#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bkp n GLU 10 N 0.00 0.54 -2.49 -3.48 1.02 -1.26 -4.90 120.64 110.07 2bkp n GLU 10 Ca 0.00 0.19 -0.41 0.00 -0.02 0.00 0.00 57.16 56.92 2bkp n GLU 10 Cb 0.00 -1.56 -0.04 0.00 -0.02 0.00 0.00 31.44 29.83 2bkp n GLU 10 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 2bkp s PRO 11 N -0.46 4.54 0.32 3.49 0.04 -1.26 -5.04 135.00 136.63 2bkp s PRO 11 Ca 0.75 1.72 -0.09 0.00 0.04 0.00 0.00 61.00 63.43 2bkp s PRO 11 Cb -0.98 -3.30 -0.06 0.00 0.04 0.00 0.00 34.50 30.19 2bkp s PRO 11 CO 0.55 -0.03 0.65 0.15 0.04 0.00 0.00 177.00 178.35 2bkp s LYS 12 N 0.10 3.75 0.50 4.56 1.02 -1.26 -5.09 119.74 123.33 2bkp s LYS 12 Ca 0.52 0.28 0.01 0.00 0.02 0.00 0.00 55.97 56.80 2bkp s LYS 12 Cb -0.29 -2.54 0.02 0.00 -0.52 0.00 0.00 37.83 34.50 2bkp s LYS 12 CO 0.33 0.14 0.73 -1.54 -0.92 0.00 0.00 175.35 174.09 2bkp s SER 13 N -2.92 5.53 0.09 2.83 1.04 -1.26 -5.00 113.70 114.02 2bkp s SER 13 Ca 0.48 0.13 -0.21 0.00 0.48 0.00 0.00 55.95 56.84 2bkp s SER 13 Cb -0.11 -1.18 -0.10 0.00 0.10 0.00 0.00 66.02 64.74 2bkp s SER 13 CO 0.27 -0.94 1.65 0.58 0.98 0.00 0.00 173.24 175.78 2bkp h VAL 14 N 0.22 1.14 -0.19 5.02 2.07 -1.97 -3.03 116.25 119.50 2bkp h VAL 14 Ca -0.44 -0.41 0.05 0.00 0.82 0.00 0.00 66.70 66.72 2bkp h VAL 14 Cb 1.28 1.10 -0.06 0.00 -1.52 0.00 0.00 31.29 32.09 2bkp h VAL 14 CO 0.55 0.13 -0.17 0.50 0.02 0.00 0.00 177.57 178.60 2bkp h LYS 15 N 0.13 -0.17 -0.13 1.57 3.64 -1.98 0.12 116.57 119.75 2bkp h LYS 15 Ca 0.06 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.44 2bkp h LYS 15 Cb 0.14 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.99 2bkp h LYS 15 CO -0.01 -0.12 0.04 1.05 -2.27 0.00 0.00 179.45 178.15 2bkp h GLU 16 N -0.18 0.18 -0.16 1.90 4.11 -1.96 0.37 114.58 118.84 2bkp h GLU 16 Ca 0.12 -0.02 -0.13 0.00 0.07 0.00 0.00 59.36 59.40 2bkp h GLU 16 Cb 0.36 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.57 2bkp h GLU 16 CO -0.30 0.16 -0.40 0.82 0.07 0.00 0.00 179.01 179.36 2bkp h ILE 17 N 0.18 1.34 -0.35 -1.06 2.04 -1.23 -2.04 117.51 116.40 2bkp h ILE 17 Ca 0.05 -1.66 -0.01 0.00 1.00 0.00 0.00 64.86 64.24 2bkp h ILE 17 Cb 0.06 1.97 -0.02 0.00 -0.74 0.00 0.00 36.82 38.09 2bkp h ILE 17 CO -0.00 0.51 0.19 0.15 0.00 0.00 0.00 178.15 178.99 2bkp h PHE 18 N 0.21 0.48 -0.59 1.37 3.57 0.19 -1.55 116.94 120.61 2bkp h PHE 18 Ca -0.00 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.48 2bkp h PHE 18 Cb 1.01 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 39.57 2bkp h PHE 18 CO 0.10 0.39 0.37 0.82 -2.23 0.00 0.00 178.31 177.76 2bkp h ILE 19 N 0.44 1.17 -0.61 1.41 2.04 -0.29 -1.03 117.51 120.64 2bkp h ILE 19 Ca 0.12 -0.36 -0.06 0.00 1.00 0.00 0.00 64.86 65.56 2bkp h ILE 19 Cb 0.07 0.34 -0.03 0.00 -0.74 0.00 0.00 36.82 36.47 2bkp h ILE 19 CO -0.02 0.17 0.15 -0.08 0.00 0.00 0.00 178.15 178.37 2bkp h GLU 20 N 0.80 0.95 -0.30 2.37 4.81 -1.14 -0.13 114.58 121.95 2bkp h GLU 20 Ca 0.21 -0.21 -0.01 0.00 -0.13 0.00 0.00 59.36 59.23 2bkp h GLU 20 Cb -0.04 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.19 2bkp h GLU 20 CO -0.04 0.84 0.16 0.52 -0.73 0.00 0.00 179.01 179.77 2bkp h MET 21 N 0.91 0.41 -0.18 1.92 2.86 -0.58 0.19 114.93 120.46 2bkp h MET 21 Ca 0.19 -0.05 -0.02 0.00 -2.06 0.00 0.00 59.70 57.77 2bkp h MET 21 Cb 0.33 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.90 2bkp h MET 21 CO -0.00 0.35 0.05 -0.22 1.06 0.00 0.00 176.91 178.14 2bkp h LYS 22 N 0.36 0.28 -0.77 1.72 3.64 -0.95 -0.66 116.57 120.19 2bkp h LYS 22 Ca 0.10 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 2bkp h LYS 22 Cb 0.05 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 31.80 2bkp h LYS 22 CO -0.02 0.41 0.43 -0.44 -2.27 0.00 0.00 179.45 177.57 2bkp h ASP 23 N 0.10 0.95 -0.19 4.20 3.32 -0.91 -2.70 116.42 121.20 2bkp h ASP 23 Ca 0.06 -0.09 -0.05 0.00 0.02 0.00 0.00 57.03 56.96 2bkp h ASP 23 Cb 0.25 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 2bkp h ASP 23 CO -0.00 0.77 -0.10 0.74 -1.72 0.00 0.00 179.24 178.93 2bkp h THR 24 N 1.06 1.31 -0.30 0.35 2.02 -0.48 -2.17 112.91 114.70 2bkp h THR 24 Ca 0.27 -1.16 -0.03 0.00 0.77 0.00 0.00 66.41 66.26 2bkp h THR 24 Cb 0.02 1.68 -0.02 0.00 -1.74 0.00 0.00 68.15 68.09 2bkp h THR 24 CO -0.05 0.35 0.06 1.62 0.37 0.00 0.00 175.52 177.87 2bkp h VAL 25 N 0.08 1.15 -0.31 3.16 3.04 -1.07 -0.30 116.25 122.00 2bkp h VAL 25 Ca 0.04 -0.56 -0.11 0.00 -1.01 0.00 0.00 66.70 65.06 2bkp h VAL 25 Cb 0.58 0.86 -0.01 0.00 -2.01 0.00 0.00 31.29 30.72 2bkp h VAL 25 CO 0.03 0.20 -0.25 -0.33 -1.01 0.00 0.00 177.57 176.20 2bkp h GLU 26 N 0.44 0.72 -0.83 4.17 5.08 -1.40 -2.03 114.58 120.73 2bkp h GLU 26 Ca 0.10 -0.36 0.01 0.00 -1.00 0.00 0.00 59.36 58.12 2bkp h GLU 26 Cb 0.20 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.41 2bkp h GLU 26 CO -0.00 0.98 0.55 1.25 -1.00 0.00 0.00 179.01 180.78 2bkp h LEU 27 N 0.48 0.94 -0.56 1.33 5.85 -0.77 -2.47 115.31 120.12 2bkp h LEU 27 Ca 0.06 -0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.78 2bkp h LEU 27 Cb 0.81 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.58 2bkp h LEU 27 CO 0.07 0.68 0.34 0.24 -0.34 0.00 0.00 178.44 179.42 2bkp h MET 28 N 1.11 0.65 -0.50 1.25 2.86 -0.72 0.91 114.93 120.49 2bkp h MET 28 Ca 0.31 -0.04 -0.02 0.00 -2.06 0.00 0.00 59.70 57.89 2bkp h MET 28 Cb -0.11 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.38 2bkp h MET 28 CO -0.07 0.43 0.23 0.28 1.06 0.00 0.00 176.91 178.83 2bkp h VAL 29 N 0.67 1.20 -0.06 -2.22 2.07 -1.20 0.23 116.25 116.93 2bkp h VAL 29 Ca 0.22 -0.56 -0.00 0.00 0.82 0.00 0.00 66.70 67.18 2bkp h VAL 29 Cb 0.02 0.65 -0.00 0.00 -1.52 0.00 0.00 31.29 30.44 2bkp h VAL 29 CO -0.10 0.22 0.04 0.44 0.02 0.00 0.00 177.57 178.19 2bkp h ASP 30 N 0.66 0.07 -0.12 0.57 3.32 -1.02 -1.86 116.42 118.04 2bkp h ASP 30 Ca 0.17 -0.04 -0.07 0.00 0.02 0.00 0.00 57.03 57.12 2bkp h ASP 30 Cb 0.13 -0.02 -0.02 0.00 0.22 0.00 0.00 39.33 39.65 2bkp h ASP 30 CO -0.02 0.08 -0.12 -0.07 -1.72 0.00 0.00 179.24 177.40 2bkp h LEU 31 N 0.05 0.44 -0.34 1.55 3.38 -0.63 -0.44 115.31 119.32 2bkp h LEU 31 Ca 0.02 -0.11 0.01 0.00 0.09 0.00 0.00 57.88 57.89 2bkp h LEU 31 Cb 0.03 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 2bkp h LEU 31 CO -0.00 0.60 0.22 0.00 0.09 0.00 0.00 178.44 179.35 2bkp h ALA 32 N 1.45 0.43 -0.37 1.53 0.00 -0.20 0.29 119.26 122.40 2bkp h ALA 32 Ca 0.08 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 2bkp h ALA 32 Cb 0.46 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2bkp h ALA 32 CO 0.03 -0.11 -0.15 1.88 0.00 0.00 0.00 179.25 180.90 2bkp h TYR 33 N 0.46 0.73 -0.36 0.00 0.05 -1.02 -2.46 116.97 114.37 2bkp h TYR 33 Ca 