#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 4.06 0.21 -1.46 1.00 -1.26 -5.00 119.30 116.85 2ku7 s MET 2 Ca 0.00 -0.14 -0.04 0.00 0.00 0.00 0.00 55.69 55.51 2ku7 s MET 2 Cb 0.00 -3.38 0.16 0.00 0.00 0.00 0.00 34.83 31.61 2ku7 s MET 2 CO 0.00 0.38 1.59 0.52 0.00 0.00 0.00 175.02 177.51 2ku7 h MET 3 N 6.33 0.72 -6.79 2.03 2.86 -2.10 -3.44 114.93 114.53 2ku7 h MET 3 Ca -0.44 -0.33 -0.69 0.00 -2.06 0.00 0.00 59.70 56.18 2ku7 h MET 3 Cb 1.17 -0.01 -0.22 0.00 0.06 0.00 0.00 31.60 32.60 2ku7 h MET 3 CO 0.72 0.94 -0.85 -0.65 1.06 0.00 0.00 176.91 178.14 2ku7 s GLN 4 N -4.42 1.65 -0.04 1.72 -0.21 -1.26 -5.14 119.66 111.95 2ku7 s GLN 4 Ca -0.09 -1.22 0.03 0.00 0.02 0.00 0.00 55.36 54.10 2ku7 s GLN 4 Cb 0.12 -2.00 0.01 0.00 1.00 0.00 0.00 33.01 32.14 2ku7 s GLN 4 CO 0.84 0.48 -0.11 0.00 -2.12 0.00 0.00 175.29 174.38 2ku7 n GLY 6 N 3.48 1.91 3.90 0.00 0.00 -1.26 -5.16 105.19 108.06 2ku7 n GLY 6 Ca -0.20 0.11 -0.30 0.00 0.00 0.00 0.00 46.02 45.62 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 2.22 3.67 -0.08 1.61 1.02 -1.26 -5.10 119.74 121.81 2ku7 s LYS 7 Ca 0.00 0.05 0.04 0.00 0.02 0.00 0.00 55.97 56.07 2ku7 s LYS 7 Cb 0.00 -2.70 0.00 0.00 -0.52 0.00 0.00 37.83 34.62 2ku7 s LYS 7 CO 0.00 0.30 -0.21 0.00 -0.92 0.00 0.00 175.35 174.52 2ku7 s ASP 9 N 0.32 6.51 -0.00 0.00 1.01 -1.26 -5.11 116.67 118.14 2ku7 s ASP 9 Ca -0.15 0.65 0.08 0.00 0.71 0.00 0.00 52.55 53.84 2ku7 s ASP 9 Cb -0.17 -2.12 -0.02 0.00 1.01 0.00 0.00 42.92 41.63 2ku7 s ASP 9 CO 0.07 0.02 -0.25 -0.13 0.21 0.00 0.00 175.17 175.09 2ku7 s ARG 10 N -2.70 2.06 0.16 8.23 0.52 -1.26 -5.05 118.95 120.91 2ku7 s ARG 10 Ca 0.42 -0.96 -0.08 0.00 -0.52 0.00 0.00 55.73 54.59 2ku7 s ARG 10 Cb -0.12 -2.05 0.01 0.00 0.52 0.00 0.00 34.95 33.31 2ku7 s ARG 10 CO 0.24 0.55 1.48 -1.49 0.02 0.00 0.00 175.30 176.10 2ku7 h TRP 11 N 5.28 0.97 -3.72 -0.53 4.06 -2.08 -3.38 115.95 116.56 2ku7 h TRP 11 Ca -0.44 -0.32 -0.79 0.00 2.06 0.00 0.00 58.89 59.40 2ku7 h TRP 11 Cb 1.13 -0.19 -0.27 0.00 -1.00 0.00 0.00 29.16 28.82 2ku7 h TRP 11 CO 0.42 1.11 0.19 0.14 -3.56 0.00 0.00 178.44 176.74 2ku7 s VAL 12 N -4.22 5.62 0.17 1.49 -7.23 -1.26 -4.89 120.40 110.08 2ku7 s VAL 12 Ca -0.10 -2.84 -0.10 0.00 -1.81 0.00 0.00 61.98 57.13 2ku7 s VAL 12 Cb 0.11 -4.45 0.05 0.00 0.56 0.00 0.00 36.38 32.65 2ku7 s VAL 12 CO 0.87 -1.08 1.62 0.45 -0.31 0.00 0.00 175.10 176.66 2ku7 h HIS 13 N 7.33 1.11 -0.68 2.82 3.86 -1.97 -3.09 115.15 124.53 2ku7 h HIS 13 Ca 0.13 -0.20 -0.05 0.00 -1.16 0.00 0.00 60.37 59.09 2ku7 h HIS 13 Cb 0.98 -0.29 -0.03 0.00 1.06 0.00 0.00 27.41 29.13 2ku7 h HIS 13 CO 0.93 1.00 0.22 0.77 0.86 0.00 0.00 177.93 181.71 2ku7 h SER 14 N 0.90 0.96 -0.08 2.45 0.02 -1.90 0.19 113.55 116.08 2ku7 h SER 14 Ca 0.16 -0.16 -0.13 0.00 -0.84 0.00 0.00 61.79 60.82 2ku7 h SER 14 Cb 0.57 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.84 2ku7 h SER 14 CO 0.03 0.89 -0.36 0.11 -1.14 0.00 0.00 176.83 176.36 2ku7 h LYS 15 N 1.00 0.59 0.18 3.45 1.57 -1.98 -3.30 116.57 118.08 2ku7 h LYS 15 Ca 0.22 -0.28 -0.35 0.00 -1.87 0.00 0.00 60.65 58.38 2ku7 h LYS 15 Cb 0.26 -0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.58 2ku7 h LYS 15 CO -0.01 0.86 -1.74 0.00 -0.57 0.00 0.00 179.45 177.99 2ku7 s GLU 17 N -2.57 3.40 0.11 0.00 2.02 0.65 -5.12 118.70 117.19 2ku7 s GLU 17 Ca -0.17 -0.34 0.06 0.00 0.02 0.00 0.00 54.97 54.54 2ku7 s GLU 17 Cb 0.05 -3.07 -0.04 0.00 0.10 0.00 0.00 34.13 31.17 2ku7 s GLU 17 CO 0.84 0.67 -0.03 -0.80 0.02 0.00 0.00 175.26 175.97 2ku7 s ASN 18 N -1.94 4.82 0.02 -0.19 -0.87 -1.26 -4.54 114.94 110.97 2ku7 s ASN 18 Ca 0.27 -0.26 -0.10 0.00 -1.57 0.00 0.00 52.86 51.20 2ku7 s ASN 18 Cb -0.13 -1.07 -0.05 0.00 -0.02 0.00 0.00 41.25 39.98 2ku7 s ASN 18 CO 0.19 0.16 0.34 -0.22 -2.57 0.00 0.00 177.10 175.00 2ku7 s LEU 19 N -2.37 4.40 0.74 0.60 2.96 -1.26 -5.09 118.68 118.67 2ku7 s LEU 19 Ca 0.25 0.76 -0.11 0.00 -0.22 0.00 0.00 54.13 54.80 2ku7 s LEU 19 Cb -0.11 -2.68 0.04 0.00 0.50 0.00 0.00 46.19 43.94 2ku7 s LEU 19 CO 0.17 0.27 1.09 -0.94 -1.32 0.00 0.00 176.35 175.61 2ku7 s SER 20 N -1.45 4.74 0.34 3.68 1.04 -1.26 -4.89 113.70 115.90 2ku7 s SER 20 Ca 0.27 1.81 0.04 0.00 0.48 0.00 0.00 55.95 58.55 2ku7 s SER 20 Cb -0.14 -2.52 0.62 0.00 0.10 0.00 0.00 66.02 64.07 2ku7 s SER 20 CO 0.14 -1.88 1.92 0.44 0.98 0.00 0.00 173.24 174.84 2ku7 h ASP 21 N -0.89 0.56 -0.17 7.02 3.32 -1.99 -2.22 116.42 122.04 2ku7 h ASP 21 Ca -0.44 -0.08 -0.05 0.00 0.02 0.00 