#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 0.22 1.43 1.00 -1.26 -5.12 119.30 118.95 2ku7 s MET 2 Ca 0.00 -0.32 0.11 0.00 0.00 0.00 0.00 55.69 55.48 2ku7 s MET 2 Cb 0.00 -3.01 -0.05 0.00 0.00 0.00 0.00 34.83 31.78 2ku7 s MET 2 CO 0.00 0.60 -0.22 -1.64 0.00 0.00 0.00 175.02 173.77 2ku7 s MET 3 N -0.57 1.52 0.11 2.03 -1.94 -1.26 -5.15 119.30 114.05 2ku7 s MET 3 Ca 0.11 -1.59 0.03 0.00 -1.71 0.00 0.00 55.69 52.53 2ku7 s MET 3 Cb -0.12 -1.72 -0.04 0.00 2.01 0.00 0.00 34.83 34.96 2ku7 s MET 3 CO 0.02 0.35 0.17 -0.65 -0.01 0.00 0.00 175.02 174.90 2ku7 s GLN 4 N -2.98 3.13 -0.07 2.03 -0.21 -1.26 -5.12 119.66 115.18 2ku7 s GLN 4 Ca 0.23 -0.66 0.06 0.00 0.02 0.00 0.00 55.36 55.00 2ku7 s GLN 4 Cb -0.06 -2.83 -0.01 0.00 1.00 0.00 0.00 33.01 31.11 2ku7 s GLN 4 CO 0.11 0.55 -0.25 0.00 -2.12 0.00 0.00 175.29 173.58 2ku7 n GLY 6 N 3.07 -1.00 3.78 0.00 0.00 -1.26 -4.90 105.19 104.89 2ku7 n GLY 6 Ca -0.18 -0.05 -0.37 0.00 0.00 0.00 0.00 46.02 45.42 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 -2.59 4.07 -0.03 1.61 1.02 -1.26 -5.09 119.74 117.47 2ku7 s LYS 7 Ca -0.05 0.29 0.02 0.00 0.02 0.00 0.00 55.97 56.25 2ku7 s LYS 7 Cb 0.08 -3.32 0.01 0.00 -0.52 0.00 0.00 37.83 34.07 2ku7 s LYS 7 CO 0.82 0.45 -0.07 0.00 -0.92 0.00 0.00 175.35 175.63 2ku7 s ASP 9 N 0.39 6.46 0.09 0.00 -1.08 -1.26 -4.97 116.67 116.30 2ku7 s ASP 9 Ca -0.06 0.41 -0.14 0.00 -0.52 0.00 0.00 52.55 52.24 2ku7 s ASP 9 Cb -0.10 -2.31 -0.13 0.00 -1.46 0.00 0.00 42.92 38.93 2ku7 s ASP 9 CO 0.00 -0.42 1.34 0.03 0.52 0.00 0.00 175.17 176.65 2ku7 h ARG 10 N 8.16 0.72 -5.51 4.34 3.08 -2.06 -3.45 114.38 119.66 2ku7 h ARG 10 Ca -0.27 -0.49 -0.57 0.00 0.07 0.00 0.00 59.98 58.72 2ku7 h ARG 10 Cb 1.13 0.07 -0.31 0.00 0.08 0.00 0.00 29.97 30.94 2ku7 h ARG 10 CO 0.77 1.11 -0.84 -1.58 -1.07 0.00 0.00 179.97 178.36 2ku7 s TRP 11 N -4.00 1.71 -0.06 3.04 0.52 -1.26 -5.14 118.94 113.76 2ku7 s TRP 11 Ca -0.12 -0.43 0.03 0.00 0.02 0.00 0.00 56.10 55.60 2ku7 s TRP 11 Cb 0.08 -1.13 0.01 0.00 -1.15 0.00 0.00 33.47 31.27 2ku7 s TRP 11 CO 0.86 -0.11 -0.15 0.08 0.02 0.00 0.00 176.95 177.64 2ku7 s VAL 12 N -0.15 1.32 0.16 4.03 1.01 -1.26 -5.05 120.40 120.46 2ku7 s VAL 12 Ca 0.00 -0.61 -0.12 0.00 0.00 0.00 0.00 61.98 61.26 2ku7 s VAL 12 Cb -0.10 -1.17 0.04 0.00 0.00 0.00 0.00 36.38 35.14 2ku7 s VAL 12 CO 0.01 0.39 1.63 1.12 0.00 0.00 0.00 175.10 178.25 2ku7 h HIS 13 N 6.71 1.00 -0.58 5.22 2.07 -2.00 -3.08 115.15 124.48 2ku7 h HIS 13 Ca -0.30 -0.16 -0.08 0.00 -2.85 0.00 0.00 60.37 56.98 2ku7 h HIS 13 Cb 1.19 -0.26 -0.02 0.00 2.57 0.00 0.00 27.41 30.88 2ku7 h HIS 13 CO 0.47 0.90 0.05 0.77 -3.07 0.00 0.00 177.93 177.06 2ku7 h SER 14 N 0.80 0.93 -0.18 3.10 0.02 -1.96 -2.51 113.55 113.74 2ku7 h SER 14 Ca 0.16 -0.23 -0.08 0.00 -0.84 0.00 0.00 61.79 60.79 2ku7 h SER 14 Cb 0.48 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.76 2ku7 h SER 14 CO 0.02 0.96 -0.15 0.11 -1.14 0.00 0.00 176.83 176.63 2ku7 h LYS 15 N 0.90 0.58 -0.00 3.45 1.57 -1.72 -1.46 116.57 119.89 2ku7 h LYS 15 Ca 0.18 -0.19 -0.22 0.00 -1.87 0.00 0.00 60.65 58.55 2ku7 h LYS 15 Cb 0.46 -0.05 0.02 0.00 0.08 0.00 0.00 32.23 32.73 2ku7 h LYS 15 CO 0.02 0.71 -0.85 0.00 -0.57 0.00 0.00 179.45 178.76 2ku7 h GLU 17 N 0.18 0.80 -5.14 0.00 5.08 -1.45 -3.46 114.58 110.60 2ku7 h GLU 17 Ca -0.11 -0.53 -0.37 0.00 -1.00 0.00 0.00 59.36 57.36 2ku7 h GLU 17 Cb 1.53 0.07 -0.20 0.00 0.50 0.00 0.00 28.75 30.65 2ku7 h GLU 17 CO 0.17 1.15 -0.76 -0.80 -1.00 0.00 0.00 179.01 177.77 2ku7 s ASN 18 N -6.97 1.53 0.40 1.42 0.01 -0.55 -5.11 114.94 105.67 2ku7 s ASN 18 Ca -0.10 -0.68 -0.00 0.00 -0.71 0.00 0.00 52.86 51.37 2ku7 s ASN 18 Cb 0.10 -0.02 -0.02 0.00 0.41 0.00 0.00 41.25 41.72 2ku7 s ASN 18 CO 0.88 -0.15 0.62 -0.22 -1.51 0.00 0.00 177.10 176.72 2ku7 s LEU 19 N -1.99 3.84 0.82 0.60 0.20 -1.26 -4.19 118.68 116.69 2ku7 s LEU 19 Ca 0.00 0.44 -0.11 0.00 0.69 0.00 0.00 54.13 55.15 2ku7 s LEU 19 Cb -0.07 -3.32 0.09 0.00 -0.43 0.00 0.00 46.19 42.45 2ku7 s LEU 19 CO 0.01 -0.47 1.13 -0.94 -0.29 0.00 0.00 176.35 175.79 2ku7 s SER 20 N -4.11 3.88 0.35 3.68 1.04 -1.26 -4.86 113.70 112.42 2ku7 s SER 20 Ca 0.44 2.05 0.06 0.00 0.48 0.00 0.00 55.95 58.97 2ku7 s SER 20 Cb -0.10 -2.55 0.66 0.00 0.10 0.00 0.00 66.02 64.13 2ku7 s SER 20 CO 0.38 -2.46 1.89 0.44 0.98 0.00 0.00 173.24 174.46 2ku7 h ASP 21 N -1.24 0.41 -0.22 7.02 3.32 -1.99 -2.31 116.42 121.40 2ku7 h ASP 21 Ca -0.44 -0.08 -0.04 0.00 0.02 0.00 0.00 57.03 56.49 2ku7 h ASP 21 Cb 1.25 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.69 2ku7 h ASP 21 CO 0.47 0.50 -0.04 -0.33 -1.72 0.00 0.00 179.24 178.13 2ku7 h GLU 22 N 0.42 0.42 -0.12 3.56 5.08 -1.99 -1.98 114.58 119.96 2ku7 h GLU 22 Ca 0.09 -0.15 -0.21 0.00 -1.00 0.00 0.00 59.36 58.08 2ku7 h GLU 22 Cb 0.34 -0.03 0.01 0.00 0.50 0.00 0.00 28.75 29.57 2ku7 h GLU 22 CO 0.01 0.64 -0.78 0.52 -1.00 0.00 0.00 179.01 178.40 2ku7 h MET 23 N 0.15 0.65 -0.21 2.33 2.86 -1.94 -2.80 114.93 115.98 2ku7 h MET 23 Ca 0.06 -0.54 -0.06 0.00 -2.06 0.00 0.00 59.70 57.10 2ku7 h MET 23 Cb 0.48 0.12 -0.01 0.00 0.06 0.00 0.00 31.60 32.25 2ku7 h MET 23 CO 0.02 1.16 -0.10 -0.92 1.06 0.00 0.00 176.91 178.13 2ku7 h TYR 24 N 0.44 0.50 -0.21 -0.22 3.20 -1.47 -2.44 116.97 116.77 2ku7 h TYR 24 Ca -0.05 -0.12 -0.14 0.00 3.14 0.00 0.00 58.73 61.56 2ku7 h TYR 24 Cb 1.40 -0.12 0.00 0.00 1.54 0.00 0.00 36.73 39.55 2ku7 h TYR 24 CO 0.07 0.72 -0.40 0.93 -1.64 0.00 0.00 178.16 177.84 2ku7 h GLU 25 N 0.14 0.65 -0.05 1.82 5.08 -1.46 -2.37 114.58 118.39 2ku7 h GLU 25 Ca 0.05 -0.41 -0.02 0.00 -1.00 0.00 0.00 59.36 57.97 2ku7 h GLU 25 Cb 0.59 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.89 2ku7 h GLU 25 CO 0.03 1.03 -0.06 0.82 -1.00 0.00 0.00 179.01 179.83 2ku7 h ILE 26 N 0.34 1.39 -0.38 3.13 2.04 -1.59 -1.11 117.51 121.35 2ku7 h ILE 26 Ca 0.01 -1.27 -0.12 0.00 1.00 0.00 0.00 64.86 64.47 2ku7 h ILE 26 Cb 1.00 2.13 -0.01 0.00 -0.74 0.00 0.00 36.82 39.20 2ku7 h ILE 26 CO 0.09 0.35 -0.25 -0.07 0.00 0.00 0.00 178.15 178.27 2ku7 h LEU 27 N -0.34 0.87 -0.44 1.44 3.38 -1.56 -3.18 115.31 115.49 2ku7 h LEU 27 Ca 0.01 -0.43 -0.18 0.00 0.09 0.00 0.00 57.88 57.37 2ku7 h LEU 27 Cb 0.59 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 2ku7 h LEU 27 CO 0.02 1.12 -0.70 0.28 0.09 0.00 0.00 178.44 179.24 2ku7 h SER 28 N 0.63 0.47 -4.18 -0.43 0.02 -1.53 -3.38 113.55 105.15 2ku7 h SER 28 Ca 0.08 -0.30 -0.67 0.00 -0.84 0.00 0.00 61.79 60.06 2ku7 h SER 28 Cb 0.82 -0.14 -0.38 0.00 0.14 0.00 0.00 62.40 62.84 2ku7 h SER 28 CO 0.07 1.03 -0.51 0.20 -1.14 0.00 0.00 176.83 176.47 2ku7 s ASN 29 N -6.96 4.81 -0.37 3.07 0.01 -0.42 -5.06 114.94 110.02 2ku7 s ASN 29 Ca -0.06 -2.84 -0.06 0.00 -0.71 0.00 0.00 52.86 49.19 2ku7 s ASN 29 Cb 0.11 -1.75 0.06 0.00 0.41 0.00 0.00 41.25 40.08 2ku7 s ASN 29 CO 0.84 -0.32 0.16 -0.76 -1.51 0.00 0.00 177.10 175.50 2ku7 s LEU 30 N -0.04 4.66 0.11 0.60 1.43 -1.21 -4.45 118.68 119.78 2ku7 s LEU 30 Ca 0.16 -1.38 -0.31 0.00 -1.03 0.00 0.00 54.13 51.57 2ku7 s LEU 30 Cb -0.23 -1.89 -0.08 0.00 0.03 0.00 0.00 46.19 44.03 2ku7 s LEU 30 CO -0.02 -0.41 1.41 -2.84 0.23 0.00 0.00 176.35 174.71 2ku7 s PRO 31 N 1.36 4.31 0.48 1.29 0.02 -1.26 -4.88 135.00 136.32 2ku7 s PRO 31 Ca 0.01 2.09 0.33 0.00 0.02 0.00 0.00 61.00 63.46 2ku7 s PRO 31 Cb -0.21 -3.27 1.46 0.00 0.02 0.00 0.00 34.50 32.50 2ku7 s PRO 31 CO 0.01 -0.46 1.68 0.93 -0.33 0.00 0.00 177.00 178.83 2ku7 h GLU 32 N 6.89 0.10 0.08 5.54 5.08 -1.99 0.13 114.58 130.41 2ku7 h GLU 32 Ca -0.42 -0.01 -0.37 0.00 -1.00 0.00 0.00 59.36 57.56 2ku7 h GLU 32 Cb 1.21 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 30.40 2ku7 h GLU 32 CO 0.87 0.07 -2.14 0.43 -1.00 0.00 0.00 179.01 177.24 2ku7 n SER 33 N -4.42 2.07 0.17 1.42 7.64 -1.26 -4.39 113.62 114.85 2ku7 n SER 33 Ca 0.34 0.11 0.02 0.00 1.01 0.00 0.00 58.87 60.35 2ku7 n SER 33 Cb 1.40 -0.72 0.33 0.00 -1.01 0.00 0.00 64.21 64.20 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 1.29 -0.07 0.44 2.07 -1.39 -2.73 116.25 115.84 2ku7 h VAL 34 Ca -0.48 -1.40 -0.03 0.00 0.82 0.00 0.00 66.70 65.61 2ku7 h VAL 34 Cb 1.95 1.75 -0.01 0.00 -1.52 0.00 0.00 31.29 33.46 2ku7 h VAL 34 CO 0.01 0.40 -0.12 0.00 0.02 0.00 0.00 177.57 177.88 2ku7 h ALA 35 N 1.58 1.68 -2.82 1.67 0.00 -1.03 -3.43 119.26 116.91 2ku7 h ALA 35 Ca -0.00 -0.15 -0.17 0.00 0.00 0.00 0.00 54.91 54.59 2ku7 h ALA 35 Cb 0.72 -0.05 -0.30 0.00 0.00 0.00 0.00 17.79 18.17 2ku7 h ALA 35 CO 0.05 0.24 -0.44 1.52 0.00 0.00 0.00 179.25 180.62 2ku7 s TYR 36 N -4.76 -0.49 -0.13 0.00 1.13 -1.03 -5.05 117.35 107.02 2ku7 s TYR 36 Ca -0.05 1.06 -0.09 0.00 -1.41 0.00 0.00 57.07 56.58 2ku7 s TYR 36 Cb 0.16 0.10 0.03 0.00 -1.10 0.00 0.00 41.96 41.16 2ku7 s TYR 36 CO 0.71 -0.33 0.18 2.41 -2.51 0.00 0.00 175.55 176.00 2ku7 n THR 37 N 4.77 -9.88 -0.10 -3.49 -1.04 -1.26 -4.74 114.28 98.55 2ku7 n THR 37 Ca -0.16 2.10 -0.20 