0.13 -0.13 -0.12 0.00 0.05 0.00 0.00 58.73 58.65 2bkp h TYR 33 Cb -0.05 -0.19 -0.01 0.00 1.01 0.00 0.00 36.73 37.50 2bkp h TYR 33 CO -0.06 0.77 -0.27 0.00 -1.05 0.00 0.00 178.16 177.55 2bkp h ALA 34 N 1.24 0.85 0.00 3.88 0.00 -0.28 -0.54 119.26 124.41 2bkp h ALA 34 Ca 0.10 -0.39 -0.08 0.00 0.00 0.00 0.00 54.91 54.54 2bkp h ALA 34 Cb 0.59 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2bkp h ALA 34 CO 0.04 0.64 -0.38 0.66 0.00 0.00 0.00 179.25 180.21 2bkp h SER 35 N 0.64 0.00 0.03 0.00 4.64 -0.15 -1.34 113.55 117.37 2bkp h SER 35 Ca 0.08 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.24 2bkp h SER 35 Cb 0.79 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.89 2bkp h SER 35 CO 0.07 0.38 -0.65 -0.07 -0.87 0.00 0.00 176.83 175.68 2bkp h LEU 36 N 0.00 0.51 -0.52 5.97 3.38 -1.21 -0.34 115.31 123.11 2bkp h LEU 36 Ca -0.00 -0.81 0.01 0.00 0.09 0.00 0.00 57.88 57.17 2bkp h LEU 36 Cb 0.67 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 2bkp h LEU 36 CO 0.05 1.26 0.34 0.25 0.09 0.00 0.00 178.44 180.43 2bkp h LEU 37 N -0.17 0.59 -2.83 1.67 5.85 -0.89 -2.82 115.31 116.71 2bkp h LEU 37 Ca -0.09 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.61 2bkp h LEU 37 Cb 1.39 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.28 2bkp h LEU 37 CO 0.13 0.43 0.00 0.49 -0.34 0.00 0.00 178.44 179.14 2bkp n PHE 38 N -4.73 1.08 -4.30 1.25 3.72 -0.52 -4.94 117.46 109.02 2bkp n PHE 38 Ca 0.03 -0.52 -0.35 0.00 -0.05 0.00 0.00 57.45 56.56 2bkp n PHE 38 Cb 0.02 -0.05 -0.06 0.00 -0.94 0.00 0.00 39.48 38.46 2bkp n PHE 38 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2bkp n GLY 39 N 1.57 -0.30 3.43 1.37 0.00 -0.41 -4.88 105.19 105.97 2bkp n GLY 39 Ca 0.25 0.13 -0.42 0.00 0.00 0.00 0.00 46.02 45.98 2bkp n GLY 39 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2bkp s ASP 40 N -3.77 5.96 0.39 1.61 -1.08 -0.27 -4.97 116.67 114.53 2bkp s ASP 40 Ca 0.44 -0.91 0.12 0.00 -0.52 0.00 0.00 52.55 51.68 2bkp s ASP 40 Cb -0.25 -2.10 0.78 0.00 -1.46 0.00 0.00 42.92 39.89 2bkp s ASP 40 CO 0.97 -0.41 1.87 0.11 0.52 0.00 0.00 175.17 178.23 2bkp h LYS 41 N 8.55 0.04 -0.41 4.34 1.57 -1.87 -2.27 116.57 126.53 2bkp h LYS 41 Ca -0.27 -0.01 -0.15 0.00 -1.87 0.00 0.00 60.65 58.35 2bkp h LYS 41 Cb 1.12 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.41 2bkp h LYS 41 CO 0.70 0.34 -0.32 0.93 -0.57 0.00 0.00 179.45 180.54 2bkp h GLU 42 N 0.04 0.92 -0.31 3.15 5.08 -1.98 0.46 114.58 121.94 2bkp h GLU 42 Ca 0.00 -0.44 -0.02 0.00 -1.00 0.00 0.00 59.36 57.90 2bkp h GLU 42 Cb 0.55 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 2bkp h GLU 42 CO 0.04 1.10 0.11 0.82 -1.00 0.00 0.00 179.01 180.07 2bkp h ILE 43 N 0.77 1.19 -0.84 3.13 2.04 -1.91 -1.58 117.51 120.32 2bkp h ILE 43 Ca 0.08 -0.61 0.07 0.00 1.00 0.00 0.00 64.86 65.40 2bkp h ILE 43 Cb 0.89 1.02 -0.06 0.00 -0.74 0.00 0.00 36.82 37.93 2bkp h ILE 43 CO 0.08 0.21 0.51 0.00 0.00 0.00 0.00 178.15 178.95 2bkp h ALA 44 N 0.95 1.17 -0.14 1.87 0.00 -1.15 -0.52 119.26 121.43 2bkp h ALA 44 Ca 0.10 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 2bkp h ALA 44 Cb 0.22 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2bkp h ALA 44 CO -0.01 0.21 -0.20 1.49 0.00 0.00 0.00 179.25 180.75 2bkp h GLU 45 N 0.90 0.24 -0.65 0.00 4.57 -0.54 -2.06 114.58 117.05 2bkp h GLU 45 Ca 0.38 -0.07 -0.06 0.00 -1.18 0.00 0.00 59.36 58.43 2bkp h GLU 45 Cb 0.23 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.77 2bkp h GLU 45 CO -0.20 0.44 0.18 1.49 -1.18 0.00 0.00 179.01 179.74 2bkp h GLU 46 N 0.22 1.01 -0.72 1.92 4.57 -0.11 -1.75 114.58 119.73 2bkp h GLU 46 Ca 0.04 -0.22 -0.01 0.00 -1.18 0.00 0.00 59.36 58.00 2bkp h GLU 46 Cb 0.48 -0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 28.89 2bkp h GLU 46 CO 0.03 0.88 0.41 0.28 -1.18 0.00 0.00 179.01 179.44 2bkp h VAL 47 N 0.97 1.21 -0.22 0.32 2.07 -0.72 -0.21 116.25 119.67 2bkp h VAL 47 Ca 0.21 -0.49 -0.12 0.00 0.82 0.00 0.00 66.70 67.12 2bkp h VAL 47 Cb 0.31 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 2bkp h VAL 47 CO -0.00 0.23 -0.37 -0.07 0.02 0.00 0.00 177.57 177.37 2bkp h LEU 48 N 0.98 0.52 -0.61 2.57 3.38 -1.19 -1.29 115.31 119.66 2bkp h LEU 48 Ca 0.25 -0.22 -0.08 0.00 0.09 0.00 0.00 57.88 57.93 2bkp h LEU 48 Cb -0.00 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 2bkp h LEU 48 CO -0.04 0.84 0.08 -0.33 0.09 0.00 0.00 178.44 179.08 2bkp h GLU 49 N 0.42 1.03 -0.05 1.13 5.08 -0.81 -2.46 114.58 118.91 2bkp h GLU 49 Ca 0.04 -0.29 -0.07 0.00 -1.00 0.00 0.00 59.36 58.05 2bkp h GLU 49 Cb 0.84 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.96 2bkp h GLU 49 CO 0.07 0.97 -0.29 -0.07 -1.00 0.00 0.00 179.01 178.69 2bkp h LEU 50 N 0.93 0.09 -1.60 1.33 3.38 -0.76 -2.22 115.31 116.46 2bkp h LEU 50 Ca 0.18 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.11 2bkp h LEU 50 Cb 0.46 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 2bkp h LEU 50 CO 0.02 0.38 0.07 -0.08 0.09 0.00 0.00 178.44 178.92 2bkp h GLU 51 N 0.08 0.33 -0.03 1.13 4.81 -0.76 0.14 114.58 120.28 2bkp h GLU 51 Ca 0.01 -0.04 -0.22 0.00 -0.13 0.00 0.00 59.36 58.98 2bkp h GLU 51 Cb 0.56 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.88 2bkp h GLU 51 CO 0.04 0.30 -0.89 0.93 -0.73 0.00 0.00 179.01 178.66 2bkp h GLU 52 N 0.33 0.50 -0.41 1.92 5.08 -1.22 -2.57 114.58 118.20 2bkp h GLU 52 Ca 0.08 -0.49 -0.06 0.00 -1.00 0.00 0.00 59.36 57.89 2bkp h GLU 52 Cb 0.11 0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 2bkp h GLU 52 CO -0.01 1.13 -0.00 -0.09 -1.00 0.00 0.00 179.01 179.04 2bkp h ARG 53 N 0.30 0.66 -0.46 2.33 9.65 -1.01 -0.88 114.38 124.98 2bkp h ARG 53 Ca -0.07 -0.16 -0.03 0.00 -1.10 0.00 0.00 59.98 58.61 2bkp h ARG 53 Cb 1.52 -0.09 -0.02 0.00 -1.39 0.00 0.00 29.97 29.99 2bkp h ARG 53 CO 0.16 0.68 0.17 0.82 2.80 0.00 0.00 179.97 184.60 2bkp h ILE 54 N 0.63 1.21 -0.67 1.20 1.08 -0.89 0.20 117.51 120.27 2bkp h ILE 54 Ca 0.13 -0.67 -0.01 0.00 -0.39 0.00 0.00 64.86 63.92 2bkp h ILE 54 Cb 0.40 0.80 -0.03 0.00 -3.07 0.00 0.00 36.82 34.91 2bkp h ILE 54 CO 0.02 0.25 0.40 0.44 -0.69 0.00 0.00 178.15 178.56 2bkp h ASP 55 N 0.60 0.81 -0.12 1.72 3.32 -1.04 0.15 116.42 121.87 2bkp h ASP 55 Ca 0.15 -0.07 -0.01 0.00 0.02 0.00 0.00 57.03 57.13 2bkp h ASP 55 Cb 0.22 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 2bkp h ASP 55 CO -0.01 0.64 0.05 0.25 -1.72 0.00 0.00 179.24 178.45 2bkp h LEU 56 N 0.91 0.16 -0.82 1.55 5.85 -0.83 -0.95 115.31 121.18 2bkp h LEU 56 Ca 0.24 -0.14 0.02 0.00 0.84 0.00 0.00 57.88 58.84 2bkp h LEU 56 Cb -0.02 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 40.93 2bkp h LEU 56 CO -0.04 0.26 0.54 -0.07 -0.34 0.00 