0.00 57.03 56.49 2ku7 h ASP 21 Cb 1.23 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 40.63 2ku7 h ASP 21 CO 0.53 0.55 -0.07 -0.08 -1.72 0.00 0.00 179.24 178.45 2ku7 h GLU 22 N 0.61 0.36 -0.49 3.56 4.57 -2.00 -2.73 114.58 118.45 2ku7 h GLU 22 Ca 0.14 -0.15 -0.12 0.00 -1.18 0.00 0.00 59.36 58.06 2ku7 h GLU 22 Cb 0.20 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 28.76 2ku7 h GLU 22 CO -0.01 0.65 -0.15 0.52 -1.18 0.00 0.00 179.01 178.85 2ku7 h MET 23 N 0.05 0.95 -0.62 1.92 2.86 -1.93 -2.64 114.93 115.52 2ku7 h MET 23 Ca 0.04 -0.36 -0.04 0.00 -2.06 0.00 0.00 59.70 57.27 2ku7 h MET 23 Cb 0.54 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 32.12 2ku7 h MET 23 CO 0.02 1.03 0.22 -0.92 1.06 0.00 0.00 176.91 178.32 2ku7 h TYR 24 N 0.84 0.97 -0.30 -0.22 3.20 -1.44 -2.05 116.97 117.97 2ku7 h TYR 24 Ca 0.13 -0.09 -0.16 0.00 3.14 0.00 0.00 58.73 61.74 2ku7 h TYR 24 Cb 0.70 -0.28 -0.00 0.00 1.54 0.00 0.00 36.73 38.68 2ku7 h TYR 24 CO 0.04 0.79 -0.47 0.93 -1.64 0.00 0.00 178.16 177.81 2ku7 h GLU 25 N 0.87 0.80 -0.21 1.82 5.08 -1.46 -1.46 114.58 120.03 2ku7 h GLU 25 Ca 0.20 -0.46 -0.06 0.00 -1.00 0.00 0.00 59.36 58.05 2ku7 h GLU 25 Cb 0.25 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.53 2ku7 h GLU 25 CO -0.01 1.09 -0.09 0.82 -1.00 0.00 0.00 179.01 179.82 2ku7 h ILE 26 N 0.64 1.30 -0.37 3.13 2.04 -1.41 0.16 117.51 123.00 2ku7 h ILE 26 Ca 0.03 -1.14 -0.14 0.00 1.00 0.00 0.00 64.86 64.61 2ku7 h ILE 26 Cb 1.04 1.62 -0.01 0.00 -0.74 0.00 0.00 36.82 38.73 2ku7 h ILE 26 CO 0.10 0.35 -0.32 -0.07 0.00 0.00 0.00 178.15 178.21 2ku7 h LEU 27 N 0.13 0.92 -0.34 1.44 3.38 -1.43 -3.19 115.31 116.22 2ku7 h LEU 27 Ca 0.05 -0.45 -0.17 0.00 0.09 0.00 0.00 57.88 57.39 2ku7 h LEU 27 Cb 0.57 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 2ku7 h LEU 27 CO 0.03 1.18 -0.83 0.77 0.09 0.00 0.00 178.44 179.68 2ku7 h SER 28 N 0.67 0.00 -3.95 -0.43 4.64 -1.31 -3.39 113.55 109.78 2ku7 h SER 28 Ca 0.07 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.76 2ku7 h SER 28 Cb 0.90 0.00 -0.41 0.00 -0.31 0.00 0.00 62.40 62.58 2ku7 h SER 28 CO 0.08 0.83 -0.66 0.20 -0.87 0.00 0.00 176.83 176.41 2ku7 s ASN 29 N -6.77 4.11 0.15 4.97 0.01 0.57 -5.07 114.94 112.91 2ku7 s ASN 29 Ca -0.00 -2.98 0.09 0.00 -0.71 0.00 0.00 52.86 49.27 2ku7 s ASN 29 Cb 0.11 -1.43 -0.04 0.00 0.41 0.00 0.00 41.25 40.30 2ku7 s ASN 29 CO 0.79 -0.23 -0.22 -1.48 -1.51 0.00 0.00 177.10 174.46 2ku7 s LEU 30 N -0.20 2.38 -0.03 0.60 0.05 -1.21 -4.45 118.68 115.82 2ku7 s LEU 30 Ca 0.18 -0.80 -0.30 0.00 0.05 0.00 0.00 54.13 53.26 2ku7 s LEU 30 Cb -0.23 -0.98 -0.04 0.00 -2.05 0.00 0.00 46.19 42.89 2ku7 s LEU 30 CO -0.02 0.06 1.24 -2.84 -0.55 0.00 0.00 176.35 174.24 2ku7 s PRO 31 N -2.41 4.35 0.47 1.48 0.02 -1.26 -4.93 135.00 132.72 2ku7 s PRO 31 Ca 0.14 1.74 0.24 0.00 0.02 0.00 0.00 61.00 63.14 2ku7 s PRO 31 Cb -0.08 -3.53 1.27 0.00 0.02 0.00 0.00 34.50 32.18 2ku7 s PRO 31 CO 0.07 -0.45 1.85 0.93 -0.33 0.00 0.00 177.00 179.07 2ku7 h GLU 32 N 7.45 0.21 0.19 5.54 5.08 -2.00 0.76 114.58 131.81 2ku7 h GLU 32 Ca -0.36 -0.01 -0.30 0.00 -1.00 0.00 0.00 59.36 57.69 2ku7 h GLU 32 Cb 1.17 -0.05 0.02 0.00 0.50 0.00 0.00 28.75 30.39 2ku7 h GLU 32 CO 0.88 0.14 -1.40 0.66 -1.00 0.00 0.00 179.01 178.29 2ku7 h SER 33 N 0.22 0.62 0.58 1.42 4.64 -1.96 -3.32 113.55 115.75 2ku7 h SER 33 Ca 0.48 -0.92 -0.07 0.00 -0.47 0.00 0.00 61.79 60.81 2ku7 h SER 33 Cb 1.50 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 63.38 2ku7 h SER 33 CO -0.12 1.65 -0.31 0.58 -0.87 0.00 0.00 176.83 177.76 2ku7 h VAL 34 N -0.07 0.93 -0.08 0.95 2.07 -1.60 -1.45 116.25 117.01 2ku7 h VAL 34 Ca -0.27 -1.21 -0.08 0.00 0.82 0.00 0.00 66.70 65.97 2ku7 h VAL 34 Cb 1.96 1.71 -0.01 0.00 -1.52 0.00 0.00 31.29 33.43 2ku7 h VAL 34 CO 0.18 0.31 -0.33 0.00 0.02 0.00 0.00 177.57 177.75 2ku7 h ALA 35 N 1.69 1.31 0.00 1.67 0.00 -1.03 -3.45 119.26 119.44 2ku7 h ALA 35 Ca -0.00 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2ku7 h ALA 35 Cb 0.69 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.40 2ku7 h ALA 35 CO 0.04 0.49 0.00 2.48 0.00 0.00 0.00 179.25 182.26 2ku7 n TYR 36 N -4.11 -1.22 -1.75 0.00 4.11 -1.03 -4.96 117.16 108.19 2ku7 n TYR 36 Ca -0.01 0.00 -0.08 0.00 -0.00 0.00 0.00 57.90 57.80 2ku7 n TYR 36 Cb 0.40 0.24 -0.02 0.00 -0.00 0.00 0.00 39.34 39.96 2ku7 n TYR 36 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 176.86 174.49 2ku7 n THR 37 N -2.01 -0.16 -0.09 -3.48 