0.00 -2.04 0.00 0.00 64.05 63.75 2ku7 n THR 37 Cb 0.52 -5.48 -0.07 0.00 -1.82 0.00 0.00 70.33 63.48 2ku7 n THR 37 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2ku7 s VAL 39 N -2.36 1.54 -0.05 0.00 1.01 -1.26 -5.06 120.40 114.23 2ku7 s VAL 39 Ca -0.27 -0.79 0.06 0.00 0.00 0.00 0.00 61.98 60.97 2ku7 s VAL 39 Cb 0.10 -1.32 -0.02 0.00 0.00 0.00 0.00 36.38 35.15 2ku7 s VAL 39 CO 0.35 0.44 -0.22 0.54 0.00 0.00 0.00 175.10 176.21 2ku7 s ASN 40 N -0.09 3.33 -0.06 3.32 4.22 -1.26 -5.13 114.94 119.27 2ku7 s ASN 40 Ca -0.02 -0.41 0.02 0.00 -2.14 0.00 0.00 52.86 50.31 2ku7 s ASN 40 Cb -0.11 -0.69 0.01 0.00 1.28 0.00 0.00 41.25 41.74 2ku7 s ASN 40 CO 0.02 0.29 -0.11 0.00 -2.04 0.00 0.00 177.10 175.26 2ku7 h THR 42 N 5.90 1.29 -3.08 0.00 1.35 -2.10 -3.46 112.91 112.82 2ku7 h THR 42 Ca -0.32 -2.76 -0.62 0.00 -0.55 0.00 0.00 66.41 62.15 2ku7 h THR 42 Cb 1.18 2.60 -0.13 0.00 -1.73 0.00 0.00 68.15 70.07 2ku7 h THR 42 CO 0.48 0.72 -0.69 -1.61 -0.25 0.00 0.00 175.52 174.17 2ku7 s GLU 43 N -2.89 2.30 0.11 4.72 2.02 -1.26 -5.14 118.70 118.56 2ku7 s GLU 43 Ca 0.02 -1.10 0.10 0.00 0.02 0.00 0.00 54.97 54.02 2ku7 s GLU 43 Cb 0.09 -2.33 -0.04 0.00 0.10 0.00 0.00 34.13 31.96 2ku7 s GLU 43 CO 0.78 0.47 -0.26 1.03 0.02 0.00 0.00 175.26 177.29 2ku7 s ARG 44 N -2.72 1.43 -0.09 1.61 0.52 -1.26 -5.14 118.95 113.31 2ku7 s ARG 44 Ca 0.26 -1.29 0.00 0.00 -0.52 0.00 0.00 55.73 54.18 2ku7 s ARG 44 Cb -0.10 -1.86 -0.03 0.00 0.52 0.00 0.00 34.95 33.48 2ku7 s ARG 44 CO 0.17 0.45 -0.08 -1.58 0.02 0.00 0.00 175.30 174.27 2ku7 s HIS 45 N -1.03 2.90 0.02 -0.53 2.46 -1.26 -5.12 115.29 112.73 2ku7 s HIS 45 Ca 0.13 -0.13 0.05 0.00 0.47 0.00 0.00 55.06 55.57 2ku7 s HIS 45 Cb -0.10 -1.75 -0.02 0.00 -0.13 0.00 0.00 32.58 30.58 2ku7 s HIS 45 CO 0.05 0.19 -0.14 0.54 -2.47 0.00 0.00 174.74 172.91 2ku7 s VAL 46 N -0.48 1.11 -0.22 0.89 0.11 -1.26 -5.13 120.40 115.42 2ku7 s VAL 46 Ca 0.07 -0.85 -0.23 0.00 -2.93 0.00 0.00 61.98 58.05 2ku7 s VAL 46 Cb -0.12 -0.98 -0.01 0.00 -1.53 0.00 0.00 36.38 33.74 2ku7 s VAL 46 CO 0.02 0.13 0.73 -0.62 -3.33 0.00 0.00 175.10 172.03 2ku7 s ASP 47 N -0.83 6.75 0.00 3.54 2.15 -1.26 -4.99 116.67 122.03 2ku7 s ASP 47 Ca 0.03 0.92 0.00 0.00 0.43 0.00 0.00 52.55 53.94 2ku7 s ASP 47 Cb -0.07 -2.39 0.00 0.00 -0.30 0.00 0.00 42.92 40.16 2ku7 s ASP 47 CO 0.01 -0.41 0.00 0.61 -0.17 0.00 0.00 175.17 175.21 2ku7 n GLY 48 N 3.83 1.37 2.69 2.66 0.00 -1.26 -4.97 105.19 109.51 2ku7 n GLY 48 Ca 0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 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 5.00 5.22 0.30 -0.02 0.00 -1.26 -4.67 105.19 109.76 2ku7 n GLY 49 Ca 0.00 -2.25 -0.02 0.00 0.00 0.00 0.00 46.02 43.75 2ku7 n GLY 49 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2ku7 h SER 50 N 2.80 0.74 0.00 1.61 0.02 -1.98 -3.47 113.55 113.27 2ku7 h SER 50 Ca 0.52 -0.12 0.00 0.00 -0.84 0.00 0.00 61.79 61.35 2ku7 h SER 50 Cb 0.33 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 62.68 2ku7 h SER 50 CO 1.29 0.72 0.00 0.61 -1.14 0.00 0.00 176.83 178.31 2ku7 n GLY 51 N -0.91 3.27 0.00 -3.77 0.00 -1.26 -4.89 105.19 97.63 2ku7 n GLY 51 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 2ku7 n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ku7 n GLY 52 N -1.33 -0.52 3.46 -0.02 0.00 -1.26 -5.14 105.19 100.38 2ku7 n GLY 52 Ca 0.00 -0.27 -0.29 0.00 0.00 0.00 0.00 46.02 45.46 2ku7 n GLY 52 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ku7 s SER 53 N -4.00 3.72 0.75 1.61 0.01 -1.26 -5.15 113.70 109.38 2ku7 s SER 53 Ca 0.00 -0.63 0.00 0.00 1.31 0.00 0.00 55.95 56.63 2ku7 s SER 53 Cb 0.00 -0.45 0.00 0.00 0.21 0.00 0.00 66.02 65.78 2ku7 s SER 53 CO 0.00 0.17 0.00 0.61 0.41 0.00 0.00 173.24 174.43 2ku7 n GLY 54 N 0.76 -0.37 0.32 3.44 0.00 -1.26 -4.97 105.19 103.10 2ku7 n GLY 54 Ca -0.16 -1.78 0.09 0.00 0.00 0.00 0.00 46.02 44.17 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 0.33 -4.04 -0.02 0.00 -2.07 -3.42 103.07 93.86 2ku7 h GLY 55 Ca 0.00 -0.11 -0.67 0.00 0.00 0.00 0.00 47.33 46.55 2ku7 h GLY 55 CO 0.00 0.09 -0.78 -1.35 0.00 0.00 0.00 176.54 174.50 2ku7 s SER 56 N -6.62 4.04 0.25 0.19 1.04 -1.26 -5.14 113.70 106.20 2ku7 s SER 56 Ca -0.07 -0.53 -0.01 0.00 0.48 0.00 0.00 55.95 55.82 2ku7 s SER 56 Cb 0.18 -0.63 -0.03 0.00 0.10 0.00 0.00 66.02 65.64 2ku7 s SER 56 CO 0.72 0.17 0.26 -0.83 0.98 0.00 0.00 173.24 174.53 2ku7 s GLY 57 N -2.26 1.50 -0.30 7.32 0.00 -1.26 -5.06 107.32 107.25 2ku7 s GLY 57 Ca 0.20 -1.63 0.03 0.00 0.00 0.00 0.00 44.72 43.32 2ku7 s GLY 57 CO 0.12 -1.25 -0.03 -0.32 0.00 0.00 0.00 173.10 171.62 2ku7 s GLY 58 N -3.19 1.79 0.04 0.20 0.00 -1.26 -5.10 107.32 99.80 2ku7 s GLY 58 Ca 0.36 -2.12 0.08 0.00 0.00 0.00 0.00 44.72 43.03 2ku7 s GLY 58 CO 0.16 0.77 -0.23 -0.56 0.00 0.00 0.00 173.10 173.24 2ku7 s SER 59 N 1.05 2.69 -0.07 1.64 0.01 -1.26 -5.14 113.70 112.61 2ku7 s SER 59 Ca 0.00 -0.52 0.01 0.00 1.31 0.00 0.00 55.95 56.75 2ku7 s SER 59 Cb -0.20 -0.24 -0.03 0.00 0.21 0.00 0.00 66.02 65.76 2ku7 s SER 59 CO -0.06 0.20 -0.07 0.00 0.41 0.00 0.00 173.24 173.73 2ku7 s ALA 60 N -0.76 2.99 0.14 1.44 0.00 -1.26 -5.13 121.76 119.18 2ku7 s ALA 60 Ca 0.09 -0.89 0.05 0.00 0.00 0.00 0.00 51.96 51.21 2ku7 s ALA 60 Cb -0.09 -1.23 -0.04 0.00 0.00 0.00 0.00 23.12 21.76 2ku7 s ALA 60 CO 0.01 0.57 -0.12 0.95 0.00 0.00 0.00 175.76 177.18 2ku7 s THR 61 N -0.82 1.25 0.00 0.00 -4.23 -1.26 -4.82 115.64 105.76 2ku7 s THR 61 Ca 0.13 -1.95 0.00 0.00 -1.18 0.00 0.00 61.69 58.68 2ku7 s THR 61 Cb -0.11 -1.74 0.00 0.00 1.34 0.00 0.00 72.50 71.99 2ku7 s THR 61 CO 0.02 -0.63 0.00 0.35 -0.54 0.00 0.00 174.62 173.81 2ku7 n THR 62 N 0.04 0.00 -3.73 3.99 -2.24 -1.26 -4.92 114.28 106.15 2ku7 n THR 62 Ca -0.12 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.30 2ku7 n THR 62 Cb 0.59 -0.38 -0.11 0.00 -2.10 0.00 0.00 70.33 68.33 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 -0.76 3.88 0.00 -0.78 1.02 -1.26 -4.94 119.74 116.90 2ku7 s LYS 63 Ca 0.00 -0.37 0.00 0.00 0.02 0.00 0.00 55.97 55.62 2ku7 s LYS 63 Cb 0.00 -3.45 0.00 0.00 -0.52 0.00 0.00 37.83 33.86 2ku7 s LYS 63 CO 0.00 -0.06 0.40 0.54 -0.92 0.00 0.00 175.35 175.31 2ku7 n ARG 64 N 4.59 -0.16 -3.97 1.68 1.74 -1.26 -4.67 116.66 114.61 2ku7 n ARG 64 Ca -0.15 -0.40 -0.35 0.00 -0.77 0.00 0.00 57.85 56.18 2ku7 n ARG 64 Cb 0.52 -0.89 -0.10 0.00 -1.02 0.00 0.00 32.46 30.97 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 -0.09 4.82 0.21 1.55 1.01 -1.26 -0.72 120.40 125.92 2ku7 s VAL 65 Ca 0.00 -0.02 0.09 0.00 0.00 0.00 0.00 61.98 62.05 2ku7 s VAL 65 Cb 0.00 -3.18 -0.05 0.00 0.00 0.00 0.00 36.38 33.16 2ku7 s VAL 65 CO 0.00 0.45 -0.18 -0.76 0.00 0.00 0.00 175.10 174.61 2ku7 s LEU 66 N 0.43 2.51 -0.14 3.92 1.43 0.19 -0.24 118.68 126.78 2ku7 s LEU 66 Ca 0.03 -0.95 -0.09 0.00 -1.03 0.00 0.00 54.13 52.10 2ku7 s LEU 66 Cb -0.12 -0.87 -0.04 0.00 0.03 0.00 0.00 46.19 45.18 2ku7 s LEU 66 CO 0.00 -0.05 0.15 -0.47 0.23 0.00 0.00 176.35 176.22 2ku7 s TYR 67 N -2.43 3.53 -0.13 0.29 6.14 0.29 -1.03 117.35 124.01 2ku7 s TYR 67 Ca 0.22 0.48 -0.02 0.00 0.64 0.00 0.00 57.07 58.39 2ku7 s TYR 67 Cb -0.04 -2.04 0.04 0.00 0.42 0.00 0.00 41.96 40.34 2ku7 s TYR 67 CO 0.09 0.56 0.01 0.14 0.64 0.00 0.00 175.55 176.99 2ku7 s VAL 68 N -0.50 0.52 0.06 3.14 -7.23 0.19 -2.35 120.40 114.22 2ku7 s VAL 68 Ca 0.13 -0.24 0.05 0.00 -1.81 0.00 0.00 61.98 60.11 2ku7 s VAL 68 Cb -0.12 -0.82 -0.03 0.00 0.56 0.00 0.00 36.38 35.97 2ku7 s VAL 68 CO 0.02 0.05 -0.14 -0.83 -0.31 0.00 0.00 175.10 173.90 2ku7 s GLY 69 N 1.89 0.83 0.00 2.32 0.00 -0.81 -0.31 107.32 111.23 2ku7 s GLY 69 Ca 0.02 -0.95 0.00 0.00 0.00 0.00 0.00 44.72 43.79 2ku7 s GLY 69 CO -0.07 -0.97 0.00 0.61 0.00 0.00 0.00 173.10 172.67 2ku7 n GLY 70 N 1.40 1.38 3.95 0.20 0.00 0.51 -1.31 105.19 111.31 2ku7 n GLY 70 Ca -0.21 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.58 2ku7 n GLY 70 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ku7 s LEU 71 N 0.00 3.39 0.36 0.99 1.02 -0.24 -4.47 118.68 119.74 2ku7 s LEU 71 Ca 0.00 0.33 -0.05 0.00 0.02 0.00 0.00 54.13 54.44 2ku7 s LEU 71 Cb 0.00 -3.18 -0.05 0.00 0.02 0.00 0.00 46.19 42.98 2ku7 s LEU 71 CO 0.00 -0.96 0.64 0.00 0.02 0.00 0.00 176.35 176.04 2ku7 s ALA 72 N -2.76 3.55 0.40 4.21 0.00 -1.26 -4.23 121.76 121.66 2ku7 s ALA 72 Ca 0.53 -0.57 0.20 0.00 0.00 0.00 0.00 51.96 52.12 2ku7 s ALA 72 Cb -0.10 -2.38 1.12 0.00 0.00 0.00 0.00 23.12 21.75 2ku7 s ALA 72 CO 0.40 0.02 1.98 0.93 0.00 0.00 0.00 175.76 179.09 2ku7 h GLU 73 N 1.10 0.00 0.00 0.00 5.08 -1.96 -1.96 114.58 116.84 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 0.20 0.00 0.39 -1.00 0.00 0.00 179.01 179.24 2ku7 n GLU 74 N -3.94 0.40 -2.88 2.33 1.02 -1.26 -4.81 120.64 111.50 2ku7 n GLU 74 Ca -0.02 0.06 -0.40 0.00 -0.02 0.00 0.00 57.16 56.78 2ku7 n GLU 74 Cb 0.29 -1.50 -0.06 0.00 -0.02 0.00 0.00 31.44 30.15 