46.19 45.25 2ku7 s LEU 114 CO 0.87 0.37 1.79 0.00 0.02 0.00 0.00 176.35 179.40 2ku7 h ALA 115 N 5.21 1.00 0.00 4.21 0.00 -1.91 -3.09 119.26 124.69 2ku7 h ALA 115 Ca -0.51 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.40 2ku7 h ALA 115 Cb 1.20 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2ku7 h ALA 115 CO 0.56 0.00 -0.00 1.49 0.00 0.00 0.00 179.25 181.31 2ku7 h GLU 116 N 0.00 -0.00 -0.09 0.00 4.81 -1.95 -2.89 114.58 114.46 2ku7 h GLU 116 Ca -0.00 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.13 2ku7 h GLU 116 Cb 0.77 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.13 2ku7 h GLU 116 CO 0.00 0.55 -0.41 0.38 -0.73 0.00 0.00 179.01 178.80 2ku7 h ASP 117 N -0.55 0.20 -0.34 1.04 3.04 -1.88 -2.54 116.42 115.40 2ku7 h ASP 117 Ca -0.00 -0.08 -0.03 0.00 -3.24 0.00 0.00 57.03 53.68 2ku7 h ASP 117 Cb 0.55 -0.06 -0.01 0.00 -1.04 0.00 0.00 39.33 38.77 2ku7 h ASP 117 CO 0.00 0.59 0.09 0.00 -2.04 0.00 0.00 179.24 177.89 2ku7 h ALA 118 N 1.42 0.44 0.00 4.15 0.00 -1.60 -0.40 119.26 123.28 2ku7 h ALA 118 Ca 0.01 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.70 2ku7 h ALA 118 Cb 0.79 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 2ku7 h ALA 118 CO 0.06 0.10 -0.25 0.00 0.00 0.00 0.00 179.25 179.16 2ku7 h ALA 119 N 0.93 1.52 -0.09 0.00 0.00 -1.44 -2.13 119.26 118.05 2ku7 h ALA 119 Ca 0.11 -0.23 -0.15 0.00 0.00 0.00 0.00 54.91 54.64 2ku7 h ALA 119 Cb 0.28 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2ku7 h ALA 119 CO -0.00 0.31 -0.58 0.00 0.00 0.00 0.00 179.25 178.98 2ku7 h ALA 120 N 1.75 0.83 -0.46 0.00 0.00 -1.00 -2.88 119.26 117.50 2ku7 h ALA 120 Ca -0.00 -0.53 -0.12 0.00 0.00 0.00 0.00 54.91 54.26 2ku7 h ALA 120 Cb 0.46 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 2ku7 h ALA 120 CO 0.03 0.71 -0.17 0.00 0.00 0.00 0.00 179.25 179.82 2ku7 h ALA 121 N 1.15 0.81 -0.33 0.00 0.00 -0.41 -2.10 119.26 118.39 2ku7 h ALA 121 Ca -0.00 -0.37 -0.16 0.00 0.00 0.00 0.00 54.91 54.39 2ku7 h ALA 121 Cb 1.09 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 2ku7 h ALA 121 CO 0.09 0.65 -0.40 0.82 0.00 0.00 0.00 179.25 180.41 2ku7 h ILE 122 N 0.80 1.28 0.00 0.00 2.04 -1.49 -2.24 117.51 117.90 2ku7 h ILE 122 Ca 0.12 -1.58 -0.11 0.00 1.00 0.00 0.00 64.86 64.28 2ku7 h ILE 122 Cb 0.72 1.52 -0.02 0.00 -0.74 0.00 0.00 36.82 38.30 