5.66 -0.57 -4.79 114.28 108.83 2ku7 n THR 37 Ca 0.00 0.00 -0.21 0.00 -3.05 0.00 0.00 64.05 60.79 2ku7 n THR 37 Cb 0.00 -0.94 -0.12 0.00 -1.55 0.00 0.00 70.33 67.72 2ku7 n THR 37 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2ku7 s VAL 39 N -2.52 2.18 -0.13 0.00 1.01 -1.26 -5.12 120.40 114.56 2ku7 s VAL 39 Ca -0.31 -1.00 -0.00 0.00 0.00 0.00 0.00 61.98 60.66 2ku7 s VAL 39 Cb 0.09 -1.82 -0.02 0.00 0.00 0.00 0.00 36.38 34.63 2ku7 s VAL 39 CO 0.64 0.56 -0.12 0.21 0.00 0.00 0.00 175.10 176.39 2ku7 s ASN 40 N 0.02 4.09 -0.20 3.32 2.47 -1.26 -5.09 114.94 118.29 2ku7 s ASN 40 Ca -0.09 -0.30 0.02 0.00 0.42 0.00 0.00 52.86 52.90 2ku7 s ASN 40 Cb -0.15 -1.61 0.03 0.00 -1.45 0.00 0.00 41.25 38.07 2ku7 s ASN 40 CO 0.06 0.17 -0.16 0.00 -3.72 0.00 0.00 177.10 173.45 2ku7 n THR 42 N 4.58 0.14 0.07 0.00 -2.24 -1.26 -4.32 114.28 111.26 2ku7 n THR 42 Ca -0.18 -0.42 -0.03 0.00 -2.27 0.00 0.00 64.05 61.15 2ku7 n THR 42 Cb 0.47 0.07 0.21 0.00 -2.10 0.00 0.00 70.33 68.98 2ku7 n THR 42 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2ku7 h GLU 43 N 0.00 0.31 -6.34 -0.78 5.08 -2.07 -3.43 114.58 107.35 2ku7 h GLU 43 Ca 0.00 -0.14 -0.69 0.00 -1.00 0.00 0.00 59.36 57.53 2ku7 h GLU 43 Cb 0.91 -0.01 -0.29 0.00 0.50 0.00 0.00 28.75 29.86 2ku7 h GLU 43 CO 0.00 0.65 -0.87 1.03 -1.00 0.00 0.00 179.01 178.82 2ku7 s ARG 44 N -4.22 2.35 0.09 2.33 0.52 -1.26 -5.14 118.95 113.62 2ku7 s ARG 44 Ca -0.05 -0.88 0.05 0.00 -0.52 0.00 0.00 55.73 54.33 2ku7 s ARG 44 Cb 0.13 -2.15 -0.03 0.00 0.52 0.00 0.00 34.95 33.43 2ku7 s ARG 44 CO 0.78 0.50 -0.14 -1.01 0.02 0.00 0.00 175.30 175.45 2ku7 s HIS 45 N -0.45 1.26 -0.01 -0.53 3.76 -1.26 -4.89 115.29 113.16 2ku7 s HIS 45 Ca 0.05 -0.51 0.04 0.00 -0.15 0.00 0.00 55.06 54.49 2ku7 s HIS 45 Cb -0.11 -0.69 -0.01 0.00 1.11 0.00 0.00 32.58 32.88 2ku7 s HIS 45 CO 0.01 0.08 -0.14 0.54 -0.85 0.00 0.00 174.74 174.37 2ku7 s VAL 46 N -1.67 1.14 -0.15 -0.90 0.11 -1.26 -5.14 120.40 112.53 2ku7 s VAL 46 Ca 0.02 -0.61 -0.13 0.00 -2.93 0.00 0.00 61.98 58.33 2ku7 s VAL 46 Cb -0.08 -0.95 -0.05 0.00 -1.53 0.00 0.00 36.38 33.78 2ku7 s VAL 46 CO 0.02 0.32 0.29 -0.62 -3.33 0.00 0.00 175.10 171.79 2ku7 s ASP 47 N -0.30 6.45 0.00 3.54 2.15 -1.26 -4.19 116.67 123.06 2ku7 s ASP 47 Ca 0.05 0.53 0.00 0.00 0.43 0.00 0.00 52.55 53.56 2ku7 s ASP 47 Cb -0.06 -2.18 0.00 0.00 -0.30 0.00 0.00 42.92 40.38 2ku7 s ASP 47 CO -0.00 0.13 0.00 0.61 -0.17 0.00 0.00 175.17 175.74 2ku7 n GLY 48 N 3.21 0.89 0.43 2.66 0.00 -1.26 -4.97 105.19 106.15 2ku7 n GLY 48 Ca -0.12 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.02 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 -2.09 -0.06 3.28 -0.02 0.00 -1.26 -4.85 105.19 100.19 2ku7 n GLY 49 Ca 0.00 -0.40 -0.29 0.00 0.00 0.00 0.00 46.02 45.34 2ku7 n GLY 49 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ku7 s SER 50 N -1.84 2.77 -0.00 1.61 0.15 -1.26 -4.67 113.70 110.47 2ku7 s SER 50 Ca 0.37 -0.48 -0.10 0.00 0.70 0.00 0.00 55.95 56.43 2ku7 s SER 50 Cb 0.20 -0.28 0.03 0.00 -1.71 0.00 0.00 66.02 64.26 2ku7 s SER 50 CO 0.31 0.25 0.47 0.61 1.20 0.00 0.00 173.24 176.09 2ku7 n GLY 51 N 2.20 0.53 0.00 9.45 0.00 -1.26 -5.17 105.19 110.94 2ku7 n GLY 51 Ca -0.16 -0.92 0.00 0.00 0.00 0.00 0.00 46.02 44.94 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 -0.34 1.77 0.29 -0.02 0.00 -1.26 -4.92 105.19 100.72 2ku7 n GLY 52 Ca 0.01 -1.38 -0.03 0.00 0.00 0.00 0.00 46.02 44.63 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 0.74 0.00 1.61 0.02 -2.02 -3.47 113.55 110.43 2ku7 h SER 53 Ca 0.00 -0.15 0.00 0.00 -0.84 0.00 0.00 61.79 60.80 2ku7 h SER 53 Cb 0.00 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 62.35 2ku7 h SER 53 CO 0.00 0.76 0.00 0.61 -1.14 0.00 0.00 176.83 177.06 2ku7 n GLY 54 N -0.79 0.73 0.24 -3.77 0.00 -1.26 -4.97 105.19 95.36 2ku7 n GLY 54 Ca 0.03 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.91 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 0.91 -3.80 -0.02 0.00 -2.03 -3.45 103.07 94.67 2ku7 h GLY 55 Ca 0.00 -1.03 -0.51 0.00 0.00 0.00 0.00 47.33 45.79 2ku7 h GLY 55 CO 0.00 0.92 -0.80 -1.35 0.00 0.00 0.00 176.54 175.32 2ku7 s SER 56 N -6.83 2.44 0.00 0.19 1.04 -1.26 -5.14 113.70 104.14 2ku7 s SER 56 Ca -0.11 -0.76 0.00 0.00 0.48 0.00 0.00 55.95 55.55 2ku7 s SER 56 Cb 0.10 -0.13 0.00 0.00 0.10 0.00 0.00 66.02 66.09 2ku7 s SER 56 CO 0.87 -0.02 0.00 0.61 0.98 0.00 0.00 173.24 175.69 2ku7 n GLY 57 N 0.73 -1.40 0.00 7.32 0.00 -1.26 -5.02 105.19 105.56 2ku7 n GLY 57 Ca -0.17 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 44.86 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 -0.09 0.77 3.47 -0.02 0.00 -1.26 -4.95 105.19 103.10 2ku7 n GLY 58 Ca 0.00 -0.73 -0.31 0.00 0.00 0.00 0.00 46.02 44.99 2ku7 n GLY 58 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ku7 s SER 59 N -4.00 3.88 0.00 1.61 0.15 -1.26 -5.14 113.70 108.94 2ku7 s SER 59 Ca 0.00 -0.41 -0.01 0.00 0.70 0.00 0.00 55.95 56.23 2ku7 s SER 59 Cb 0.00 -0.65 -0.04 0.00 -1.71 0.00 0.00 66.02 63.62 2ku7 s SER 59 CO 0.00 0.25 0.14 0.00 1.20 0.00 0.00 173.24 174.83 2ku7 s ALA 60 N -0.95 3.80 0.20 5.45 0.00 -1.26 -5.12 121.76 123.88 2ku7 s ALA 60 Ca 0.15 -0.82 0.09 0.00 0.00 0.00 0.00 51.96 51.38 2ku7 s ALA 60 Cb -0.11 -1.74 -0.04 0.00 0.00 0.00 0.00 23.12 21.23 2ku7 s ALA 60 CO 0.06 0.73 -0.17 0.95 0.00 0.00 0.00 175.76 177.32 2ku7 s THR 61 N -1.29 1.92 -1.54 0.00 -4.23 -1.26 -4.80 115.64 104.44 2ku7 s THR 61 Ca 0.26 -2.11 -0.15 0.00 -1.18 0.00 0.00 61.69 58.51 2ku7 s THR 61 Cb -0.12 -2.00 0.13 0.00 1.34 0.00 0.00 72.50 71.84 2ku7 s THR 61 CO 0.17 -0.42 0.72 0.35 -0.54 0.00 0.00 174.62 174.90 2ku7 n THR 62 N -0.10 -1.09 -3.97 3.99 -2.24 -1.26 -4.96 114.28 104.65 2ku7 n THR 62 Ca -0.10 0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.32 2ku7 n THR 62 Cb 0.59 -1.81 -0.07 0.00 -2.10 0.00 0.00 70.33 66.93 2ku7 n THR 62 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2ku7 s LYS 63 N -6.61 3.53 0.00 -0.78 -0.14 -1.26 -4.99 119.74 109.49 2ku7 s LYS 63 Ca 0.63 -0.22 0.18 0.00 -1.36 0.00 0.00 55.97 55.20 2ku7 s LYS 63 Cb -0.34 -3.15 0.07 0.00 -1.68 0.00 0.00 37.83 32.72 2ku7 s LYS 63 CO 0.78 0.63 0.98 0.54 -0.76 0.00 0.00 175.35 177.52 2ku7 n ARG 64 N 2.44 1.57 -4.50 1.68 1.74 -1.26 -4.72 116.66 113.61 2ku7 n ARG 64 Ca -0.19 -1.20 -0.34 0.00 -0.77 0.00 0.00 57.85 55.36 2ku7 n ARG 64 Cb 0.54 -1.33 -0.12 0.00 -1.02 0.00 0.00 32.46 30.53 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 -1.77 3.76 0.15 1.55 1.01 -1.26 -0.42 120.40 123.42 2ku7 s VAL 65 Ca 0.18 -0.42 0.09 0.00 0.00 0.00 0.00 61.98 61.83 2ku7 s VAL 65 Cb 0.14 -2.62 -0.04 0.00 0.00 0.00 0.00 36.38 33.87 2ku7 s VAL 65 CO 0.34 0.52 -0.22 -0.76 0.00 0.00 0.00 175.10 174.98 2ku7 s LEU 66 N 0.07 2.38 -0.32 3.92 1.43 0.13 -0.39 118.68 125.90 2ku7 s LEU 66 Ca -0.01 -0.79 -0.12 0.00 -1.03 0.00 0.00 54.13 52.18 2ku7 s LEU 66 Cb -0.14 -0.98 -0.02 0.00 0.03 0.00 0.00 46.19 45.08 2ku7 s LEU 66 CO 0.03 0.06 0.22 -0.47 0.23 0.00 0.00 176.35 176.42 2ku7 s TYR 67 N -1.53 3.22 -0.23 0.29 5.04 0.19 -0.37 117.35 123.96 2ku7 s TYR 67 Ca 0.14 -0.20 -0.02 0.00 -2.44 0.00 0.00 57.07 54.54 2ku7 s TYR 67 Cb -0.08 -2.44 0.01 0.00 0.35 0.00 0.00 41.96 39.80 2ku7 s TYR 67 CO 0.06 -0.34 -0.07 0.14 -1.34 0.00 0.00 175.55 174.01 2ku7 s VAL 68 N 1.71 3.00 0.10 3.14 -7.23 0.63 -1.53 120.40 120.22 2ku7 s VAL 68 Ca 0.06 -0.80 0.05 0.00 -1.81 0.00 0.00 61.98 59.49 2ku7 s VAL 68 Cb -0.17 -2.43 -0.03 0.00 0.56 0.00 0.00 36.38 34.31 2ku7 s VAL 68 CO 0.10 0.33 -0.14 -0.83 -0.31 0.00 0.00 175.10 174.25 2ku7 s GLY 69 N 1.39 0.99 0.00 2.32 0.00 -0.09 -0.41 107.32 111.51 2ku7 s GLY 69 Ca 0.03 -1.19 0.00 0.00 0.00 0.00 0.00 44.72 43.56 2ku7 s GLY 69 CO -0.05 -1.23 0.00 0.61 0.00 0.00 0.00 173.10 172.43 2ku7 n GLY 70 N 0.79 1.74 3.95 0.20 0.00 0.49 -0.26 105.19 112.10 2ku7 n GLY 70 Ca -0.17 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.62 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 3.77 0.36 0.99 1.02 -0.18 -4.35 118.68 120.30 2ku7 s LEU 71 Ca 0.00 0.27 -0.04 0.00 0.02 0.00 0.00 54.13 54.38 2ku7 s LEU 71 Cb 0.00 -3.15 -0.04 0.00 0.02 0.00 0.00 46.19 43.01 2ku7 s LEU 71 CO 0.00 -0.57 0.63 0.00 0.02 0.00 0.00 176.35 176.43 2ku7 s ALA 72 N -2.46 3.56 0.45 4.21 0.00 -1.26 -4.34 121.76 121.93 2ku7 s ALA 72 Ca 0.46 -0.60 0.23 0.00 0.00 0.00 0.00 51.96 52.04 2ku7 s ALA 72 Cb -0.10 -2.36 1.33 0.00 0.00 0.00 0.00 23.12 21.99 2ku7 s ALA 72 CO 0.37 0.01 2.07 0.93 0.00 0.00 0.00 175.76 179.13 2ku7 h GLU 73 N 1.04 0.00 0.00 0.00 5.08 -1.96 -1.51 114.58 117.24 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 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 2ku7 h GLU 73 CO 0.64 0.13 0.00 0.39 -1.00 0.00 0.00 179.01 179.16 2ku7 n GLU 74 N -3.94 0.44 -3.14 2.33 -0.58 -1.26 -4.80 120.64 109.69 2ku7 n GLU 74 Ca -0.02 0.05 -0.38 0.00 -0.42 0.00 0.00 57.16 56.39 2ku7 n GLU 74 Cb 0.22 -1.50 -0.06 0.00 -0.57 