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 -2.48 4.38 0.52 2.62 -7.23 -0.74 -5.07 120.40 112.41 2ku7 s VAL 75 Ca 0.24 1.85 0.01 0.00 -1.81 0.00 0.00 61.98 62.27 2ku7 s VAL 75 Cb 0.16 -4.21 -0.00 0.00 0.56 0.00 0.00 36.38 32.88 2ku7 s VAL 75 CO 0.34 0.46 0.04 -1.81 -0.31 0.00 0.00 175.10 173.81 2ku7 s ASP 76 N -0.77 4.19 0.50 4.85 1.01 -1.26 -4.99 116.67 120.20 2ku7 s ASP 76 Ca 0.39 -1.63 0.15 0.00 0.71 0.00 0.00 52.55 52.17 2ku7 s ASP 76 Cb -0.23 0.57 1.20 0.00 1.01 0.00 0.00 42.92 45.46 2ku7 s ASP 76 CO 0.28 -0.90 2.11 0.44 0.21 0.00 0.00 175.17 177.30 2ku7 h ASP 77 N 1.27 0.11 -0.44 0.27 3.32 -1.97 -1.88 116.42 117.09 2ku7 h ASP 77 Ca -0.43 -0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.48 2ku7 h ASP 77 Cb 1.32 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.83 2ku7 h ASP 77 CO 0.72 0.07 -0.24 0.11 -1.72 0.00 0.00 179.24 178.18 2ku7 h LYS 78 N 0.12 0.95 -0.15 3.56 1.57 -1.98 -1.16 116.57 119.48 2ku7 h LYS 78 Ca 0.07 -0.43 -0.03 0.00 -1.87 0.00 0.00 60.65 58.39 2ku7 h LYS 78 Cb 0.13 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.42 2ku7 h LYS 78 CO -0.01 1.09 -0.03 0.28 -0.57 0.00 0.00 179.45 180.21 2ku7 h VAL 79 N 0.78 1.29 -0.48 0.50 2.07 -1.76 -1.10 116.25 117.55 2ku7 h VAL 79 Ca 0.10 -0.97 -0.13 0.00 0.82 0.00 0.00 66.70 66.51 2ku7 h VAL 79 Cb 0.82 1.64 -0.01 0.00 -1.52 0.00 0.00 31.29 32.21 2ku7 h VAL 79 CO 0.07 0.29 -0.21 0.25 0.02 0.00 0.00 177.57 177.98 2ku7 h LEU 80 N -0.02 1.01 -0.11 2.57 6.46 -1.40 -1.83 115.31 121.99 2ku7 h LEU 80 Ca 0.04 -0.38 -0.03 0.00 -0.12 0.00 0.00 57.88 57.38 2ku7 h LEU 80 Cb 0.45 -0.28 -0.00 0.00 -0.73 0.00 0.00 40.66 40.10 2ku7 h LEU 80 CO 0.01 1.18 -0.05 -0.74 -0.62 0.00 0.00 178.44 178.22 2ku7 h HIS 81 N 0.85 0.26 0.00 1.25 2.76 -1.24 -2.68 115.15 116.35 2ku7 h HIS 81 Ca 0.11 -0.06 -0.01 0.00 -2.20 0.00 0.00 60.37 58.21 2ku7 h HIS 81 Cb 0.79 -0.06 -0.00 0.00 1.55 0.00 0.00 27.41 29.69 2ku7 h HIS 81 CO 0.05 0.57 -0.03 0.00 -1.30 0.00 0.00 177.93 177.22 2ku7 h ALA 82 N 0.65 1.01 0.07 5.26 0.00 -1.22 0.29 119.26 125.31 2ku7 h ALA 82 Ca 0.02 -0.03 -0.28 0.00 0.00 0.00 0.00 54.91 54.63 2ku7 h ALA 82 Cb 0.51 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 2ku7 h ALA 82 CO 0.02 0.04 -1.42 0.00 0.00 0.00 0.00 179.25 177.89 2ku7 h ALA 83 N 1.97 0.38 -0.08 0.00 0.00 -1.30 -3.33 119.26 116.90 2ku7 h ALA 83 Ca -0.00 -1.12 0.00 0.00 0.00 0.00 0.00 54.91 53.79 2ku7 h ALA 83 Cb 0.55 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2ku7 h ALA 83 CO 0.00 1.24 0.00 1.19 0.00 0.00 0.00 179.25 181.69 2ku7 n PHE 84 N -3.35 0.07 0.08 0.00 3.01 -1.01 -4.53 117.46 111.73 2ku7 n PHE 84 Ca -0.12 -0.04 -0.03 0.00 1.01 0.00 0.00 57.45 58.27 2ku7 n PHE 84 Cb 1.02 -0.00 0.18 0.00 -0.01 0.00 0.00 39.48 40.67 2ku7 n PHE 84 CO 0.00 0.00 0.00 0.97 1.01 0.00 0.00 176.76 178.74 2ku7 h ILE 85 N 4.14 1.33 -0.05 4.37 6.09 -1.05 -3.22 117.51 129.13 2ku7 h ILE 85 Ca 0.00 -1.67 0.01 0.00 -1.37 0.00 0.00 64.86 61.83 2ku7 h ILE 85 Cb 0.89 1.78 -0.00 0.00 0.47 0.00 0.00 36.82 39.96 2ku7 h ILE 85 CO 0.00 0.50 0.09 1.55 -3.07 0.00 0.00 178.15 177.22 2ku7 h PRO 86 N 0.21 0.00 0.02 2.19 0.13 -1.80 -1.97 132.00 130.78 2ku7 h PRO 86 Ca 0.01 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.93 2ku7 h PRO 86 Cb 0.91 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.02 2ku7 h PRO 86 CO 0.07 0.00 -0.99 0.74 -0.23 0.00 0.00 178.00 177.59 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 0.02 -0.08 0.00 0.00 2.80 0.00 0.00 57.97 60.71 2ku7 h PHE 87 Cb 0.20 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.34 2ku7 h PHE 87 CO 0.00 1.01 0.00 0.41 -0.60 0.00 0.00 178.31 179.13 2ku7 n GLY 88 N 1.23 -0.82 3.74 -1.45 0.00 -0.74 -4.76 105.19 102.39 2ku7 n GLY 88 Ca -0.02 -0.95 -0.40 0.00 0.00 0.00 0.00 46.02 44.65 2ku7 n GLY 88 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2ku7 s ASP 89 N -4.00 7.34 -0.03 1.61 1.01 -1.26 -4.51 116.67 116.83 2ku7 s ASP 89 Ca 0.00 1.60 0.06 0.00 0.71 0.00 0.00 52.55 54.92 2ku7 s ASP 89 Cb 0.00 -2.52 -0.02 0.00 1.01 0.00 0.00 42.92 41.39 2ku7 s ASP 89 CO 0.00 0.01 -0.20 -0.63 0.21 0.00 0.00 175.17 174.56 2ku7 s ILE 90 N -0.18 2.60 -0.08 0.77 1.01 -1.26 -2.19 121.20 121.87 2ku7 s ILE 90 Ca 0.41 -0.92 -0.04 0.00 0.00 0.00 0.00 60.65 60.09 2ku7 s ILE 90 Cb -0.22 -1.98 -0.01 0.00 0.01 0.00 0.00 42.46 40.26 2ku7 s ILE 90 CO 0.26 0.57 -0.09 0.71 0.00 0.00 0.00 174.94 176.39 2ku7 h THR 91 N 