2ku7 h ILE 122 CO 0.06 0.52 -0.52 -0.78 0.00 0.00 0.00 178.15 177.42 2ku7 h ASP 123 N 0.64 0.00 0.09 1.72 1.82 -1.48 -2.79 116.42 116.41 2ku7 h ASP 123 Ca 0.04 0.00 -0.27 0.00 -0.39 0.00 0.00 57.03 56.41 2ku7 h ASP 123 Cb 1.00 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 41.00 2ku7 h ASP 123 CO 0.10 0.52 -1.44 0.78 -1.61 0.00 0.00 179.24 177.59 2ku7 h ASN 124 N 0.00 0.29 -1.28 2.28 2.35 -1.39 -3.42 115.58 114.41 2ku7 h ASN 124 Ca -0.01 -0.80 -0.48 0.00 -0.55 0.00 0.00 56.30 54.46 2ku7 h ASN 124 Cb 0.93 -0.10 -0.41 0.00 0.05 0.00 0.00 38.32 38.80 2ku7 h ASN 124 CO 0.07 1.62 -0.95 0.23 -1.65 0.00 0.00 177.43 176.75 2ku7 n MET 125 N -3.97 2.37 -0.16 0.81 2.81 -0.84 -4.86 117.12 113.27 2ku7 n MET 125 Ca -0.27 -3.93 -0.05 0.00 -1.81 0.00 0.00 57.70 51.65 2ku7 n MET 125 Cb 0.87 -1.78 0.14 0.00 -0.71 0.00 0.00 33.22 31.74 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 2.78 0.86 -2.12 7.83 -0.73 -1.67 -3.37 115.58 119.16 2ku7 h ASN 126 Ca 0.11 -0.18 -0.54 0.00 1.87 0.00 0.00 56.30 57.57 2ku7 h ASN 126 Cb 1.04 -0.23 -0.36 0.00 0.27 0.00 0.00 38.32 39.05 2ku7 h ASN 126 CO 0.69 0.86 -0.96 -0.62 -0.37 0.00 0.00 177.43 177.03 2ku7 n GLU 127 N -4.25 0.34 -4.46 6.67 1.02 -1.24 -1.31 120.64 117.41 2ku7 n GLU 127 Ca 0.04 -3.05 -0.23 0.00 -0.02 0.00 0.00 57.16 53.90 2ku7 n GLU 127 Cb 0.26 -1.55 -0.10 0.00 -0.02 0.00 0.00 31.44 30.02 2ku7 n GLU 127 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 2ku7 s SER 128 N -0.18 3.21 -0.29 1.62 0.01 -1.14 -4.90 113.70 112.03 2ku7 s SER 128 Ca 0.33 -1.12 -0.21 0.00 1.31 0.00 0.00 55.95 56.27 2ku7 s SER 128 Cb 0.07 -0.25 -0.01 0.00 0.21 0.00 0.00 66.02 66.04 2ku7 s SER 128 CO -0.17 -0.17 0.65 -0.70 0.41 0.00 0.00 173.24 173.25 2ku7 s GLU 129 N -3.62 3.98 -0.10 12.44 2.12 -1.26 -0.43 118.70 131.83 2ku7 s GLU 129 Ca 0.29 0.42 0.03 0.00 0.36 0.00 0.00 54.97 56.07 2ku7 s GLU 129 Cb 0.00 -3.70 0.01 0.00 0.26 0.00 0.00 34.13 30.70 2ku7 s GLU 129 CO 0.13 -0.52 -0.20 -1.17 -0.54 0.00 0.00 175.26 172.95 2ku7 s LEU 130 N 2.61 1.97 -1.86 2.70 2.96 0.21 -4.71 118.68 122.56 2ku7 s LEU 130 Ca 0.26 -0.51 0.00 0.00 -0.22 0.00 0.00 54.13 53.67 2ku7 s LEU 130 Cb -0.15 -1.28 0.00 0.00 0.50 0.00 0.00 46.19 45.26 2ku7 s LEU 130 CO 0.11 0.10 0.00 0.33 -1.32 0.00 0.00 176.35 175.57 2ku7 n PHE 131 N 3.76 -0.21 -0.15 5.38 -0.00 -1.26 -1.23 117.46 123.75 2ku7 n PHE 131 Ca -0.20 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.25 2ku7 n PHE 131 Cb 0.52 -3.12 0.00 0.00 -0.00 0.00 0.00 39.48 36.88 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 -0.36 0.74 3.27 7.13 0.00 -1.26 -4.77 105.19 109.94 2ku7 n GLY 132 Ca -0.18 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.64 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 1.09 0.05 1.61 0.52 -0.37 -5.09 118.95 115.92 2ku7 s ARG 133 Ca 0.00 -1.26 -0.30 0.00 -0.52 0.00 0.00 55.73 53.65 2ku7 s ARG 133 Cb 0.00 -1.07 -0.04 0.00 0.52 0.00 0.00 34.95 34.35 2ku7 s ARG 133 CO 0.00 0.22 0.97 0.99 0.02 0.00 0.00 175.30 177.50 2ku7 s THR 134 N -1.95 4.69 0.18 0.02 2.01 -1.26 0.64 115.64 119.98 2ku7 s THR 134 Ca 0.10 2.06 0.11 0.00 0.31 0.00 0.00 61.69 64.27 2ku7 s THR 134 Cb -0.06 -4.32 -0.04 0.00 0.01 0.00 0.00 72.50 68.09 2ku7 s THR 134 CO 0.04 0.23 -0.23 0.27 -0.69 0.00 0.00 174.62 174.24 2ku7 s ILE 135 N 0.54 2.41 -0.05 1.82 -4.36 0.43 -4.34 121.20 117.64 2ku7 s ILE 135 Ca 0.50 -1.97 0.05 0.00 -0.26 0.00 0.00 60.65 58.96 2ku7 s ILE 135 Cb -0.22 -2.15 -0.00 0.00 1.25 0.00 0.00 42.46 41.34 2ku7 s ILE 135 CO 0.29 -0.09 -0.20 -0.13 0.24 0.00 0.00 174.94 175.05 2ku7 s ARG 136 N -2.61 2.06 -0.03 0.37 0.52 -0.73 -2.88 118.95 115.65 2ku7 s ARG 136 Ca 0.20 -0.70 0.03 0.00 -0.52 0.00 0.00 55.73 54.75 2ku7 s ARG 136 Cb -0.08 -1.76 -0.00 0.00 0.52 0.00 0.00 34.95 33.63 2ku7 s ARG 136 CO 0.10 0.27 -0.13 0.14 0.02 0.00 0.00 175.30 175.70 2ku7 s VAL 137 N 0.02 1.11 0.30 3.52 -7.23 -0.43 -2.56 120.40 115.12 2ku7 s VAL 137 Ca -0.05 -0.54 -0.07 0.00 -1.81 0.00 0.00 61.98 59.51 2ku7 s VAL 137 Cb -0.13 -0.96 0.00 0.00 0.56 0.00 0.00 36.38 35.85 2ku7 s VAL 137 CO 0.03 0.33 0.47 0.54 -0.31 0.00 0.00 175.10 176.16 2ku7 s ASN 138 N 0.12 0.41 0.08 4.85 2.20 -1.00 -4.73 114.94 116.86 2ku7 s ASN 138 Ca -0.03 -1.24 -0.31 0.00 -0.94 0.00 0.00 52.86 50.34 2ku7 s ASN 138 Cb -0.10 0.63 -0.06 0.00 -2.00 0.00 0.00 41.25 39.72 2ku7 s ASN 138 CO 0.01 -1.23 1.22 -0.76 -2.94 0.00 0.00 177.10 173.40 2ku7 s LEU 139 N -3.14 4.38 0.00 3.54 1.43 -1.26 0.11 118.68 123.74 2ku7 s LEU 139 Ca 0.27 2.07 0.24 0.00 -1.03 0.00 0.00 54.13 55.68 2ku7 s LEU 139 Cb -0.00 -3.58 0.23 0.00 0.03 0.00 0.00 46.19 42.86 2ku7 s LEU 139 CO 0.15 -0.48 1.28 0.00 0.23 0.00 0.00 176.35 177.53