0.00 0.00 31.44 29.53 2ku7 n GLU 74 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 2ku7 s VAL 75 N -2.40 4.57 0.50 2.62 -7.23 -0.57 -5.08 120.40 112.81 2ku7 s VAL 75 Ca 0.25 1.39 0.01 0.00 -1.81 0.00 0.00 61.98 61.83 2ku7 s VAL 75 Cb 0.15 -3.97 -0.01 0.00 0.56 0.00 0.00 36.38 33.11 2ku7 s VAL 75 CO 0.32 0.46 0.03 -1.81 -0.31 0.00 0.00 175.10 173.79 2ku7 s ASP 76 N -1.26 3.89 0.51 4.85 1.01 -1.26 -4.98 116.67 119.43 2ku7 s ASP 76 Ca 0.35 -1.69 0.15 0.00 0.71 0.00 0.00 52.55 52.07 2ku7 s ASP 76 Cb -0.20 0.60 1.23 0.00 1.01 0.00 0.00 42.92 45.55 2ku7 s ASP 76 CO 0.22 -0.90 2.14 0.44 0.21 0.00 0.00 175.17 177.27 2ku7 h ASP 77 N 1.40 0.05 -0.42 0.27 3.32 -1.95 -1.99 116.42 117.10 2ku7 h ASP 77 Ca -0.42 -0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.50 2ku7 h ASP 77 Cb 1.31 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.84 2ku7 h ASP 77 CO 0.70 0.04 -0.23 0.11 -1.72 0.00 0.00 179.24 178.13 2ku7 h LYS 78 N 0.06 0.90 -0.19 3.56 1.57 -1.98 -1.33 116.57 119.16 2ku7 h LYS 78 Ca 0.02 -0.41 -0.03 0.00 -1.87 0.00 0.00 60.65 58.36 2ku7 h LYS 78 Cb 0.02 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 2ku7 h LYS 78 CO -0.00 1.06 -0.02 0.28 -0.57 0.00 0.00 179.45 180.20 2ku7 h VAL 79 N 0.73 1.27 -0.53 0.50 2.07 -1.78 -1.16 116.25 117.34 2ku7 h VAL 79 Ca 0.09 -0.92 -0.11 0.00 0.82 0.00 0.00 66.70 66.58 2ku7 h VAL 79 Cb 0.80 1.49 -0.02 0.00 -1.52 0.00 0.00 31.29 32.05 2ku7 h VAL 79 CO 0.07 0.28 -0.10 0.25 0.02 0.00 0.00 177.57 178.08 2ku7 h LEU 80 N 0.09 0.99 -0.08 2.57 6.46 -1.40 -1.84 115.31 122.11 2ku7 h LEU 80 Ca 0.05 -0.32 -0.02 0.00 -0.12 0.00 0.00 57.88 57.47 2ku7 h LEU 80 Cb 0.43 -0.27 -0.00 0.00 -0.73 0.00 0.00 40.66 40.09 2ku7 h LEU 80 CO 0.01 1.10 -0.03 -0.74 -0.62 0.00 0.00 178.44 178.16 2ku7 h HIS 81 N 0.88 0.18 0.00 1.25 2.76 -1.24 -2.64 115.15 116.35 2ku7 h HIS 81 Ca 0.14 -0.04 -0.01 0.00 -2.20 0.00 0.00 60.37 58.26 2ku7 h HIS 81 Cb 0.66 -0.04 -0.00 0.00 1.55 0.00 0.00 27.41 29.57 2ku7 h HIS 81 CO 0.04 0.51 -0.03 0.00 -1.30 0.00 0.00 177.93 177.15 2ku7 h ALA 82 N 0.64 1.01 0.06 5.26 0.00 -1.23 0.32 119.26 125.31 2ku7 h ALA 82 Ca 0.02 -0.03 -0.27 0.00 0.00 0.00 0.00 54.91 54.63 2ku7 h ALA 82 Cb 0.46 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 2ku7 h ALA 82 CO 0.01 0.04 -1.40 0.00 0.00 0.00 0.00 179.25 177.90 2ku7 h ALA 83 N 1.97 0.40 -0.13 0.00 0.00 -1.30 -3.34 119.26 116.87 2ku7 h ALA 83 Ca -0.00 -1.12 0.00 0.00 0.00 0.00 0.00 54.91 53.79 2ku7 h ALA 83 Cb 0.54 0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.52 2ku7 h ALA 83 CO 0.00 1.27 0.00 1.19 0.00 0.00 0.00 179.25 181.71 2ku7 n PHE 84 N -3.33 0.14 0.07 0.00 3.72 -1.00 -4.54 117.46 112.52 2ku7 n PHE 84 Ca -0.11 -0.09 -0.04 0.00 -0.05 0.00 0.00 57.45 57.16 2ku7 n PHE 84 Cb 1.01 -0.00 0.16 0.00 -0.94 0.00 0.00 39.48 39.71 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 3.77 1.34 -0.01 4.37 6.09 -1.05 -3.23 117.51 128.79 2ku7 h ILE 85 Ca 0.00 -1.71 0.00 0.00 -1.37 0.00 0.00 64.86 61.78 2ku7 h ILE 85 Cb 0.83 1.79 -0.00 0.00 0.47 0.00 0.00 36.82 39.91 2ku7 h ILE 85 CO 0.00 0.51 0.02 1.55 -3.07 0.00 0.00 178.15 177.16 2ku7 h PRO 86 N 0.23 0.00 0.03 2.19 0.13 -1.80 -2.32 132.00 130.46 2ku7 h PRO 86 Ca 0.01 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.91 2ku7 h PRO 86 Cb 0.95 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.05 2ku7 h PRO 86 CO 0.08 0.00 -1.11 0.74 -0.23 0.00 0.00 178.00 177.48 2ku7 h PHE 87 N 0.00 0.12 0.00 1.56 0.04 -1.90 -3.50 116.94 113.27 2ku7 h PHE 87 Ca 0.00 -0.09 0.00 0.00 2.80 0.00 0.00 57.97 60.69 2ku7 h PHE 87 Cb 0.04 -0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.18 2ku7 h PHE 87 CO 0.00 1.07 0.00 0.41 -0.60 0.00 0.00 178.31 179.19 2ku7 n GLY 88 N 1.41 -1.28 3.74 -1.45 0.00 -0.87 -4.74 105.19 101.99 2ku7 n GLY 88 Ca -0.03 -0.89 -0.40 0.00 0.00 0.00 0.00 46.02 44.69 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 -3.89 7.23 -0.06 1.61 1.01 -1.26 -4.46 116.67 116.85 2ku7 s ASP 89 Ca 0.00 1.47 0.03 0.00 0.71 0.00 0.00 52.55 54.76 2ku7 s ASP 89 Cb 0.00 -2.48 -0.03 0.00 1.01 0.00 0.00 42.92 41.42 2ku7 s ASP 89 CO 0.00 -0.04 -0.12 -0.63 0.21 0.00 0.00 175.17 174.59 2ku7 s ILE 90 N 0.16 3.26 -0.10 0.77 1.01 -1.26 -2.16 121.20 122.87 2ku7 s ILE 90 Ca 0.41 -0.65 -0.07 0.00 0.00 0.00 0.00 60.65 60.34 2ku7 s ILE 90 Cb -0.20 -2.30 -0.02 0.00 0.01 0.00 0.00 42.46 39.94 2ku7 s ILE 90 CO 0.24 0.59 -0.13 0.35 0.00 0.00 0.00 174.94 175.98 2ku7 