4.38 0.00 -3.66 2.92 1.35 -1.58 -3.46 112.91 112.86 2ku7 h THR 91 Ca -0.45 -0.58 -0.10 0.00 -0.55 0.00 0.00 66.41 64.73 2ku7 h THR 91 Cb 1.14 0.00 -0.16 0.00 -1.73 0.00 0.00 68.15 67.40 2ku7 h THR 91 CO 0.49 0.00 -0.38 -1.81 -0.25 0.00 0.00 175.52 173.57 2ku7 s ASP 92 N -4.74 0.07 -0.11 5.36 1.01 -1.25 -5.06 116.67 111.94 2ku7 s ASP 92 Ca -0.07 -0.49 0.03 0.00 0.71 0.00 0.00 52.55 52.73 2ku7 s ASP 92 Cb 0.01 0.31 0.00 0.00 1.01 0.00 0.00 42.92 44.25 2ku7 s ASP 92 CO 0.11 -0.63 -0.22 -0.63 0.21 0.00 0.00 175.17 174.00 2ku7 s ILE 93 N -3.12 2.16 -0.11 0.77 -1.09 -1.26 -2.75 121.20 115.80 2ku7 s ILE 93 Ca -0.01 -0.97 0.01 0.00 -2.23 0.00 0.00 60.65 57.45 2ku7 s ILE 93 Cb 0.02 -1.84 -0.01 0.00 -1.58 0.00 0.00 42.46 39.04 2ku7 s ILE 93 CO -0.07 0.55 -0.15 -1.10 -1.23 0.00 0.00 174.94 172.94 2ku7 s GLN 94 N 0.46 3.18 -0.30 2.79 -0.21 -1.12 -4.98 119.66 119.48 2ku7 s GLN 94 Ca -0.15 -0.72 0.01 0.00 0.02 0.00 0.00 55.36 54.52 2ku7 s GLN 94 Cb -0.17 -2.54 0.09 0.00 1.00 0.00 0.00 33.01 31.39 2ku7 s GLN 94 CO 0.06 0.28 0.04 0.42 -2.12 0.00 0.00 175.29 173.98 2ku7 s ILE 95 N 0.15 1.48 0.05 1.08 1.09 -1.26 -2.82 121.20 120.98 2ku7 s ILE 95 Ca -0.08 -1.64 -0.31 0.00 -1.10 0.00 0.00 60.65 57.52 2ku7 s ILE 95 Cb -0.15 -2.01 -0.10 0.00 -1.06 0.00 0.00 42.46 39.14 2ku7 s ILE 95 CO 0.05 -0.50 1.93 -2.65 -0.10 0.00 0.00 174.94 173.68 2ku7 n PRO 96 N 4.62 2.79 -4.58 2.79 -0.02 -1.26 -4.99 135.00 134.34 2ku7 n PRO 96 Ca -0.03 1.02 -0.23 0.00 -2.02 0.00 0.00 63.50 62.24 2ku7 n PRO 96 Cb 0.43 -2.95 -0.16 0.00 -0.02 0.00 0.00 33.50 30.80 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 3.96 1.81 0.12 2.45 2.96 -1.26 -4.67 118.68 124.05 2ku7 s LEU 97 Ca 0.88 -0.26 -0.20 0.00 -0.22 0.00 0.00 54.13 54.32 2ku7 s LEU 97 Cb -0.47 -0.74 -0.07 0.00 0.50 0.00 0.00 46.19 45.41 2ku7 s LEU 97 CO 0.42 0.09 0.63 -1.81 -1.32 0.00 0.00 176.35 174.36 2ku7 s ASP 98 N 0.20 7.13 0.33 3.68 1.01 -1.26 -4.94 116.67 122.81 2ku7 s ASP 98 Ca -0.05 1.36 0.04 0.00 0.71 0.00 0.00 52.55 54.61 2ku7 s ASP 98 Cb -0.11 -2.39 0.59 0.00 1.01 0.00 0.00 42.92 42.02 2ku7 s ASP 98 CO 0.01 0.22 1.86 1.88 0.21 0.00 0.00 175.17 179.35 2ku7 h TYR 99 N 4.30 0.52 -0.02 4.23 0.05 -1.98 0.61 116.97 124.67 2ku7 h TYR 99 Ca -0.49 -0.06 -0.03 0.00 0.05 0.00 0.00 58.73 58.21 2ku7 h TYR 99 Cb 1.21 -0.15 0.00 0.00 1.01 0.00 0.00 36.73 38.80 2ku7 h TYR 99 CO 0.66 0.54 -0.09 1.49 -1.05 0.00 0.00 178.16 179.71 2ku7 h GLU 100 N 0.47 0.10 0.00 4.88 4.81 -2.02 -3.37 114.58 119.46 2ku7 h GLU 100 Ca 0.10 -0.08 -0.29 0.00 -0.13 0.00 0.00 59.36 58.96 2ku7 h GLU 100 Cb 0.38 0.02 -0.05 0.00 0.63 0.00 0.00 28.75 29.72 2ku7 h GLU 100 CO 0.02 0.73 -1.86 0.25 -0.73 0.00 0.00 179.01 177.42 2ku7 n THR 101 N -4.67 1.46 -2.81 0.32 -2.24 -1.22 -4.98 114.28 100.14 2ku7 n THR 101 Ca -0.09 -0.79 -0.16 0.00 -2.27 0.00 0.00 64.05 60.74 2ku7 n THR 101 Cb 0.38 -0.82 -0.00 0.00 -2.10 0.00 0.00 70.33 67.78 2ku7 n THR 101 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 2ku7 n GLU 102 N -2.93 -2.82 -4.38 -0.78 2.13 0.21 -4.96 120.64 107.12 2ku7 n GLU 102 Ca -0.20 0.53 -0.27 0.00 0.66 0.00 0.00 57.16 57.89 2ku7 n GLU 102 Cb 1.04 -5.18 -0.11 0.00 0.27 0.00 0.00 31.44 27.46 2ku7 n GLU 102 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 2ku7 s LYS 103 N -5.42 1.72 -0.03 5.31 1.02 -1.26 -4.94 119.74 116.14 2ku7 s LYS 103 Ca 0.16 -1.46 -0.08 0.00 0.02 0.00 0.00 55.97 54.61 2ku7 s LYS 103 Cb -0.08 -1.95 -0.05 0.00 -0.52 0.00 0.00 37.83 35.23 2ku7 s LYS 103 CO 0.20 0.41 0.26 -1.58 -0.92 0.00 0.00 175.35 173.71 2ku7 s HIS 104 N -1.76 3.61 -2.41 3.18 5.65 -1.26 -4.37 115.29 117.94 2ku7 s HIS 104 Ca 0.23 0.65 0.26 0.00 0.25 0.00 0.00 55.06 56.45 2ku7 s HIS 104 Cb -0.08 -2.04 0.63 0.00 -1.18 0.00 0.00 32.58 29.91 2ku7 s HIS 104 CO 0.12 0.65 1.50 0.54 -0.65 0.00 0.00 174.74 176.90 2ku7 n ARG 105 N 1.49 1.60 -0.44 2.88 5.12 -1.26 -4.79 116.66 121.25 2ku7 n ARG 105 Ca -0.14 -1.12 0.00 0.00 -1.93 0.00 0.00 57.85 54.66 2ku7 n ARG 105 Cb 0.53 -1.48 0.00 0.00 -1.16 0.00 0.00 32.46 30.36 2ku7 n ARG 105 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2ku7 n GLY 106 N 1.29 0.76 3.12 -0.13 0.00 -1.26 -4.94 105.19 104.03 2ku7 n GLY 106 Ca 0.15 -0.47 -0.12 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.04 0.30 1.61 -0.12 -1.26 -0.36 117.98 116.11 2ku7 s PHE 107 Ca 0.00 0.05 -0.17 0.00 -0.05 0.00 0.00 56.93 56.76 2ku7 s PHE 107 Cb 0.00 -0.00 0.02 