0.00 178.44 178.78 2bkp h LEU 57 N 0.04 0.91 -1.07 2.25 3.38 -0.24 -1.56 115.31 119.02 2bkp h LEU 57 Ca 0.04 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 2bkp h LEU 57 Cb 0.15 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.64 2bkp h LEU 57 CO -0.00 0.64 0.47 -1.13 0.09 0.00 0.00 178.44 178.51 2bkp h ASN 58 N 1.07 0.99 -0.15 -0.43 -1.24 -0.46 0.26 115.58 115.62 2bkp h ASN 58 Ca 0.31 -0.07 -0.01 0.00 0.71 0.00 0.00 56.30 57.25 2bkp h ASN 58 Cb -0.06 -0.25 -0.01 0.00 0.73 0.00 0.00 38.32 38.73 2bkp h ASN 58 CO -0.09 0.78 0.06 0.22 -1.29 0.00 0.00 177.43 177.11 2bkp h TYR 59 N 1.13 0.23 -0.75 0.67 3.20 -0.41 -0.57 116.97 120.47 2bkp h TYR 59 Ca 0.29 -0.02 -0.04 0.00 3.14 0.00 0.00 58.73 62.10 2bkp h TYR 59 Cb -0.02 -0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.15 2bkp h TYR 59 CO 0.01 0.31 0.31 1.96 -1.64 0.00 0.00 178.16 179.10 2bkp h GLN 60 N 0.08 1.12 -0.82 1.82 4.20 -0.82 -0.20 115.11 120.48 2bkp h GLN 60 Ca 0.05 -0.20 0.02 0.00 0.06 0.00 0.00 58.65 58.58 2bkp h GLN 60 Cb 0.18 -0.18 -0.04 0.00 0.30 0.00 0.00 27.48 27.73 2bkp h GLN 60 CO -0.00 0.91 0.54 1.25 -0.67 0.00 0.00 178.83 180.86 2bkp h LEU 61 N 1.08 0.91 -0.16 1.46 5.85 -0.26 -0.19 115.31 123.99 2bkp h LEU 61 Ca 0.25 -0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.89 2bkp h LEU 61 Cb 0.20 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.01 2bkp h LEU 61 CO -0.02 0.64 -0.17 0.24 -0.34 0.00 0.00 178.44 178.79 2bkp h MET 62 N 1.06 0.40 0.50 1.25 2.86 -0.21 -0.46 114.93 120.34 2bkp h MET 62 Ca 0.31 -0.21 -0.01 0.00 -2.06 0.00 0.00 59.70 57.73 2bkp h MET 62 Cb -0.04 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.60 2bkp h MET 62 CO -0.08 0.77 -0.52 0.52 1.06 0.00 0.00 176.91 178.67 2bkp h MET 63 N 0.04 -0.98 -0.18 1.72 2.86 -0.62 0.28 114.93 118.05 2bkp h MET 63 Ca 0.03 0.07 0.05 0.00 -2.06 0.00 0.00 59.70 57.79 2bkp h MET 63 Cb 0.70 0.22 -0.06 0.00 0.06 0.00 0.00 31.60 32.52 2bkp h MET 63 CO 0.04 -0.66 -0.27 0.45 1.06 0.00 0.00 176.91 177.53 2bkp h HIS 64 N -1.02 -0.74 -0.33 -0.22 -0.00 -1.08 -2.31 115.15 109.45 2bkp h HIS 64 Ca -0.06 0.04 0.07 0.00 -0.00 0.00 0.00 60.37 60.42 2bkp h HIS 64 Cb 0.89 0.35 -0.08 0.00 -0.00 0.00 0.00 27.41 28.57 2bkp h HIS 64 CO -0.26 -0.35 -0.18 0.77 -0.00 0.00 0.00 177.93 177.91 2bkp h SER 65 N -0.32 -0.59 0.06 2.45 0.02 -0.83 -1.31 113.55 113.03 2bkp h SER 65 Ca 0.11 0.13 0.02 0.00 -0.84 0.00 0.00 61.79 61.22 2bkp h SER 65 Cb 0.49 0.32 -0.03 0.00 0.14 0.00 0.00 62.40 63.32 2bkp h SER 65 CO -0.36 -0.21 -0.21 0.58 -1.14 0.00 0.00 176.83 175.49 2bkp h VAL 66 N -0.13 0.53 -0.40 2.27 2.07 -0.63 -2.37 116.25 117.58 2bkp h VAL 66 Ca 0.17 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.68 2bkp h VAL 66 Cb 0.39 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 2bkp h VAL 66 CO -0.41 0.00 0.20 -0.07 0.02 0.00 0.00 177.57 177.30 2bkp h LEU 67 N -0.36 0.49 -1.20 2.57 3.38 -1.18 -2.88 115.31 116.13 2bkp h LEU 67 Ca 0.04 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 2bkp h LEU 67 Cb 0.41 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 2bkp h LEU 67 CO -0.15 0.42 0.10 0.00 0.09 0.00 0.00 178.44 178.91 2bkp h ALA 68 N 1.66 1.36 -2.40 1.53 0.00 -0.71 -3.42 119.26 117.27 2bkp h ALA 68 Ca 0.14 -0.17 -0.56 0.00 0.00 0.00 0.00 54.91 54.31 2bkp h ALA 68 Cb 0.06 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.61 2bkp h ALA 68 CO -0.02 0.46 0.39 0.00 0.00 0.00 0.00 179.25 180.08 2bkp s ALA 69 N -5.16 3.41 0.00 0.00 0.00 -1.09 -4.89 121.76 114.04 2bkp s ALA 69 Ca -0.09 0.21 0.00 0.00 0.00 0.00 0.00 51.96 52.09 2bkp s ALA 69 Cb 0.16 -3.26 0.00 0.00 0.00 0.00 0.00 23.12 20.02 2bkp s ALA 69 CO 0.77 -0.50 0.00 0.54 0.00 0.00 0.00 175.76 176.58 2bkp n ARG 70 N 4.77 3.36 -4.26 0.00 1.74 -1.26 -4.90 116.66 116.12 2bkp n ARG 70 Ca 0.05 0.00 -0.14 0.00 -0.77 0.00 0.00 57.85 56.99 2bkp n ARG 70 Cb 0.49 -0.57 -0.10 0.00 -1.02 0.00 0.00 32.46 31.26 2bkp n ARG 70 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2bkp s ASN 71 N -0.97 1.15 0.21 0.55 2.20 -1.26 -5.03 114.94 111.78 2bkp s ASN 71 Ca 0.00 -1.23 -0.14 0.00 -0.94 0.00 0.00 52.86 50.55 2bkp s ASN 71 Cb 0.00 0.14 0.23 0.00 -2.00 0.00 0.00 41.25 39.62 2bkp s ASN 71 CO 0.00 -0.62 1.63 0.58 -2.94 0.00 0.00 177.10 175.75 2bkp h VAL 72 N 2.62 0.39 0.05 3.54 2.07 -1.99 -0.39 116.25 122.55 2bkp h VAL 72 Ca -0.37 -0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.15 2bkp h VAL 72 Cb 1.22 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 31.36 2bkp h VAL 72 CO 0.62 0.00 -0.07 0.11 0.02 0.00 0.00 177.57 178.25 2bkp h LYS 73 N 0.01 -0.14 -0.64 1.57 1.57 -2.00 -1.53 116.57 115.41 2bkp h LYS 73 Ca 0.30 0.01 0.04 0.00 -1.87 0.00 0.00 60.65 59.12 2bkp h LYS 73 Cb 0.46 0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.75 2bkp h LYS 73 CO -0.62 -0.09 0.38 0.93 -0.57 0.00 0.00 179.45 179.48 2bkp h GLU 74 N -0.14 0.71 -0.65 3.15 5.08 -1.83 -2.32 114.58 118.57 2bkp h GLU 74 Ca 0.01 -0.04 0.06 0.00 -1.00 0.00 0.00 59.36 58.39 2bkp h GLU 74 Cb 0.15 -0.16 -0.05 0.00 0.50 0.00 0.00 28.75 29.18 2bkp h GLU 74 CO -0.04 0.47 0.36 0.00 -1.00 0.00 0.00 179.01 178.81 2bkp h ALA 75 N 1.29 0.87 -0.81 3.43 0.00 -0.74 0.11 119.26 123.41 2bkp h ALA 75 Ca 0.27 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.17 2bkp h ALA 75 Cb 0.07 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 2bkp h ALA 75 CO -0.13 0.04 0.40 0.93 0.00 0.00 0.00 179.25 180.50 2bkp h GLU 76 N 0.67 1.15 -0.13 0.00 5.08 -0.77 -1.13 114.58 119.45 2bkp h GLU 76 Ca 0.29 -0.15 -0.20 0.00 -1.00 0.00 0.00 59.36 58.30 2bkp h GLU 76 Cb 0.18 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.21 2bkp h GLU 76 CO -0.18 0.87 -0.74 1.96 -1.00 0.00 0.00 179.01 179.92 2bkp h GLN 77 N 1.14 0.61 -0.26 2.33 4.20 -0.91 -2.97 115.11 119.25 2bkp h GLN 77 Ca 0.28 -0.49 -0.03 0.00 0.06 0.00 0.00 58.65 58.47 2bkp h GLN 77 Cb 0.09 0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.95 2bkp h GLN 77 CO -0.04 1.11 0.02 0.28 -0.67 0.00 0.00 178.83 179.53 2bkp h VAL 78 N 0.42 1.15 -0.25 -0.54 2.07 -0.41 -2.09 116.25 116.61 2bkp h VAL 78 Ca -0.04 -0.56 -0.06 0.00 0.82 0.00 0.00 66.70 66.86 2bkp h VAL 78 Cb 1.33 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 32.02 2bkp h VAL 78 CO 0.14 0.19 -0.13 0.40 0.02 0.00 0.00 177.57 178.20 2bkp h ILE 79 N 0.37 1.22 -0.59 4.57 2.04 -1.06 -2.21 117.51 121.84 2bkp h ILE 79 Ca 0.09 -0.95 -0.05 0.00 1.00 0.00 0.00 64.86 64.95 2bkp h ILE 79 Cb 0.22 1.17 -0.03 0.00 -0.74 0.00 0.00 36.82 37.44 2bkp h ILE 79 CO 0.00 0.31 0.16 0.71 0.00 0.00 0.00 178.15 179.33 2bkp h THR 80 N 0.38 1.23 -0.14 -0.27 1.35 -1.29 -0.09 112.91 114.08 2bkp h THR 