n THR 91 N 2.35 1.05 -3.85 2.92 -2.24 -0.10 -4.88 114.28 109.54 2ku7 n THR 91 Ca -0.17 0.29 -0.10 0.00 -2.27 0.00 0.00 64.05 61.80 2ku7 n THR 91 Cb 0.52 -2.16 -0.08 0.00 -2.10 0.00 0.00 70.33 66.51 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 -5.16 0.05 -0.16 3.42 1.01 -1.26 -5.05 116.67 109.54 2ku7 s ASP 92 Ca -0.11 -0.40 0.00 0.00 0.71 0.00 0.00 52.55 52.75 2ku7 s ASP 92 Cb 0.02 0.29 -0.00 0.00 1.01 0.00 0.00 42.92 44.23 2ku7 s ASP 92 CO 0.16 -0.57 -0.16 -0.63 0.21 0.00 0.00 175.17 174.19 2ku7 s ILE 93 N -2.67 2.61 -0.13 0.77 -1.09 -1.26 -2.52 121.20 116.91 2ku7 s ILE 93 Ca -0.04 -0.79 0.03 0.00 -2.23 0.00 0.00 60.65 57.62 2ku7 s ILE 93 Cb -0.01 -2.10 0.01 0.00 -1.58 0.00 0.00 42.46 38.78 2ku7 s ILE 93 CO -0.04 0.52 -0.22 -1.10 -1.23 0.00 0.00 174.94 172.86 2ku7 s GLN 94 N 0.86 3.01 -0.15 2.79 -1.52 -1.05 -5.00 119.66 118.60 2ku7 s GLN 94 Ca -0.05 -0.85 -0.00 0.00 -1.95 0.00 0.00 55.36 52.51 2ku7 s GLN 94 Cb -0.15 -2.39 0.03 0.00 -0.22 0.00 0.00 33.01 30.28 2ku7 s GLN 94 CO -0.01 0.03 -0.08 0.42 -0.25 0.00 0.00 175.29 175.40 2ku7 s ILE 95 N 0.70 1.22 0.13 1.08 1.09 -1.26 -1.65 121.20 122.51 2ku7 s ILE 95 Ca -0.10 -0.57 -0.32 0.00 -1.10 0.00 0.00 60.65 58.56 2ku7 s ILE 95 Cb -0.16 -1.29 -0.12 0.00 -1.06 0.00 0.00 42.46 39.83 2ku7 s ILE 95 CO 0.01 0.26 1.78 -2.65 -0.10 0.00 0.00 174.94 174.24 2ku7 n PRO 96 N 4.86 2.64 -4.87 2.79 -0.02 -1.26 -5.00 135.00 134.13 2ku7 n PRO 96 Ca -0.13 0.96 -0.27 0.00 -2.02 0.00 0.00 63.50 62.04 2ku7 n PRO 96 Cb 0.49 -2.82 -0.16 0.00 -0.02 0.00 0.00 33.50 30.98 2ku7 n PRO 96 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2ku7 s LEU 97 N 2.20 1.91 0.10 2.45 2.96 -1.26 -4.59 118.68 122.45 2ku7 s LEU 97 Ca 0.81 -0.38 -0.17 0.00 -0.22 0.00 0.00 54.13 54.18 2ku7 s LEU 97 Cb -0.53 -1.02 -0.07 0.00 0.50 0.00 0.00 46.19 45.07 2ku7 s LEU 97 CO 0.37 0.15 0.54 -1.81 -1.32 0.00 0.00 176.35 174.29 2ku7 s ASP 98 N 0.11 6.93 0.35 3.68 1.01 -1.26 -4.95 116.67 122.54 2ku7 s ASP 98 Ca -0.06 1.15 0.06 0.00 0.71 0.00 0.00 52.55 54.41 2ku7 s ASP 98 Cb -0.13 -2.32 0.65 0.00 1.01 0.00 0.00 42.92 42.13 2ku7 s ASP 98 CO 0.03 0.20 1.87 1.88 0.21 0.00 0.00 175.17 179.36 2ku7 h TYR 99 N 4.10 0.42 -0.05 4.23 0.05 -1.97 0.62 116.97 124.37 2ku7 h TYR 99 Ca -0.49 -0.05 -0.03 0.00 0.05 0.00 0.00 58.73 58.20 2ku7 h TYR 99 Cb 1.20 -0.12 -0.00 0.00 1.01 0.00 0.00 36.73 38.83 2ku7 h TYR 99 CO 0.67 0.49 -0.09 1.49 -1.05 0.00 0.00 178.16 179.67 2ku7 h GLU 100 N 0.38 0.15 0.00 4.88 4.81 -2.00 -3.37 114.58 119.43 2ku7 h GLU 100 Ca 0.08 -0.10 -0.28 0.00 -0.13 0.00 0.00 59.36 58.93 2ku7 h GLU 100 Cb 0.40 0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.74 2ku7 h GLU 100 CO 0.02 0.66 -2.20 0.25 -0.73 0.00 0.00 179.01 177.01 2ku7 n THR 101 N -4.69 1.12 -1.77 0.32 -2.24 -1.22 -4.99 114.28 100.81 2ku7 n THR 101 Ca -0.08 -0.77 -0.19 0.00 -2.27 0.00 0.00 64.05 60.74 2ku7 n THR 101 Cb 0.34 -0.43 -0.06 0.00 -2.10 0.00 0.00 70.33 68.08 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 -2.68 -1.52 -4.38 -0.78 1.02 0.22 -4.97 120.64 107.55 2ku7 n GLU 102 Ca -0.25 1.06 -0.23 0.00 -0.02 0.00 0.00 57.16 57.72 2ku7 n GLU 102 Cb 1.02 -5.49 -0.11 0.00 -0.02 0.00 0.00 31.44 26.84 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 -3.97 1.41 0.24 3.49 1.02 -1.26 -4.88 119.74 115.80 2ku7 s LYS 103 Ca 0.00 -1.52 0.05 0.00 0.02 0.00 0.00 55.97 54.52 2ku7 s LYS 103 Cb 0.00 -1.51 -0.03 0.00 -0.52 0.00 0.00 37.83 35.77 2ku7 s LYS 103 CO 0.00 0.30 0.37 -3.38 -0.92 0.00 0.00 175.35 171.72 2ku7 s HIS 104 N -2.14 3.44 -2.42 3.18 -3.43 -1.26 -4.15 115.29 108.51 2ku7 s HIS 104 Ca 0.20 -0.02 0.28 0.00 -0.80 0.00 0.00 55.06 54.73 2ku7 s HIS 104 Cb -0.06 -1.59 1.17 0.00 -1.43 0.00 0.00 32.58 30.68 2ku7 s HIS 104 CO 0.09 0.42 1.81 0.54 -2.00 0.00 0.00 174.74 175.60 2ku7 n ARG 105 N -1.42 1.57 -0.10 -0.38 1.74 -1.26 -4.87 116.66 111.93 2ku7 n ARG 105 Ca -0.09 -0.82 0.00 0.00 -0.77 0.00 0.00 57.85 56.17 2ku7 n ARG 105 Cb 0.57 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.53 2ku7 n ARG 105 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2ku7 n GLY 106 N 1.15 1.85 3.09 -0.13 0.00 -1.26 -4.92 105.19 104.97 2ku7 n GLY 106 Ca 0.20 -0.05 -0.12 0.00 0.00 0.00 0.00 46.02 46.05 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 -0.08 0.20 1.61 -0.12 -1.26 -0.38 117.98 115.95 2ku7 s PHE 107 Ca 0.00 0.16 -0.15 0.00 -0.05 0.00 0.00 56.93 56.90 2ku7 s PHE 107 Cb 0.00 0.01 0.01 0.00 -0.63 0.00 