0.00 -0.63 0.00 0.00 43.02 42.41 2ku7 s PHE 107 CO 0.00 -0.27 0.67 0.00 -0.05 0.00 0.00 175.22 175.57 2ku7 s ALA 108 N -1.10 -0.76 0.11 1.99 0.00 0.58 -4.58 121.76 118.00 2ku7 s ALA 108 Ca -0.12 -0.62 0.10 0.00 0.00 0.00 0.00 51.96 51.32 2ku7 s ALA 108 Cb -0.06 0.87 -0.04 0.00 0.00 0.00 0.00 23.12 23.89 2ku7 s ALA 108 CO 0.02 -0.97 -0.22 -0.06 0.00 0.00 0.00 175.76 174.53 2ku7 s PHE 109 N -3.48 2.44 -0.04 0.00 0.08 -1.13 -0.64 117.98 115.21 2ku7 s PHE 109 Ca 0.16 -0.32 0.05 0.00 0.12 0.00 0.00 56.93 56.94 2ku7 s PHE 109 Cb -0.04 -1.32 -0.01 0.00 -0.57 0.00 0.00 43.02 41.08 2ku7 s PHE 109 CO 0.09 0.34 -0.18 0.54 -0.10 0.00 0.00 175.22 175.92 2ku7 s VAL 110 N -1.08 1.44 -0.15 -0.44 0.11 -0.20 -2.78 120.40 117.31 2ku7 s VAL 110 Ca 0.16 -0.74 -0.03 0.00 -2.93 0.00 0.00 61.98 58.44 2ku7 s VAL 110 Cb -0.10 -1.23 -0.03 0.00 -1.53 0.00 0.00 36.38 33.49 2ku7 s VAL 110 CO 0.08 0.41 -0.05 -0.70 -3.33 0.00 0.00 175.10 171.51 2ku7 s GLU 111 N -0.08 3.63 -0.02 1.54 -6.30 -1.11 -0.63 118.70 115.72 2ku7 s GLU 111 Ca -0.01 -0.55 0.02 0.00 -2.50 0.00 0.00 54.97 51.93 2ku7 s GLU 111 Cb -0.10 -2.87 -0.03 0.00 0.00 0.00 0.00 34.13 31.13 2ku7 s GLU 111 CO 0.01 0.24 -0.04 -0.06 0.02 0.00 0.00 175.26 175.44 2ku7 s PHE 112 N 0.35 2.99 0.23 5.30 0.08 0.11 -1.46 117.98 125.57 2ku7 s PHE 112 Ca -0.05 0.03 -0.03 0.00 0.12 0.00 0.00 56.93 57.00 2ku7 s PHE 112 Cb -0.14 -1.66 0.24 0.00 -0.57 0.00 0.00 43.02 40.88 2ku7 s PHE 112 CO 0.03 0.40 1.66 1.49 -0.10 0.00 0.00 175.22 178.71 2ku7 h GLU 113 N 4.66 0.74 -5.96 0.44 4.81 -1.76 -3.44 114.58 114.07 2ku7 h GLU 113 Ca -0.49 -0.28 -0.67 0.00 -0.13 0.00 0.00 59.36 57.79 2ku7 h GLU 113 Cb 1.17 -0.05 -0.13 0.00 0.63 0.00 0.00 28.75 30.38 2ku7 h GLU 113 CO 0.55 0.87 -0.60 -0.51 -0.73 0.00 0.00 179.01 178.59 2ku7 s LEU 114 N -8.91 3.73 0.38 1.64 1.02 -1.26 -5.01 118.68 110.27 2ku7 s LEU 114 Ca -0.09 0.17 0.20 0.00 0.02 0.00 0.00 54.13 54.43 2ku7 s LEU 114 Cb 0.13 -1.95 0.54 0.00 0.02 0.00 0.00 46.19 44.94 2ku7 s LEU 114 CO 0.83 0.35 1.66 0.00 0.02 0.00 0.00 176.35 179.21 2ku7 h ALA 115 N 4.86 0.89 -0.03 4.21 0.00 -1.84 -3.13 119.26 124.22 2ku7 h ALA 115 Ca -0.51 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.09 2ku7 h ALA 115 Cb 1.19 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2ku7 h ALA 115 CO 0.56 0.39 -0.09 0.93 0.00 0.00 0.00 179.25 181.04 2ku7 h GLU 116 N 0.00 0.12 -0.14 0.00 4.39 -1.93 -2.85 114.58 114.18 2ku7 h GLU 116 Ca -0.00 -0.08 -0.08 0.00 0.34 0.00 0.00 59.36 59.53 2ku7 h GLU 116 Cb 1.01 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.66 2ku7 h GLU 116 CO 0.04 0.70 -0.26 0.38 -1.16 0.00 0.00 179.01 178.71 2ku7 h ASP 117 N -0.44 0.25 -0.37 1.42 3.04 -1.86 -2.51 116.42 115.95 2ku7 h ASP 117 Ca -0.00 -0.08 -0.07 0.00 -3.24 0.00 0.00 57.03 53.64 2ku7 h ASP 117 Cb 0.70 -0.07 -0.01 0.00 -1.04 0.00 0.00 39.33 38.91 2ku7 h ASP 117 CO 0.02 0.52 -0.05 0.00 -2.04 0.00 0.00 179.24 177.69 2ku7 h ALA 118 N 1.51 0.51 0.00 4.15 0.00 -1.61 -2.34 119.26 121.48 2ku7 h ALA 118 Ca 0.04 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.62 2ku7 h ALA 118 Cb 0.59 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2ku7 h ALA 118 CO 0.04 0.33 -0.22 0.00 0.00 0.00 0.00 179.25 179.40 2ku7 h ALA 119 N 0.85 1.53 -0.25 0.00 0.00 -1.35 -2.33 119.26 117.70 2ku7 h ALA 119 Ca 0.10 -0.20 -0.14 0.00 0.00 0.00 0.00 54.91 54.67 2ku7 h ALA 119 Cb 0.54 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 2ku7 h ALA 119 CO 0.03 0.28 -0.43 0.00 0.00 0.00 0.00 179.25 179.12 2ku7 h ALA 120 N 1.78 0.79 -0.50 0.00 0.00 -1.16 -2.69 119.26 117.48 2ku7 h ALA 120 Ca -0.00 -0.46 -0.11 0.00 0.00 0.00 0.00 54.91 54.34 2ku7 h ALA 120 Cb 0.42 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2ku7 h ALA 120 CO 0.03 0.66 -0.13 0.00 0.00 0.00 0.00 179.25 179.81 2ku7 h ALA 121 N 1.03 0.83 -0.12 0.00 0.00 -0.89 -2.63 119.26 117.48 2ku7 h ALA 121 Ca 0.04 -0.35 -0.14 0.00 0.00 0.00 0.00 54.91 54.46 2ku7 h ALA 121 Cb 0.95 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 2ku7 h ALA 121 CO 0.09 0.65 -0.52 0.82 0.00 0.00 0.00 179.25 180.29 2ku7 h ILE 122 N 0.84 1.35 -0.08 0.00 2.04 -1.48 0.21 117.51 120.38 2ku7 h ILE 122 Ca 0.13 -1.78 -0.14 0.00 1.00 0.00 0.00 64.86 64.08 2ku7 h ILE 122 Cb 0.67 1.83 -0.01 0.00 -0.74 0.00 0.00 36.82 38.57 2ku7 h ILE 122 CO 0.05 0.53 -0.56 -0.78 0.00 0.00 0.00 178.15 177.40 2ku7 h ASP 123 N 0.25 0.27 0.00 1.72 3.58 -1.36 -3.05 116.42 117.83 2ku7 h ASP 123 Ca 0.01 -0.15 -0.30 0.00 0.42 0.00 0.00 57.03 57.01 2ku7 h ASP 123 Cb 1.00 -0.08 -0.05 0.00 1.72 0.00 0.00 39.33 41.91 2ku7 h ASP 123 CO 0.08 0.77 -2.13 0.59 -2.88 0.00 0.00 179.24 175.68 2ku7 n ASN 124 N -3.91 1.84 -1.37 2.28 3.02 -1.00 -4.64 115.26 111.48 2ku7 n ASN 124 Ca -0.02 -0.06 0.09 0.00 -0.03 0.00 0.00 54.58 54.55 2ku7 n ASN 124 Cb 0.58 0.20 0.32 0.00 -0.61 0.00 0.00 39.78 40.27 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 -2.88 3.53 -0.21 3.52 2.81 0.72 -4.54 117.12 120.07 2ku7 n MET 125 Ca -0.32 -2.77 0.07 0.00 -1.81 0.00 0.00 57.70 52.87 2ku7 n MET 125 Cb 0.94 -1.80 0.34 0.00 -0.71 0.00 0.00 33.22 31.99 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 3.50 0.70 -1.90 7.83 -0.73 -1.64 -3.30 115.58 120.03 2ku7 h ASN 126 Ca 0.00 0.01 -0.52 0.00 1.87 0.00 0.00 56.30 57.66 2ku7 h ASN 126 Cb 1.36 -0.14 -0.35 0.00 0.27 0.00 0.00 38.32 39.45 2ku7 h ASN 126 CO 0.20 0.44 -0.97 -0.62 -0.37 0.00 0.00 177.43 176.11 2ku7 n GLU 127 N -4.49 0.51 -4.41 6.67 1.02 -1.24 -2.60 120.64 116.10 2ku7 n GLU 127 Ca 0.12 -3.01 -0.21 0.00 -0.02 0.00 0.00 57.16 54.04 2ku7 n GLU 127 Cb 0.25 -1.41 -0.10 0.00 -0.02 0.00 0.00 31.44 30.15 2ku7 n GLU 127 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2ku7 s SER 128 N -0.65 2.98 -0.26 1.62 1.04 -1.17 -4.93 113.70 112.34 2ku7 s SER 128 Ca 0.34 -1.07 -0.16 0.00 0.48 0.00 0.00 55.95 55.54 2ku7 s SER 128 Cb 0.12 -0.20 -0.03 0.00 0.10 0.00 0.00 66.02 66.00 2ku7 s SER 128 CO -0.15 -0.15 0.43 -0.70 0.98 0.00 0.00 173.24 173.65 2ku7 s GLU 129 N -3.62 4.05 -0.07 4.02 2.12 -1.26 -0.26 118.70 123.68 2ku7 s GLU 129 Ca 0.27 0.16 0.02 0.00 0.36 0.00 0.00 54.97 55.78 2ku7 s GLU 129 Cb -0.01 -3.64 0.01 0.00 0.26 0.00 0.00 34.13 30.75 2ku7 s GLU 129 CO 0.11 -0.28 -0.12 -1.17 -0.54 0.00 0.00 175.26 173.26 2ku7 s LEU 130 N 2.07 1.62 -1.15 2.70 2.96 0.15 -4.75 118.68 122.28 2ku7 s LEU 130 Ca 0.18 -0.31 0.00 0.00 -0.22 0.00 0.00 54.13 53.77 2ku7 s LEU 130 Cb -0.16 -0.86 0.00 0.00 0.50 0.00 0.00 46.19 45.67 2ku7 s LEU 130 CO 0.09 0.02 0.00 0.33 -1.32 0.00 0.00 176.35 175.48 2ku7 n PHE 131 N 3.93 0.00 -0.15 5.38 -0.00 -1.26 -1.60 117.46 123.77 2ku7 n PHE 131 Ca -0.22 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.23 2ku7 n PHE 131 Cb 0.52 -2.59 0.00 0.00 -0.00 0.00 0.00 39.48 37.41 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 0.76 3.29 7.13 0.00 -1.26 -4.96 105.19 109.98 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 1.14 0.06 1.61 0.52 -0.63 -5.11 118.95 115.69 2ku7 s ARG 133 Ca 0.00 -1.32 -0.29 0.00 -0.52 0.00 0.00 55.73 53.60 2ku7 s ARG 133 Cb 0.00 -1.12 -0.05 0.00 0.52 0.00 0.00 34.95 34.31 2ku7 s ARG 133 CO 0.00 0.22 0.92 0.99 0.02 0.00 0.00 175.30 177.45 2ku7 s THR 134 N -2.08 4.68 0.20 0.02 2.01 -1.26 0.32 115.64 119.53 2ku7 s THR 134 Ca 0.12 1.96 0.11 0.00 0.31 0.00 0.00 61.69 64.20 2ku7 s THR 134 Cb -0.05 -4.27 -0.04 0.00 0.01 0.00 0.00 72.50 68.14 2ku7 s THR 134 CO 0.05 0.27 -0.22 0.27 -0.69 0.00 0.00 174.62 174.30 2ku7 s ILE 135 N 0.34 2.46 -0.06 1.82 -4.36 0.64 -4.45 121.20 117.58 2ku7 s ILE 135 Ca 0.47 -2.04 0.05 0.00 -0.26 0.00 0.00 60.65 58.86 2ku7 s ILE 135 Cb -0.22 -2.20 -0.00 0.00 1.25 0.00 0.00 42.46 41.29 2ku7 s ILE 135 CO 0.28 -0.15 -0.21 -0.13 0.24 0.00 0.00 174.94 174.97 2ku7 s ARG 136 N -2.80 2.30 -0.03 0.37 0.52 -0.43 -3.02 118.95 115.87 2ku7 s ARG 136 Ca 0.22 -0.74 0.03 0.00 -0.52 0.00 0.00 55.73 54.72 2ku7 s ARG 136 Cb -0.08 -1.90 -0.00 0.00 0.52 0.00 0.00 34.95 33.50 2ku7 s ARG 136 CO 0.11 0.25 -0.12 0.14 0.02 0.00 0.00 175.30 175.70 2ku7 s VAL 137 N 0.11 1.02 0.26 3.52 -7.23 -1.07 -1.93 120.40 115.07 2ku7 s VAL 137 Ca -0.08 -0.50 -0.09 0.00 -1.81 0.00 0.00 61.98 59.50 2ku7 s VAL 137 Cb -0.14 -0.89 -0.01 0.00 0.56 0.00 0.00 36.38 35.91 2ku7 s VAL 137 CO 0.04 0.30 0.44 0.20 -0.31 0.00 0.00 175.10 175.78 2ku7 s ASN 138 N 0.09 0.13 0.06 4.85 0.01 -0.99 -4.56 114.94 114.54 2ku7 s ASN 138 Ca -0.02 -1.10 -0.31 0.00 -0.71 0.00 0.00 52.86 50.72 2ku7 s ASN 138 Cb -0.09 0.58 -0.06 0.00 0.41 0.00 0.00 41.25 42.09 2ku7 s ASN 138 CO 0.01 -1.15 1.30 -0.76 -1.51 0.00 0.00 177.10 174.99 2ku7 s LEU 139 N -3.08 4.35 0.00 0.60 1.43 -1.26 0.10 118.68 120.83 2ku7 s LEU 139 Ca 0.26 2.12 0.26 0.00 -1.03 0.00 0.00 54.13 55.74 2ku7 s LEU 139 Cb 0.00 -3.58 0.62 0.00 0.03 0.00 0.00 46.19 43.26 2ku7 s LEU 139 CO 0.12 -0.58 1.50 0.00 0.23 0.00 0.00 176.35 177.62