80 Ca 0.07 -0.83 -0.01 0.00 -0.55 0.00 0.00 66.41 65.09 2bkp h THR 80 Cb 0.46 0.61 -0.01 0.00 -1.73 0.00 0.00 68.15 67.48 2bkp h THR 80 CO 0.03 0.32 0.04 0.40 -0.25 0.00 0.00 175.52 176.06 2bkp h ILE 81 N 0.87 1.18 -0.41 6.82 2.04 -1.36 -2.56 117.51 124.09 2bkp h ILE 81 Ca 0.19 -0.56 -0.02 0.00 1.00 0.00 0.00 64.86 65.47 2bkp h ILE 81 Cb 0.29 1.28 -0.02 0.00 -0.74 0.00 0.00 36.82 37.64 2bkp h ILE 81 CO -0.00 0.17 0.16 -0.07 0.00 0.00 0.00 178.15 178.41 2bkp h LEU 82 N 0.05 0.52 -0.53 1.44 3.38 -0.99 -1.23 115.31 117.96 2bkp h LEU 82 Ca 0.05 -0.05 -0.07 0.00 0.09 0.00 0.00 57.88 57.89 2bkp h LEU 82 Cb 0.22 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 2bkp h LEU 82 CO -0.00 0.48 0.06 1.56 0.09 0.00 0.00 178.44 180.63 2bkp h GLN 83 N 0.58 0.90 -0.30 1.13 4.20 -0.83 -0.68 115.11 120.10 2bkp h GLN 83 Ca 0.14 -0.26 -0.16 0.00 0.06 0.00 0.00 58.65 58.44 2bkp h GLN 83 Cb 0.12 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.80 2bkp h GLN 83 CO -0.01 0.89 -0.44 0.82 -0.67 0.00 0.00 178.83 179.42 2bkp h ILE 84 N 0.78 1.29 -0.18 2.54 2.04 -1.11 -2.20 117.51 120.67 2bkp h ILE 84 Ca 0.16 -1.62 -0.06 0.00 1.00 0.00 0.00 64.86 64.34 2bkp h ILE 84 Cb 0.45 1.52 -0.01 0.00 -0.74 0.00 0.00 36.82 38.04 2bkp h ILE 84 CO 0.02 0.53 -0.14 0.00 0.00 0.00 0.00 178.15 178.55 2bkp h ALA 85 N 0.89 1.44 -0.49 1.87 0.00 -1.04 -0.57 119.26 121.37 2bkp h ALA 85 Ca 0.04 -0.23 -0.11 0.00 0.00 0.00 0.00 54.91 54.62 2bkp h ALA 85 Cb 1.00 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 2bkp h ALA 85 CO 0.10 0.39 -0.13 -0.97 0.00 0.00 0.00 179.25 178.64 2bkp h ASN 86 N 0.27 0.92 -0.44 0.00 -1.24 -0.72 0.74 115.58 115.10 2bkp h ASN 86 Ca 0.05 -0.30 -0.12 0.00 0.71 0.00 0.00 56.30 56.65 2bkp h ASN 86 Cb 0.41 -0.25 -0.02 0.00 0.73 0.00 0.00 38.32 39.20 2bkp h ASN 86 CO 0.02 1.05 -0.16 0.00 -1.29 0.00 0.00 177.43 177.05 2bkp h ALA 87 N 1.03 0.80 -0.48 1.57 0.00 -0.77 -1.99 119.26 119.42 2bkp h ALA 87 Ca 0.13 -0.36 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 2bkp h ALA 87 Cb 0.66 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2bkp h ALA 87 CO 0.05 0.66 0.24 0.82 0.00 0.00 0.00 179.25 181.01 2bkp h ILE 88 N 0.82 1.19 -0.96 0.00 2.04 -0.82 -2.09 117.51 117.69 2bkp h ILE 88 Ca 0.12 -0.52 0.09 0.00 1.00 0.00 0.00 64.86 65.54 2bkp h ILE 88 Cb 0.71 0.64 -0.07 0.00 -0.74 0.00 0.00 36.82 37.36 2bkp h ILE 88 CO 0.05 0.21 0.62 -0.33 0.00 0.00 0.00 178.15 178.70 2bkp h GLU 89 N 0.64 1.01 -0.25 2.37 4.39 -0.51 0.10 114.58 122.33 2bkp h GLU 89 Ca 0.17 -0.06 -0.09 0.00 0.34 0.00 0.00 59.36 59.72 2bkp h GLU 89 Cb 0.11 -0.23 -0.01 0.00 -0.10 0.00 0.00 28.75 28.52 2bkp h GLU 89 CO -0.02 0.67 -0.22 -0.44 -1.16 0.00 0.00 179.01 177.84 2bkp h ASP 90 N 1.04 0.45 0.31 1.42 3.32 -0.86 -1.42 116.42 120.68 2bkp h ASP 90 Ca 0.43 -0.14 -0.20 0.00 0.02 0.00 0.00 57.03 57.14 2bkp h ASP 90 Cb 0.30 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 39.73 2bkp h ASP 90 CO -0.19 0.68 -0.83 0.40 -1.72 0.00 0.00 179.24 177.58 2bkp h ILE 91 N 0.41 1.39 0.44 0.35 2.04 -0.52 -2.24 117.51 119.38 2bkp h ILE 91 Ca 0.07 -2.30 -0.02 0.00 1.00 0.00 0.00 64.86 63.61 2bkp h ILE 91 Cb 0.61 2.26 0.00 0.00 -0.74 0.00 0.00 36.82 38.95 2bkp h ILE 91 CO 0.04 0.69 -0.23 -1.28 0.00 0.00 0.00 178.15 177.37 2bkp h SER 92 N 0.25 -0.56 -0.38 1.72 0.87 -0.53 -1.68 113.55 113.24 2bkp h SER 92 Ca -0.05 0.03 -0.01 0.00 -1.23 0.00 0.00 61.79 60.52 2bkp h SER 92 Cb 1.43 0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 63.53 2bkp h SER 92 CO 0.14 -0.38 0.20 0.78 -0.53 0.00 0.00 176.83 177.04 2bkp h ASN 93 N -0.62 0.51 -0.52 6.23 2.35 -1.28 -0.90 115.58 121.34 2bkp h ASN 93 Ca -0.06 -0.04 -0.03 0.00 -0.55 0.00 0.00 56.30 55.63 2bkp h ASN 93 Cb 0.49 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.71 2bkp h ASN 93 CO 0.08 0.44 0.22 0.00 -1.65 0.00 0.00 177.43 176.52 2bkp h ALA 94 N 1.64 0.68 -0.84 -0.83 0.00 -1.11 0.18 119.26 118.98 2bkp h ALA 94 Ca 0.15 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2bkp h ALA 94 Cb 0.06 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.61 2bkp h ALA 94 CO -0.02 0.27 0.42 0.00 0.00 0.00 0.00 179.25 179.93 2bkp h ALA 95 N 1.07 1.07 -0.71 0.00 0.00 -0.53 -1.42 119.26 118.75 2bkp h ALA 95 Ca 0.18 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2bkp h ALA 95 Cb 0.17 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 2bkp h ALA 95 CO -0.02 0.62 0.35 0.78 0.00 0.00 0.00 179.25 180.99 2bkp h GLY 96 N 1.18 1.08 1.09 0.00 0.00 -0.65 -1.78 103.07 104.00 2bkp h GLY 96 Ca 0.29 -0.51 -0.03 0.00 0.00 0.00 0.00 47.33 47.08 2bkp h GLY 96 CO -0.04 0.48 0.36 -0.55 0.00 0.00 0.00 176.54 176.80 2bkp h ASP 97 N 1.00 1.06 -0.42 0.19 3.32 0.08 -0.56 116.42 121.09 2bkp h ASP 97 Ca 0.25 -0.14 -0.04 0.00 0.02 0.00 0.00 57.03 57.12 2bkp h ASP 97 Cb 0.08 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.34 2bkp h ASP 97 CO -0.03 0.91 0.11 -0.07 -1.72 0.00 0.00 179.24 178.44 2bkp h LEU 98 N 1.15 0.63 -0.93 1.55 3.38 -0.81 -2.97 115.31 117.30 2bkp h LEU 98 Ca 0.27 -0.22 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 2bkp h LEU 98 Cb 0.15 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 2bkp h LEU 98 CO -0.03 0.69 0.14 0.00 0.09 0.00 0.00 178.44 179.33 2bkp h ALA 99 N 0.96 1.13 -0.80 1.53 0.00 -1.00 -2.74 119.26 118.34 2bkp h ALA 99 Ca 0.13 -0.22 0.09 0.00 0.00 0.00 0.00 54.91 54.91 2bkp h ALA 99 Cb 0.30 -0.24 -0.07 0.00 0.00 0.00 0.00 17.79 17.78 2bkp h ALA 99 CO -0.00 0.59 0.45 0.87 0.00 0.00 0.00 179.25 181.16 2bkp h LYS 100 N 0.89 0.75 -0.95 0.00 1.57 -0.95 -1.59 116.57 116.28 2bkp h LYS 100 Ca 0.19 -0.05 0.13 0.00 -1.87 0.00 0.00 60.65 59.06 2bkp h LYS 100 Cb 0.32 -0.17 -0.09 0.00 0.08 0.00 0.00 32.23 32.38 2bkp h LYS 100 CO 0.00 0.50 0.57 0.52 -0.57 0.00 0.00 179.45 180.47 2bkp h MET 101 N 0.77 0.84 -0.18 3.15 2.86 -1.40 0.09 114.93 121.07 2bkp h MET 101 Ca 0.38 -0.05 -0.20 0.00 -2.06 0.00 0.00 59.70 57.77 2bkp h MET 101 Cb 0.34 -0.19 0.00 0.00 0.06 0.00 0.00 31.60 31.82 2bkp h MET 101 CO -0.24 0.56 -0.69 0.28 1.06 0.00 0.00 176.91 177.88 2bkp h VAL 102 N 0.87 1.29 0.00 -2.22 2.07 -1.41 -3.01 116.25 113.84 2bkp h VAL 102 Ca 0.49 -1.91 -0.03 0.00 0.82 0.00 0.00 66.70 66.06 2bkp h VAL 102 Cb 0.56 1.88 -0.00 0.00 -1.52 0.00 0.00 31.29 32.21 2bkp h VAL 102 CO -0.30 0.61 -0.15 -0.07 0.02 0.00 0.00 177.57 177.68 2bkp h LEU 103 N 0.53 0.00 -0.35 2.57 3.38 -0.31 -1.85 115.31 119.28 2bkp h LEU 103 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2bkp h LEU 103 Cb 1.