0.00 43.02 42.41 2ku7 s PHE 107 CO 0.00 -0.21 0.46 0.00 -0.05 0.00 0.00 175.22 175.43 2ku7 s ALA 108 N -0.72 -0.60 -0.00 1.99 0.00 0.45 -4.53 121.76 118.36 2ku7 s ALA 108 Ca -0.08 -0.50 0.04 0.00 0.00 0.00 0.00 51.96 51.41 2ku7 s ALA 108 Cb -0.05 0.89 -0.03 0.00 0.00 0.00 0.00 23.12 23.93 2ku7 s ALA 108 CO 0.01 -0.78 -0.09 -0.06 0.00 0.00 0.00 175.76 174.84 2ku7 s PHE 109 N -3.92 2.83 -0.07 0.00 0.40 -0.66 -0.27 117.98 116.28 2ku7 s PHE 109 Ca 0.13 -0.08 0.04 0.00 -0.60 0.00 0.00 56.93 56.43 2ku7 s PHE 109 Cb -0.00 -1.60 -0.02 0.00 0.51 0.00 0.00 43.02 41.91 2ku7 s PHE 109 CO 0.00 0.33 -0.19 0.54 0.70 0.00 0.00 175.22 176.61 2ku7 s VAL 110 N -0.94 2.60 -0.20 -0.44 0.11 0.50 -2.53 120.40 119.50 2ku7 s VAL 110 Ca 0.16 -0.87 -0.05 0.00 -2.93 0.00 0.00 61.98 58.28 2ku7 s VAL 110 Cb -0.11 -2.01 -0.03 0.00 -1.53 0.00 0.00 36.38 32.71 2ku7 s VAL 110 CO 0.06 0.57 0.01 -0.70 -3.33 0.00 0.00 175.10 171.71 2ku7 s GLU 111 N -0.26 3.68 -0.10 1.54 2.12 -1.05 -0.70 118.70 123.94 2ku7 s GLU 111 Ca 0.00 -0.49 -0.00 0.00 0.36 0.00 0.00 54.97 54.84 2ku7 s GLU 111 Cb -0.13 -3.10 -0.03 0.00 0.26 0.00 0.00 34.13 31.13 2ku7 s GLU 111 CO 0.03 0.07 -0.08 -0.06 -0.54 0.00 0.00 175.26 174.67 2ku7 s PHE 112 N 0.87 2.91 0.28 5.30 0.40 0.44 -0.92 117.98 127.26 2ku7 s PHE 112 Ca 0.01 -0.18 -0.01 0.00 -0.60 0.00 0.00 56.93 56.16 2ku7 s PHE 112 Cb -0.14 -1.78 0.39 0.00 0.51 0.00 0.00 43.02 42.00 2ku7 s PHE 112 CO 0.02 0.15 1.79 1.49 0.70 0.00 0.00 175.22 179.37 2ku7 h GLU 113 N 5.82 0.76 -5.46 0.44 4.81 -1.74 -3.42 114.58 115.79 2ku7 h GLU 113 Ca -0.41 -0.18 -0.64 0.00 -0.13 0.00 0.00 59.36 58.00 2ku7 h GLU 113 Cb 1.18 -0.10 -0.17 0.00 0.63 0.00 0.00 28.75 30.29 2ku7 h GLU 113 CO 0.55 0.75 -0.61 -0.51 -0.73 0.00 0.00 179.01 178.46 2ku7 s LEU 114 N -9.19 3.57 0.45 1.64 1.02 -1.26 -5.00 118.68 109.92 2ku7 s LEU 114 Ca -0.09 0.03 0.24 0.00 0.02 0.00 0.00 54.13 54.33 2ku7 s LEU 114 Cb 0.15 -1.87 1.03 0.00 0.02 0.00 0.00 46.19 45.52 2ku7 s LEU 114 CO 0.80 0.23 1.88 0.00 0.02 0.00 0.00 176.35 179.28 2ku7 h ALA 115 N 6.30 1.09 -0.32 4.21 0.00 -1.88 -3.05 119.26 125.61 2ku7 h ALA 115 Ca -0.38 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.27 2ku7 h ALA 115 Cb 1.18 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 2ku7 h ALA 115 CO 0.64 0.27 -0.03 0.93 0.00 0.00 0.00 179.25 181.06 2ku7 h GLU 116 N 0.00 0.58 -0.12 0.00 4.39 -1.94 -2.91 114.58 114.58 2ku7 h GLU 116 Ca -0.00 -0.20 -0.11 0.00 0.34 0.00 0.00 59.36 59.39 2ku7 h GLU 116 Cb 0.65 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.25 2ku7 h GLU 116 CO 0.03 0.74 -0.40 -0.44 -1.16 0.00 0.00 179.01 177.77 2ku7 h ASP 117 N 0.37 0.28 -0.15 1.42 3.32 -1.84 -2.57 116.42 117.25 2ku7 h ASP 117 Ca 0.09 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.02 2ku7 h ASP 117 Cb 0.50 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.96 2ku7 h ASP 117 CO 0.02 0.66 0.09 0.00 -1.72 0.00 0.00 179.24 178.29 2ku7 h ALA 118 N 1.36 0.19 0.00 3.45 0.00 -1.44 0.27 119.26 123.09 2ku7 h ALA 118 Ca 0.02 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 2ku7 h ALA 118 Cb 0.81 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 2ku7 h ALA 118 CO 0.06 -0.32 -0.36 0.00 0.00 0.00 0.00 179.25 178.64 2ku7 h ALA 119 N 1.03 1.36 -0.20 0.00 0.00 -1.49 -2.75 119.26 117.21 2ku7 h ALA 119 Ca 0.05 -0.33 -0.18 0.00 0.00 0.00 0.00 54.91 54.46 2ku7 h ALA 119 Cb 0.00 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 2ku7 h ALA 119 CO -0.01 0.45 -0.59 0.00 0.00 0.00 0.00 179.25 179.10 2ku7 h ALA 120 N 1.64 0.59 -0.54 0.00 0.00 -0.98 -2.84 119.26 117.14 2ku7 h ALA 120 Ca -0.00 -0.53 -0.09 0.00 0.00 0.00 0.00 54.91 54.29 2ku7 h ALA 120 Cb 0.65 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 2ku7 h ALA 120 CO 0.05 0.69 -0.02 0.00 0.00 0.00 0.00 179.25 179.97 2ku7 h ALA 121 N 0.85 0.96 -0.31 0.00 0.00 -0.20 -1.69 119.26 118.88 2ku7 h ALA 121 Ca 0.00 -0.30 -0.17 0.00 0.00 0.00 0.00 54.91 54.45 2ku7 h ALA 121 Cb 1.16 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.74 2ku7 h ALA 121 CO 0.12 0.63 -0.46 0.82 0.00 0.00 0.00 179.25 180.35 2ku7 h ILE 122 N 0.85 1.28 0.00 0.00 2.04 -1.51 -2.74 117.51 117.43 2ku7 h ILE 122 Ca 0.16 -1.65 -0.10 0.00 1.00 0.00 0.00 64.86 64.27 2ku7 h ILE 122 Cb 0.52 1.53 -0.01 0.00 -0.74 0.00 0.00 36.82 38.12 2ku7 h ILE 122 CO 0.03 0.54 -0.48 -2.24 0.00 0.00 0.00 178.15 175.99 2ku7 h ASP 123 N 0.66 0.00 0.00 1.72 3.04 -1.43 -3.03 116.42 117.38 