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.05 2bkp h LEU 103 CO 0.14 0.15 -0.06 -0.62 0.09 0.00 0.00 178.44 178.14 2bkp n GLU 104 N -3.43 0.99 -0.99 1.13 1.02 -0.09 -4.90 120.64 114.37 2bkp n GLU 104 Ca -0.01 -0.35 0.00 0.00 -0.02 0.00 0.00 57.16 56.79 2bkp n GLU 104 Cb 0.33 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.25 2bkp n GLU 104 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2bkp n GLY 105 N 1.19 0.25 3.46 0.62 0.00 -0.69 -4.95 105.19 105.05 2bkp n GLY 105 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2bkp n GLY 105 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2bkp n VAL 106 N -2.45 1.77 -3.00 1.61 0.31 -1.16 -4.88 118.33 110.53 2bkp n VAL 106 Ca 0.00 -0.50 -0.42 0.00 -0.01 0.00 0.00 64.34 63.41 2bkp n VAL 106 Cb 0.25 -0.53 -0.06 0.00 -0.91 0.00 0.00 33.84 32.60 2bkp n VAL 106 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 2bkp s GLU 107 N -1.52 3.71 0.27 5.55 2.12 -1.26 -4.93 118.70 122.65 2bkp s GLU 107 Ca 0.63 0.21 -0.29 0.00 0.36 0.00 0.00 54.97 55.88 2bkp s GLU 107 Cb -0.64 -3.82 -0.09 0.00 0.26 0.00 0.00 34.13 29.84 2bkp s GLU 107 CO 0.58 -0.83 1.01 -0.51 -0.54 0.00 0.00 175.26 174.96 2bkp s LEU 108 N 3.00 4.56 0.38 2.70 1.43 -1.26 -5.01 118.68 124.47 2bkp s LEU 108 Ca 0.29 2.06 -0.27 0.00 -1.03 0.00 0.00 54.13 55.18 2bkp s LEU 108 Cb -0.13 -3.69 -0.10 0.00 0.03 0.00 0.00 46.19 42.30 2bkp s LEU 108 CO 0.17 -0.01 1.39 -2.28 0.23 0.00 0.00 176.35 175.84 2bkp s HIS 109 N -1.24 2.75 0.53 0.29 5.65 -1.26 -4.87 115.29 117.13 2bkp s HIS 109 Ca 0.44 1.31 0.22 0.00 0.25 0.00 0.00 55.06 57.28 2bkp s HIS 109 Cb -0.27 -3.83 1.35 0.00 -1.18 0.00 0.00 32.58 28.65 2bkp s HIS 109 CO 0.34 -2.46 2.05 -1.35 -0.65 0.00 0.00 174.74 172.68 2bkp h PRO 110 N 2.93 0.00 0.00 2.88 0.11 -2.03 -1.85 132.00 134.04 2bkp h PRO 110 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2bkp h PRO 110 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2bkp h PRO 110 CO 0.64 0.00 0.00 -0.39 -0.21 0.00 0.00 178.00 178.04 2bkp h VAL 111 N 0.00 0.00 0.25 3.15 -1.51 -1.99 -3.00 116.25 113.14 2bkp h VAL 111 Ca 0.16 -0.17 -0.01 0.00 -1.23 0.00 0.00 66.70 65.45 2bkp h VAL 111 Cb 0.64 1.16 0.00 0.00 -2.13 0.00 0.00 31.29 30.96 2bkp h VAL 111 CO -0.00 0.00 -0.12 0.40 -1.23 0.00 0.00 177.57 176.62 2bkp h ILE 112 N 0.00 0.81 -0.70 7.19 2.04 -1.70 -0.41 117.51 124.75 2bkp h ILE 112 Ca 0.00 -0.47 -0.07 0.00 1.00 0.00 0.00 64.86 65.32 2bkp h ILE 112 Cb 0.17 1.08 -0.03 0.00 -0.74 0.00 0.00 36.82 37.30 2bkp h ILE 112 CO 0.00 0.10 0.16 0.11 0.00 0.00 0.00 178.15 178.52 2bkp h LYS 113 N -0.57 1.12 -0.82 2.37 1.57 -1.72 -2.31 116.57 116.20 2bkp h LYS 113 Ca -0.03 -0.28 0.01 0.00 -1.87 0.00 0.00 60.65 58.49 2bkp h LYS 113 Cb 0.42 -0.14 -0.04 0.00 0.08 0.00 0.00 32.23 32.54 2bkp h LYS 113 CO 0.06 1.00 0.54 0.93 -0.57 0.00 0.00 179.45 181.40 2bkp h GLU 114 N 1.05 1.06 -0.59 3.15 5.08 -1.47 -1.37 114.58 121.48 2bkp h GLU 114 Ca 0.22 -0.06 -0.04 0.00 -1.00 0.00 0.00 59.36 58.48 2bkp h GLU 114 Cb 0.39 -0.24 -0.03 0.00 0.50 0.00 0.00 28.75 29.37 2bkp h GLU 114 CO 0.00 0.70 0.21 1.15 -1.00 0.00 0.00 179.01 180.07 2bkp h THR 115 N 1.09 1.22 0.00 1.13 2.02 -0.70 0.16 112.91 117.83 2bkp h THR 115 Ca 0.31 -0.71 -0.09 0.00 0.77 0.00 0.00 66.41 66.68 2bkp h THR 115 Cb -0.09 0.54 -0.01 0.00 -1.74 0.00 0.00 68.15 66.85 2bkp h THR 115 CO -0.08 0.28 -0.44 0.40 0.37 0.00 0.00 175.52 176.05 2bkp h ILE 116 N 0.85 1.02 0.00 3.11 2.04 -0.82 -2.16 117.51 121.55 2bkp h ILE 116 Ca 0.20 -1.70 0.00 0.00 1.00 0.00 0.00 64.86 64.36 2bkp h ILE 116 Cb 0.20 2.00 0.00 0.00 -0.74 0.00 0.00 36.82 38.29 2bkp h ILE 116 CO -0.01 0.43 -0.89 0.18 0.00 0.00 0.00 178.15 177.86 2bkp n LEU 117 N -3.59 0.64 -0.21 1.44 4.77 -0.59 -3.45 117.00 116.01 2bkp n LEU 117 Ca -0.00 0.07 0.02 0.00 -0.03 0.00 0.00 56.01 56.07 2bkp n LEU 117 Cb 0.54 -0.13 0.04 0.00 -2.33 0.00 0.00 43.42 41.54 2bkp n LEU 117 CO 0.38 0.01 0.42 -0.62 -1.33 0.00 0.00 177.39 176.24 2bkp n GLU 118 N -2.02 0.99 -1.02 3.23 1.02 0.50 -4.89 120.64 118.44 2bkp n GLU 118 Ca 0.02 -1.16 -0.22 0.00 -0.02 0.00 0.00 57.16 55.78 2bkp n GLU 118 Cb 0.44 -1.10 0.18 0.00 -0.02 0.00 0.00 31.44 30.94 2bkp n GLU 118 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2bkp n GLY 119 N 0.12 -2.23 0.35 0.62 0.00 -0.83 -4.92 105.19 98.30 2bkp n GLY 119 Ca 0.04 -1.56 -0.04 0.00 0.00 0.00 0.00 46.02 44.45 2bkp n GLY 119 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2bkp h GLU 120 N 0.00 1.24 -5.08 1.61 5.08 -1.96 -3.40 114.58 112.07 2bkp h GLU 120 Ca -0.32 -0.14 -0.66 0.00 -1.00 0.00 0.00 59.36 57.24 2bkp h GLU 120 Cb 0.93 -0.25 -0.31 0.00 0.50 0.00 0.00 28.75 29.62 2bkp h GLU 120 CO 0.21 0.89 -0.80 -2.00 -1.00 0.00 0.00 179.01 176.32 2bkp s GLU 121 N -5.87 3.18 0.44 2.33 2.56 -1.26 -4.38 118.70 115.70 2bkp s GLU 121 Ca -0.13 -0.74 0.06 0.00 0.00 0.00 0.00 54.97 54.16 2bkp s GLU 121 Cb 0.17 -2.73 -0.05 0.00 2.00 0.00 0.00 34.13 33.52 2bkp s GLU 121 CO 0.82 -0.14 0.09 0.96 -0.56 0.00 0.00 175.26 176.44 2bkp s ILE 122 N 1.21 1.93 -0.13 -3.70 -4.36 0.13 -4.90 121.20 111.38 2bkp s ILE 122 Ca 0.02 -1.86 -0.02 0.00 -0.26 0.00 0.00 60.65 58.53 2bkp s ILE 122 Cb -0.14 -2.79 -0.03 0.00 1.25 0.00 0.00 42.46 40.75 2bkp s ILE 122 CO -0.06 0.00 -0.05 -0.63 0.24 0.00 0.00 174.94 174.44 2bkp s ILE 123 N -2.71 3.76 0.06 8.37 -1.09 -1.22 -1.82 121.20 126.55 2bkp s ILE 123 Ca 0.32 -0.42 0.04 0.00 -2.23 0.00 0.00 60.65 58.35 2bkp s ILE 123 Cb 0.06 -2.61 -0.03 0.00 -1.58 0.00 0.00 42.46 38.30 2bkp s ILE 123 CO 0.17 0.53 -0.11 -0.83 -1.23 0.00 0.00 174.94 173.47 2bkp s GLY 124 N 0.03 0.68 -0.25 6.18 0.00 0.87 -4.82 107.32 110.00 2bkp s GLY 124 Ca -0.00 -0.89 -0.08 0.00 0.00 0.00 0.00 44.72 43.75 2bkp s GLY 124 CO 0.03 -0.93 0.09 1.25 0.00 0.00 0.00 173.10 173.54 2bkp s LYS 125 N -1.71 3.73 -0.24 2.90 2.20 -1.26 -0.76 119.74 124.60 2bkp s LYS 125 Ca -0.06 -0.44 0.02 0.00 -0.36 0.00 0.00 55.97 55.13 2bkp s LYS 125 Cb -0.10 -3.39 0.04 0.00 -1.51 0.00 0.00 37.83 32.88 2bkp s LYS 125 CO 0.01 -0.17 -0.12 0.42 -0.36 0.00 0.00 175.35 175.13 2bkp s ILE 126 N 1.59 2.26 -0.10 5.43 1.09 0.11 -4.96 121.20 126.63 2bkp s ILE 126 Ca 0.06 -1.37 -0.30 0.00 -1.10 0.00 0.00 60.65 57.95 2bkp s ILE 126 Cb -0.15 -2.21 -0.02 0.00 -1.06 0.00 0.00 42.46 39.03 2bkp s ILE 126 CO 0.05 0.15 1.07 -1.10 -0.10 0.00 0.00 174.94 175.01 2bkp s GLN 127 N 1.18 4.39 -0.27 2.79 -1.52 -1.26 -0.80 119.66 124.17 2bkp s GLN 127 Ca -0.04 1.48 -0.15 0.00 -1.95 0.00 0.00 55.36 54.70 2bkp s GLN 127 Cb -0.18 -3.55 -0.04 0.00 -0.22 0.00 0.00 33.01 29.02 2bkp s GLN 127 CO -0.07 -0.37 0.37 0.08 -0.25 0.00 0.00 175.29 175.04 2bkp s VAL 128 N 2.15 5.18 0.29 1.09 1.01 -0.58 -4.41 120.40 125.12 2bkp s VAL 128 Ca 0.50 0.56 -0.06 0.00 0.00 0.00 0.00 61.98 62.98 2bkp s VAL 128 Cb -0.20 -3.69 -0.06 0.00 0.00 0.00 0.00 36.38 32.43 2bkp s VAL 128 CO 0.19 0.17 0.57 -0.31 0.00 0.00 0.00 175.10 175.71 2bkp s TYR 129 N 2.02 3.47 0.35 5.22 1.51 -0.54 -0.19 117.35 129.18 2bkp s TYR 129 Ca 0.15 0.72 0.12 0.00 -1.01 0.00 0.00 57.07 57.05 2bkp s TYR 129 Cb -0.16 -2.16 0.96 0.00 -0.11 0.00 0.00 41.96 40.49 2bkp s TYR 129 CO 0.10 0.17 1.74 -1.35 -1.11 0.00 0.00 175.55 175.10 2bkp h PRO 130 N 1.82 0.51 -0.07 -1.71 0.11 -1.92 -1.50 132.00 129.24 2bkp h PRO 130 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2bkp h PRO 130 Cb 1.19 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.18 2bkp h PRO 130 CO 0.67 0.34 0.00 -0.85 -0.21 0.00 0.00 178.00 177.94 2bkp n GLU 131 N -4.79 1.34 -2.52 1.05 0.00 -1.26 -4.91 120.64 109.55 2bkp n GLU 131 Ca 0.26 -0.51 -0.39 0.00 0.00 0.00 0.00 57.16 56.52 2bkp n GLU 131 Cb 0.79 -1.36 -0.04 0.00 0.00 0.00 0.00 31.44 30.82 2bkp n GLU 131 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 2bkp s SER 132 N -1.64 7.16 0.03 -1.84 0.15 -0.57 -4.68 113.70 112.31 2bkp s SER 132 Ca 0.32 2.18 0.13 0.00 0.70 0.00 0.00 55.95 59.28 2bkp s SER 132 Cb 0.16 -2.61 0.56 0.00 -1.71 0.00 0.00 66.02 62.42 2bkp s SER 132 CO 0.25 -0.22 1.41 1.33 1.20 0.00 0.00 173.24 177.22 2bkp n VAL 133 N 0.86 1.15 0.73 4.45 0.24 -1.26 -2.25 118.33 122.25 2bkp n VAL 133 Ca 0.01 0.30 0.12 0.00 -2.04 0.00 0.00 64.34 62.73 2bkp n VAL 133 Cb 0.46 -1.11 0.23 0.00 -1.47 0.00 0.00 33.84 31.95 2bkp n VAL 133 CO 0.00 0.00 0.00 2.30 -2.14 0.00 0.00 176.83 176.99 2bkp n ILE 134 N -1.58 0.23 -1.74 1.34 -5.35 -1.26 -4.82 119.36 106.19 2bkp n ILE 134 Ca 0.03 -0.18 -0.42 0.00 -0.27 0.00 0.00 62.75 61.91 2bkp n ILE 134 Cb 0.14 -0.06 -0.03 0.00 -1.74 0.00 0.00 39.64 37.96 2bkp n ILE 134 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 2bkp s VAL 135 N -3.10 2.55 0.00 7.28 1.01 -0.95 -1.63 120.40 125.55 2bkp s VAL 135 Ca 0.08 0.09 0.00 0.00 0.00 0.00 0.00 61.98 62.15 2bkp s VAL 135 Cb 0.15 -3.06 0.00 0.00 0.00 0.00 0.00 36.38 33.47 2bkp s VAL 135 CO 0.70 0.00 0.00 0.61 0.00 0.00 0.00 175.10 176.41 2bkp n GLY 136 N 4.20 0.70 3.69 4.51 0.00 0.11 -5.00 105.19 113.40 2bkp n GLY 136 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 2bkp n GLY 136 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bkp s LYS 137 N -0.61 2.63 0.57 1.61 1.02 -0.65 -4.84 119.74 119.47 2bkp s LYS 137 Ca 0.00 -0.78 -0.06 0.00 0.02 0.00 0.00 55.97 55.15 2bkp s LYS 137 Cb 0.00 -2.58 -0.01 0.00 -0.52 0.00 0.00 37.83 34.72 2bkp s LYS 137 CO 0.00 0.56 0.89 0.95 -0.92 0.00 0.00 175.35 176.83 2bkp s THR 138 N -1.27 4.06 0.24 2.17 -4.23 -1.26 -1.20 115.64 114.16 2bkp s THR 138 Ca 0.25 0.16 -0.01 0.00 -1.18 0.00 0.00 61.69 60.91 2bkp s THR 138 Cb -0.12 -3.60 0.03 0.00 1.34 0.00 0.00 72.50 70.16 2bkp s THR 138 CO 0.17 -0.63 1.65 -0.07 -0.54 0.00 0.00 174.62 175.20 2bkp h LEU 139 N -0.12 0.61 -0.53 4.79 3.38 -0.85 -1.71 115.31 120.89 2bkp h LEU 139 Ca -0.46 -0.23 0.10 0.00 0.09 0.00 0.00 57.88 57.38 2bkp h LEU 139 Cb 1.24 -0.17 -0.08 0.00 0.09 0.00 0.00 40.66 41.74 2bkp h LEU 139 CO 0.61 0.87 0.09 1.23 0.09 0.00 0.00 178.44 181.33 2bkp h GLY 140 N 1.02 0.64 2.00 0.83 0.00 0.10 -2.34 103.07 105.31 2bkp h GLY 140 Ca 0.06 -0.01 -0.13 0.00 0.00 0.00 0.00 47.33 47.26 2bkp h GLY 140 CO 0.06 -0.10 -0.60 0.83 0.00 0.00 0.00 176.54 176.74 2bkp h GLU 141 N 0.22 0.00 0.16 4.80 5.08 -1.68 -3.39 114.58 119.78 2bkp h GLU 141 Ca 0.27 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.62 2bkp h GLU 141 Cb 0.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.64 2bkp h GLU 141 CO -0.37 0.60 -0.08 -0.07 -1.00 0.00 0.00 179.01 178.09 2bkp h LEU 142 N 0.00 -0.19 -2.37 1.33 3.38 -0.75 -3.49 115.31 113.22 2bkp h LEU 142 Ca -0.01 -0.29 -0.27 0.00 0.09 0.00 0.00 57.88 57.41 2bkp h LEU 142 Cb 1.21 0.05 0.19 0.00 0.09 0.00 0.00 40.66 42.20 2bkp h LEU 142 CO 0.08 0.38 -0.85 -0.67 0.09 0.00 0.00 178.44 177.47 2bkp n ASP 143 N -4.91 -6.03 0.26 -0.43 -0.08 -1.17 -4.87 116.55 99.32 2bkp n ASP 143 Ca -0.06 -0.71 0.12 0.00 -1.51 0.00 0.00 54.79 52.62 2bkp n ASP 143 Cb 0.23 -5.15 0.71 0.00 2.34 0.00 0.00 41.12 39.25 2bkp n ASP 143 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 2bkp h LEU 144 N -1.21 0.00 0.77 -2.67 3.38 -1.87 -2.63 115.31 111.08 2bkp h LEU 144 Ca -0.61 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.33 2bkp h LEU 144 Cb 1.32 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.06 2bkp h LEU 144 CO 0.45 0.11 -0.47 0.00 0.09 0.00 0.00 178.44 178.62 2bkp h ALA 145 N 1.89 -1.21 -0.17 1.53 0.00 -1.81 0.34 119.26 119.84 2bkp h ALA 145 Ca -0.00 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 2bkp h ALA 145 Cb 0.28 0.57 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 2bkp h ALA 145 CO 0.01 -1.19 0.05 1.15 0.00 0.00 0.00 179.25 179.27 2bkp h THR 146 N -1.16 1.20 0.00 0.00 2.02 -1.86 0.17 112.91 113.27 2bkp h THR 146 Ca -0.10 -0.61 -0.14 0.00 0.77 0.00 0.00 66.41 66.32 2bkp h THR 146 Cb 0.93 1.28 -0.02 0.00 -1.74 0.00 0.00 68.15 68.60 2bkp h THR 146 CO 0.11 0.19 -0.67 0.78 0.37 0.00 0.00 175.52 176.30 2bkp h ASN 147 N 0.09 0.00 0.00 4.18 2.35 -1.50 -3.39 115.58 117.32 2bkp h ASN 147 Ca 0.05 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.80 2bkp h ASN 147 Cb 0.25 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.62 2bkp h ASN 147 CO -0.00 0.67 -0.44 0.35 -1.65 0.00 0.00 177.43 176.36 2bkp n THR 148 N -3.34 0.00 -1.08 2.81 -2.24 0.95 -4.80 114.28 106.58 2bkp n THR 148 Ca 0.01 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 2bkp n THR 148 Cb 0.77 0.50 0.00 0.00 -2.10 0.00 0.00 70.33 69.50 2bkp n THR 148 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bkp n GLY 149 N 1.26 1.13 2.97 3.38 0.00 0.60 -4.45 105.19 110.08 2bkp n GLY 149 Ca 0.00 -0.44 -0.17 0.00 0.00 0.00 0.00 46.02 45.40 2bkp n GLY 149 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bkp s VAL 150 N -2.08 0.53 -0.28 1.61 1.01 -1.07 -4.17 120.40 115.94 2bkp s VAL 150 Ca 0.00 -0.26 -0.10 0.00 0.00 0.00 0.00 61.98 61.62 2bkp s VAL 150 Cb 0.00 -0.47 -0.03 0.00 0.00 0.00 0.00 36.38 35.88 2bkp s VAL 150 CO 0.00 0.16 0.15 0.26 0.00 0.00 0.00 175.10 175.68 2bkp s TRP 151 N 0.02 3.17 -0.44 5.22 0.52 0.38 -2.28 118.94 125.54 2bkp s TRP 151 Ca 0.00 -0.19 -0.26 0.00 0.02 0.00 0.00 56.10 55.67 2bkp s TRP 151 Cb -0.05 -2.34 0.02 0.00 -1.15 0.00 0.00 33.47 29.96 2bkp s TRP 151 CO -0.00 -0.29 0.97 0.42 0.02 0.00 0.00 176.95 178.07 2bkp s ILE 152 N 1.69 4.44 -0.75 2.03 -1.09 -1.26 -0.64 121.20 125.62 2bkp s ILE 152 Ca 0.06 0.96 0.23 0.00 -2.23 0.00 0.00 60.65 59.67 2bkp s ILE 152 Cb -0.16 -4.45 -0.15 0.00 -1.58 0.00 0.00 42.46 36.12 2bkp s ILE 152 CO 0.08 -0.80 1.00 2.30 -1.23 0.00 0.00 