2ku7 h ASP 123 Ca 0.04 0.00 -0.06 0.00 -3.24 0.00 0.00 57.03 53.77 2ku7 h ASP 123 Cb 1.04 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 39.32 2ku7 h ASP 123 CO 0.10 0.48 -0.30 0.78 -2.04 0.00 0.00 179.24 178.26 2ku7 h ASN 124 N 0.00 0.00 -2.01 4.15 2.35 -1.31 -3.42 115.58 115.33 2ku7 h ASN 124 Ca -0.00 -0.88 -0.51 0.00 -0.55 0.00 0.00 56.30 54.36 2ku7 h ASN 124 Cb 1.19 0.00 -0.41 0.00 0.05 0.00 0.00 38.32 39.15 2ku7 h ASN 124 CO 0.06 1.12 -1.00 0.23 -1.65 0.00 0.00 177.43 176.19 2ku7 n MET 125 N -4.57 1.82 -0.10 0.81 2.81 -1.04 -4.89 117.12 111.96 2ku7 n MET 125 Ca -0.15 -3.90 -0.08 0.00 -1.81 0.00 0.00 57.70 51.76 2ku7 n MET 125 Cb 0.53 -1.87 0.09 0.00 -0.71 0.00 0.00 33.22 31.25 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 2.98 0.82 -2.29 7.83 -1.24 -1.72 -3.38 115.58 118.57 2ku7 h ASN 126 Ca 0.10 -0.28 -0.57 0.00 0.71 0.00 0.00 56.30 56.26 2ku7 h ASN 126 Cb 0.83 -0.22 -0.37 0.00 0.73 0.00 0.00 38.32 39.28 2ku7 h ASN 126 CO 0.62 0.99 -0.97 -0.62 -1.29 0.00 0.00 177.43 176.16 2ku7 n GLU 127 N -4.13 0.22 -4.44 6.67 1.02 -1.23 -1.44 120.64 117.30 2ku7 n GLU 127 Ca 0.01 -3.13 -0.23 0.00 -0.02 0.00 0.00 57.16 53.79 2ku7 n GLU 127 Cb 0.41 -1.64 -0.10 0.00 -0.02 0.00 0.00 31.44 30.09 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 0.02 3.28 -0.29 1.62 0.15 -1.14 -4.89 113.70 112.45 2ku7 s SER 128 Ca 0.33 -1.06 -0.20 0.00 0.70 0.00 0.00 55.95 55.72 2ku7 s SER 128 Cb 0.05 -0.25 -0.01 0.00 -1.71 0.00 0.00 66.02 64.09 2ku7 s SER 128 CO -0.19 -0.07 0.60 -0.70 1.20 0.00 0.00 173.24 174.08 2ku7 s GLU 129 N -3.57 3.96 -0.06 5.44 2.12 -1.26 -0.52 118.70 124.80 2ku7 s GLU 129 Ca 0.28 0.32 0.02 0.00 0.36 0.00 0.00 54.97 55.96 2ku7 s GLU 129 Cb -0.02 -3.70 0.01 0.00 0.26 0.00 0.00 34.13 30.68 2ku7 s GLU 129 CO 0.13 -0.50 -0.11 -1.17 -0.54 0.00 0.00 175.26 173.06 2ku7 s LEU 130 N 2.52 1.60 -1.03 2.70 2.96 0.14 -4.76 118.68 122.81 2ku7 s LEU 130 Ca 0.24 -0.28 0.00 0.00 -0.22 0.00 0.00 54.13 53.87 2ku7 s LEU 130 Cb -0.15 -0.78 0.00 0.00 0.50 0.00 0.00 46.19 45.75 2ku7 s LEU 130 CO 0.11 0.02 0.00 0.33 -1.32 0.00 0.00 176.35 175.49 2ku7 n PHE 131 N 3.86 0.00 -0.16 5.38 -0.00 -1.26 -1.54 117.46 123.74 2ku7 n PHE 131 Ca -0.23 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.22 2ku7 n PHE 131 Cb 0.52 -2.48 0.00 0.00 -0.00 0.00 0.00 39.48 37.52 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 -0.15 0.71 3.30 7.13 0.00 -1.26 -4.96 105.19 109.96 2ku7 n GLY 132 Ca -0.10 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 -0.84 1.19 0.05 1.61 0.52 -0.59 -5.11 118.95 115.78 2ku7 s ARG 133 Ca 0.00 -1.33 -0.27 0.00 -0.52 0.00 0.00 55.73 53.61 2ku7 s ARG 133 Cb 0.00 -1.24 -0.05 0.00 0.52 0.00 0.00 34.95 34.17 2ku7 s ARG 133 CO 0.00 0.26 0.83 0.99 0.02 0.00 0.00 175.30 177.40 2ku7 s THR 134 N -1.92 4.71 0.17 0.02 2.01 -1.26 0.23 115.64 119.59 2ku7 s THR 134 Ca 0.13 1.78 0.10 0.00 0.31 0.00 0.00 61.69 64.00 2ku7 s THR 134 Cb -0.06 -4.19 -0.04 0.00 0.01 0.00 0.00 72.50 68.22 2ku7 s THR 134 CO 0.05 0.32 -0.19 0.27 -0.69 0.00 0.00 174.62 174.38 2ku7 s ILE 135 N 0.13 2.66 -0.07 1.82 -4.36 0.32 -4.43 121.20 117.27 2ku7 s ILE 135 Ca 0.42 -1.80 0.03 0.00 -0.26 0.00 0.00 60.65 59.05 2ku7 s ILE 135 Cb -0.21 -2.26 0.01 0.00 1.25 0.00 0.00 42.46 41.24 2ku7 s ILE 135 CO 0.25 -0.05 -0.17 -0.60 0.24 0.00 0.00 174.94 174.61 2ku7 s ARG 136 N -2.53 2.10 -0.04 0.37 6.06 0.63 -2.90 118.95 122.65 2ku7 s ARG 136 Ca 0.20 -0.60 0.04 0.00 -2.50 0.00 0.00 55.73 52.88 2ku7 s ARG 136 Cb -0.09 -1.69 -0.00 0.00 0.06 0.00 0.00 34.95 33.22 2ku7 s ARG 136 CO 0.11 0.13 -0.16 0.14 -2.50 0.00 0.00 175.30 173.02 2ku7 s VAL 137 N 0.40 1.33 0.25 7.11 -7.23 -0.52 -0.92 120.40 120.83 2ku7 s VAL 137 Ca -0.13 -0.67 -0.07 0.00 -1.81 0.00 0.00 61.98 59.31 2ku7 s VAL 137 Cb -0.15 -1.15 -0.01 0.00 0.56 0.00 0.00 36.38 35.63 2ku7 s VAL 137 CO 0.05 0.39 0.37 0.20 -0.31 0.00 0.00 175.10 175.79 2ku7 s ASN 138 N 0.03 0.21 0.07 4.85 -0.87 -0.58 -4.76 114.94 113.89 2ku7 s ASN 138 Ca -0.03 -1.19 -0.31 0.00 -1.57 0.00 0.00 52.86 49.76 2ku7 s ASN 138 Cb -0.11 0.54 -0.06 0.00 -0.02 0.00 0.00 41.25 41.60 2ku7 s ASN 138 CO 0.02 -1.08 1.26 -0.76 -2.57 0.00 0.00 177.10 173.97 2ku7 s LEU 139 N -3.11 4.37 0.00 0.60 1.43 -1.26 0.57 118.68 121.28 2ku7 s LEU 139 Ca 0.29 2.10 0.25 0.00 -1.03 0.00 0.00 54.13 55.74 2ku7 s LEU 139 Cb 0.02 -3.58 0.37 0.00 0.03 0.00 0.00 46.19 43.02 2ku7 s LEU 139 CO 0.12 -0.54 1.36 0.00 0.23 0.00 0.00 176.35 177.53