174.94 176.29 2bkp n ILE 153 N 6.40 0.08 -3.58 2.92 -5.35 -0.35 -4.67 119.36 114.81 2bkp n ILE 153 Ca 0.08 -0.15 -0.05 0.00 -0.27 0.00 0.00 62.75 62.36 2bkp n ILE 153 Cb 0.48 0.45 -0.02 0.00 -1.74 0.00 0.00 39.64 38.81 2bkp n ILE 153 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2bkp s ALA 154 N -3.13 -2.00 -0.03 -1.28 0.00 -1.20 -1.16 121.76 112.96 2bkp s ALA 154 Ca 0.05 1.33 0.01 0.00 0.00 0.00 0.00 51.96 53.35 2bkp s ALA 154 Cb 0.15 0.08 0.02 0.00 0.00 0.00 0.00 23.12 23.38 2bkp s ALA 154 CO 0.82 -0.67 -0.02 0.08 0.00 0.00 0.00 175.76 175.97 2bkp s VAL 155 N -2.63 0.30 -0.32 0.00 1.01 -0.43 -0.24 120.40 118.10 2bkp s VAL 155 Ca 0.09 -0.01 -0.12 0.00 0.00 0.00 0.00 61.98 61.94 2bkp s VAL 155 Cb -0.01 -0.36 -0.02 0.00 0.00 0.00 0.00 36.38 36.00 2bkp s VAL 155 CO -0.06 0.16 0.20 -0.60 0.00 0.00 0.00 175.10 174.81 2bkp s ARG 156 N 0.84 3.57 -0.52 2.72 6.06 0.76 -1.07 118.95 131.30 2bkp s ARG 156 Ca -0.09 -0.58 0.04 0.00 -2.50 0.00 0.00 55.73 52.59 2bkp s ARG 156 Cb -0.12 -3.70 0.13 0.00 0.06 0.00 0.00 34.95 31.31 2bkp s ARG 156 CO -0.01 -0.37 0.27 0.50 -2.50 0.00 0.00 175.30 173.19 2bkp s ARG 157 N 1.70 2.00 6.49 5.12 3.52 0.26 -1.04 118.95 137.01 2bkp s ARG 157 Ca 0.06 -2.62 0.00 0.00 -0.13 0.00 0.00 55.73 53.04 2bkp s ARG 157 Cb -0.17 -3.34 0.00 0.00 -1.56 0.00 0.00 34.95 29.88 2bkp s ARG 157 CO 0.09 -1.11 0.00 0.41 -0.81 0.00 0.00 175.30 173.88 2bkp n GLY 158 N 3.12 1.85 0.87 8.12 0.00 -1.26 -2.39 105.19 115.49 2bkp n GLY 158 Ca 0.05 -0.24 0.08 0.00 0.00 0.00 0.00 46.02 45.92 2bkp n GLY 158 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2bkp n LYS 159 N 2.98 2.43 -4.41 1.61 5.02 -1.26 -4.98 118.16 119.54 2bkp n LYS 159 Ca 0.00 -2.10 -0.29 0.00 -2.02 0.00 0.00 58.31 53.90 2bkp n LYS 159 Cb 0.00 -1.37 -0.13 0.00 -0.02 0.00 0.00 35.03 33.51 2bkp n LYS 159 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2bkp s ARG 160 N -1.09 1.56 -0.06 1.97 0.52 -1.01 -5.13 118.95 115.71 2bkp s ARG 160 Ca 0.30 -1.27 0.01 0.00 -0.52 0.00 0.00 55.73 54.25 2bkp s ARG 160 Cb 0.17 -1.98 -0.03 0.00 0.52 0.00 0.00 34.95 33.63 2bkp s ARG 160 CO 0.22 0.47 -0.07 -1.58 0.02 0.00 0.00 175.30 174.36 2bkp s TRP 161 N -1.06 2.92 -0.22 -0.53 0.52 -1.26 -0.57 118.94 118.74 2bkp s TRP 161 Ca 0.15 0.01 0.02 0.00 0.02 0.00 0.00 56.10 56.30 2bkp s TRP 161 Cb -0.10 -1.70 0.05 0.00 -1.15 0.00 0.00 33.47 30.56 2bkp s TRP 161 CO 0.07 0.33 -0.12 0.42 0.02 0.00 0.00 176.95 177.67 2bkp s ILE 162 N -0.82 1.87 -0.06 2.03 1.09 -0.23 -4.99 121.20 120.09 2bkp s ILE 162 Ca 0.13 -1.21 -0.05 0.00 -1.10 0.00 0.00 60.65 58.42 2bkp s ILE 162 Cb -0.11 -1.92 -0.04 0.00 -1.06 0.00 0.00 42.46 39.33 2bkp s ILE 162 CO 0.02 0.15 0.16 -0.36 -0.10 0.00 0.00 174.94 174.81 2bkp s PHE 163 N 1.29 3.57 -1.16 3.97 0.40 -1.26 -1.31 117.98 123.47 2bkp s PHE 163 Ca -0.03 0.43 -0.26 0.00 -0.60 0.00 0.00 56.93 56.47 2bkp s PHE 163 Cb -0.17 -1.88 0.01 0.00 0.51 0.00 0.00 43.02 41.50 2bkp s PHE 163 CO -0.08 0.69 0.75 0.41 0.70 0.00 0.00 175.22 177.69 2bkp n GLY 164 N 1.40 -0.94 3.77 4.36 0.00 -0.31 -4.89 105.19 108.57 2bkp n GLY 164 Ca -0.15 0.41 -0.39 0.00 0.00 0.00 0.00 46.02 45.89 2bkp n GLY 164 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2bkp s PRO 165 N -6.52 4.08 0.80 1.61 0.04 -1.26 -5.04 135.00 128.71 2bkp s PRO 165 Ca 0.47 2.05 -0.13 0.00 0.04 0.00 0.00 61.00 63.43 2bkp s PRO 165 Cb -0.21 -2.80 0.20 0.00 0.04 0.00 0.00 34.50 31.74 2bkp s PRO 165 CO 0.91 -0.37 0.69 0.09 0.04 0.00 0.00 177.00 178.36 2bkp n ASN 166 N 0.25 -1.83 -0.01 6.66 3.02 -1.26 -4.90 115.26 117.19 2bkp n ASN 166 Ca 0.03 -0.90 0.14 0.00 -0.03 0.00 0.00 54.58 53.82 2bkp n ASN 166 Cb 0.44 -0.65 0.62 0.00 -0.61 0.00 0.00 39.78 39.59 2bkp n ASN 166 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2bkp n GLU 167 N -3.71 0.13 0.00 3.52 1.02 -1.26 -2.83 120.64 117.52 2bkp n GLU 167 Ca 0.10 -0.01 0.12 0.00 -0.02 0.00 0.00 57.16 57.34 2bkp n GLU 167 Cb 0.38 -1.50 0.15 0.00 -0.02 0.00 0.00 31.44 30.45 2bkp n GLU 167 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2bkp n ASN 168 N -1.42 1.03 -4.69 1.62 5.03 -1.26 0.14 115.26 115.71 2bkp n ASN 168 Ca 0.09 -0.82 -0.42 0.00 0.87 0.00 0.00 54.58 54.29 2bkp n ASN 168 Cb 0.31 0.43 -0.03 0.00 -1.02 0.00 0.00 39.78 39.48 2bkp n ASN 168 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.26 175.55 2bkp s PHE 169 N -2.77 2.84 -0.22 3.10 5.36 -1.13 -4.82 117.98 120.33 2bkp s PHE 169 Ca 0.15 0.82 -0.09 0.00 -0.96 0.00 0.00 56.93 56.85 2bkp s PHE 169 Cb 0.18 -3.66 -0.04 0.00 -0.34 0.00 0.00 43.02 39.16 2bkp s PHE 169 CO 0.67 -2.43 0.11 0.21 -1.46 0.00 0.00 175.22 172.32 2bkp s LYS 170 N 2.47 3.95 0.30 10.12 2.20 -1.26 -0.58 119.74 136.94 2bkp s LYS 170 Ca 0.64 -0.34 -0.29 0.00 -0.36 0.00 0.00 55.97 55.62 2bkp s LYS 170 Cb -0.31 -3.40 -0.09 0.00 -1.51 0.00 0.00 37.83 32.52 2bkp s LYS 170 CO 0.26 0.07 1.09 0.42 -0.36 0.00 0.00 175.35 176.83 2bkp s ILE 171 N 0.97 3.53 0.14 5.43 1.01 -0.34 -4.90 121.20 127.05 2bkp s ILE 171 Ca 0.06 1.48 0.07 0.00 0.00 0.00 0.00 60.65 62.27 2bkp s ILE 171 Cb -0.14 -3.92 -0.04 0.00 0.01 0.00 0.00 42.46 38.37 2bkp s ILE 171 CO 0.03 0.31 -0.17 -0.13 0.00 0.00 0.00 174.94 174.99 2bkp s ARG 172 N -1.59 1.16 0.44 2.79 0.52 -1.26 0.07 118.95 121.07 2bkp s ARG 172 Ca 0.46 -1.32 -0.26 0.00 -0.52 0.00 0.00 55.73 54.10 2bkp s ARG 172 Cb -0.30 -1.16 -0.09 0.00 0.52 0.00 0.00 34.95 33.92 2bkp s ARG 172 CO 0.39 0.23 1.41 0.00 0.02 0.00 0.00 175.30 177.36 2bkp s ALA 173 N -2.00 3.28 0.00 2.13 0.00 -1.26 -1.65 121.76 122.25 2bkp s ALA 173 Ca 0.12 1.44 0.00 0.00 0.00 0.00 0.00 51.96 53.52 2bkp s ALA 173 Cb -0.06 -3.57 0.00 0.00 0.00 0.00 0.00 23.12 19.49 2bkp s ALA 173 CO 0.05 -1.12 0.00 0.41 0.00 0.00 0.00 175.76 175.10 2bkp n GLY 174 N 0.58 3.32 3.73 0.00 0.00 0.73 -4.97 105.19 108.58 2bkp n GLY 174 Ca 0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.71 2bkp n GLY 174 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2bkp s ASP 175 N -0.91 4.52 -0.22 1.61 1.01 -0.66 -4.74 116.67 117.27 2bkp s ASP 175 Ca 0.00 2.47 0.02 0.00 0.71 0.00 0.00 52.55 55.74 2bkp s ASP 175 Cb 0.00 -2.60 0.05 0.00 1.01 0.00 0.00 42.92 41.37 2bkp s ASP 175 CO 0.00 -2.05 -0.12 -0.69 0.21 0.00 0.00 175.17 172.52 2bkp s VAL 176 N -1.69 1.92 0.03 -1.27 1.01 -0.20 -1.53 120.40 118.67 2bkp s VAL 176 Ca 0.78 -1.25 -0.17 0.00 0.00 0.00 0.00 61.98 61.34 2bkp s VAL 176 Cb -0.33 -1.97 -0.06 0.00 0.00 0.00 0.00 36.38 34.03 2bkp s VAL 176 CO 0.41 0.15 0.50 -0.76 0.00 0.00 0.00 175.10 175.40 2bkp s LEU 177 N 1.26 4.49 -0.33 3.92 1.43 0.01 -0.17 118.68 129.30 2bkp s LEU 177 Ca -0.03 1.12 -0.08 0.00 -1.03 0.00 0.00 54.13 54.11 2bkp s LEU 177 Cb -0.17 -2.77 0.02 0.00 0.03 0.00 0.00 46.19 43.31 2bkp s LEU 177 CO -0.08 0.28 0.13 -0.63 0.23 0.00 0.00 176.35 176.28 2bkp s ILE 178 N -1.00 4.08 0.21 -0.59 -1.09 0.67 0.09 121.20 123.58 2bkp s ILE 178 Ca 0.27 -0.89 0.11 0.00 -2.23 0.00 0.00 60.65 57.91 2bkp s ILE 178 Cb -0.18 -3.23 -0.04 0.00 -1.58 0.00 0.00 42.46 37.43 2bkp s ILE 178 CO 0.16 -0.10 -0.19 -0.83 -1.23 0.00 0.00 174.94 172.75 2bkp s GLY 179 N 1.48 1.75 -0.04 6.18 0.00 0.06 -1.21 107.32 115.54 2bkp s GLY 179 Ca 0.01 -1.66 0.07 0.00 0.00 0.00 0.00 44.72 43.14 2bkp s GLY 179 CO 0.04 -1.70 -0.24 -1.60 0.00 0.00 0.00 173.10 169.61 2bkp s ARG 180 N -2.93 2.34 0.00 2.90 3.52 0.19 -0.09 118.95 124.88 2bkp s ARG 180 Ca 0.24 -0.88 0.00 0.00 -0.13 0.00 0.00 55.73 54.96 2bkp s ARG 180 Cb -0.07 -2.15 0.00 0.00 -1.56 0.00 0.00 34.95 31.17 2bkp s ARG 180 CO 0.13 0.50 0.00 0.41 -0.81 0.00 0.00 175.30 175.53 2bkp n GLY 181 N 2.61 -1.63 3.83 8.12 0.00 -0.76 -0.47 105.19 116.90 2bkp n GLY 181 Ca -0.17 -1.20 -0.31 0.00 0.00 0.00 0.00 46.02 44.34 2bkp n GLY 181 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2bkp s THR 182 N -2.81 4.21 0.14 2.61 -4.23 -1.26 0.21 115.64 114.51 2bkp s THR 182 Ca 0.00 0.78 -0.22 0.00 -1.18 0.00 0.00 61.69 61.07 2bkp s THR 182 Cb 0.00 -3.54 0.01 0.00 1.34 0.00 0.00 72.50 70.31 2bkp s THR 182 CO 0.00 -0.87 1.65 -0.09 -0.54 0.00 0.00 174.62 174.77 2bkp h ARG 183 N -0.35 -0.19 -0.63 3.99 9.65 -1.87 -0.84 114.38 124.14 2bkp h ARG 183 Ca -0.44 0.01 0.05 0.00 -1.10 0.00 0.00 59.98 58.49 2bkp h ARG 183 Cb 1.20 0.04 -0.05 0.00 -1.39 0.00 0.00 29.97 29.78 2bkp h ARG 183 CO 0.58 -0.13 0.36 1.79 2.80 0.00 0.00 179.97 185.38 2bkp h THR 184 N -0.20 1.00 -0.32 0.20 1.35 -1.95 -0.03 112.91 112.96 2bkp h THR 184 Ca 0.12 -0.23 0.03 0.00 -0.55 0.00 0.00 66.41 65.78 2bkp h THR 184 Cb 0.37 0.26 -0.03 0.00 -1.73 0.00 0.00 68.15 67.02 2bkp h THR 184 CO -0.30 0.12 0.12 0.28 -0.25 0.00 0.00 175.52 175.49 2bkp h SER 185 N 0.68 0.15 -0.36 5.36 0.02 -1.64 -0.96 113.55 116.79 2bkp h SER 185 Ca 0.27 0.03 0.03 0.00 -0.84 0.00 0.00 61.79 61.28 2bkp h SER 185 Cb 0.12 0.01 -0.03 0.00 0.14 0.00 0.00 62.40 62.64 2bkp h SER 185 CO -0.15 0.12 0.17 0.40 -1.14 0.00 0.00 176.83 176.23 2bkp h ILE 186 N 0.27 0.97 -0.38 3.27 1.08 -0.40 -0.58 117.51 121.73 2bkp h ILE 186 Ca 0.14 -0.12 -0.04 0.00 -0.39 0.00 0.00 64.86 64.45 2bkp h ILE 186 Cb 0.10 0.58 -0.02 0.00 -3.07 0.00 0.00 36.82 34.41 2bkp h ILE 186 CO -0.14 0.06 0.05 0.44 -0.69 0.00 0.00 178.15 177.88 2bkp h ASP 187 N 0.35 0.54 0.39 1.72 5.19 -0.78 -1.70 116.42 122.14 2bkp h ASP 187 Ca 0.15 -0.09 -0.02 0.00 -0.62 0.00 0.00 57.03 56.46 2bkp h ASP 187 Cb 0.08 -0.14 0.00 0.00 0.18 0.00 0.00 39.33 39.45 2bkp h ASP 187 CO -0.12 0.57 -0.19 -0.74 -3.12 0.00 0.00 179.24 175.65 2bkp h HIS 188 N 0.56 -0.48 -0.45 4.55 2.76 -0.38 -2.74 115.15 118.96 2bkp h HIS 188 Ca 0.13 -0.01 0.10 0.00 -2.20 0.00 0.00 60.37 58.38 2bkp h HIS 188 Cb 0.28 0.16 -0.02 0.00 1.55 0.00 0.00 27.41 29.38 2bkp h HIS 188 CO 0.01 -0.21 0.31 1.25 -1.30 0.00 0.00 177.93 178.00 2bkp h LEU 189 N -0.70 0.17 -0.71 0.26 5.85 -0.95 -0.99 115.31 118.24 2bkp h LEU 189 Ca -0.05 0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.61 2bkp h LEU 189 Cb 0.50 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.46 2bkp h LEU 189 CO 0.09 0.10 0.19 0.11 -0.34 0.00 0.00 178.44 178.59 2bkp h LYS 190 N 0.19 1.13 -0.65 1.25 1.57 -1.04 0.21 116.57 119.22 2bkp h LYS 190 Ca 0.21 -0.26 -0.08 0.00 -1.87 0.00 0.00 60.65 58.65 2bkp h LYS 190 Cb 0.59 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 32.72 2bkp h LYS 190 CO -0.03 0.98 0.09 0.93 -0.57 0.00 0.00 179.45 180.85 2bkp h GLU 191 N 1.07 1.10 0.33 3.15 4.39 -0.91 0.37 114.58 124.08 2bkp h GLU 191 Ca 0.23 -0.30 -0.02 0.00 0.34 0.00 0.00 59.36 59.60 2bkp h GLU 191 Cb 0.35 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 28.88 2bkp h GLU 191 CO -0.00 1.02 -0.16 0.82 -1.16 0.00 0.00 179.01 179.53 2bkp h ILE 192 N 1.01 0.69 -0.32 3.13 2.04 -1.14 -1.06 117.51 121.86 2bkp h ILE 192 Ca 0.20 -0.19 0.09 0.00 1.00 0.00 0.00 64.86 65.96 2bkp h ILE 192 Cb 0.46 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 37.32 2bkp h ILE 192 CO 0.02 0.04 0.25 0.00 0.00 0.00 0.00 178.15 178.45 2bkp h ALA 193 N 0.09 2.24 0.00 1.87 0.00 -0.24 0.48 119.26 123.70 2bkp h ALA 193 Ca -0.05 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 2bkp h ALA 193 Cb 0.41 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 2bkp h ALA 193 CO 0.08 -0.41 -0.16 -0.09 0.00 0.00 0.00 179.25 178.66 2bkp h ARG 194 N 0.00 0.00 0.00 0.00 9.65 0.15 -1.42 114.38 122.76 2bkp h ARG 194 Ca 0.15 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.03 2bkp h ARG 194 Cb 0.64 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.22 2bkp h ARG 194 CO -0.00 0.16 0.00 0.41 2.80 0.00 0.00 179.97 183.34 2bkp n GLY 195 N 1.02 0.91 0.35 2.80 0.00 0.17 -4.61 105.19 105.84 2bkp n GLY 195 Ca 0.03 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.04 2bkp n GLY 195 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bkp h ALA 196 N 0.00 1.38 -2.67 4.61 0.00 -1.46 -3.30 119.26 117.82 2bkp h ALA 196 Ca 0.00 -0.08 -0.73 0.00 0.00 0.00 0.00 54.91 54.10 2bkp h ALA 196 Cb 0.00 -0.31 -0.29 0.00 0.00 0.00 0.00 17.79 17.18 2bkp h ALA 196 CO 0.00 0.54 -0.34 0.42 0.00 0.00 0.00 179.25 179.87 2bkp s ILE 197 N -5.81 4.34 -0.50 0.00 1.01 -1.05 -4.95 121.20 114.25 2bkp s ILE 197 Ca -0.11 -1.94 0.00 0.00 0.00 0.00 0.00 60.65 58.60 2bkp s ILE 197 Cb 0.17 -3.83 0.00 0.00 0.01 0.00 0.00 42.46 38.81 2bkp s ILE 197 CO 0.79 -0.81 0.66 0.54 0.00 0.00 0.00 174.94 176.12 2bkp n ARG 198 N 4.72 0.87 -3.75 2.79 5.12 -1.25 -4.38 116.66 120.78 2bkp n ARG 198 Ca -0.05 0.00 -0.13 0.00 -1.93 0.00 0.00 57.85 55.75 2bkp n ARG 198 Cb 0.41 -1.25 -0.11 0.00 -1.16 0.00 0.00 32.46 30.35 2bkp n ARG 198 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 2bkp s VAL 199 N -0.43 -0.01 0.00 1.55 -7.23 -1.26 -4.93 120.40 108.09 2bkp s VAL 199 Ca 0.00 0.02 0.00 0.00 -1.81 0.00 0.00 61.98 60.19 2bkp s VAL 199 Cb 0.00 -0.47 0.00 0.00 0.56 0.00 0.00 36.38 36.47 2bkp s VAL 199 CO 0.00 0.01 0.00 -0.38 -0.31 0.00 0.00 175.10 174.42 2bkp n ILE 200 N 3.18 0.00 -3.83 -0.62 5.41 -1.26 -4.99 119.36 117.25 2bkp n ILE 200 Ca -0.15 0.00 -0.07 0.00 1.00 0.00 0.00 62.75 63.53 2bkp n ILE 200 Cb 0.57 0.00 0.02 0.00 -0.71 0.00 0.00 39.64 39.52 2bkp n ILE 200 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 2bkp s GLY 201 N 0.00 0.30 0.00 7.39 0.00 -1.26 -5.04 107.32 108.71 2bkp s GLY 201 Ca 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 44.72 44.09 2bkp s GLY 201 CO 0.00 0.61 0.00 -2.01 0.00 0.00 0.00 173.10 171.70