#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bki s LEU 4 N 0.00 2.69 0.67 1.08 1.43 -1.26 -5.09 118.68 118.20 2bki s LEU 4 Ca 0.00 0.49 -0.09 0.00 -1.03 0.00 0.00 54.13 53.50 2bki s LEU 4 Cb 0.00 -2.94 0.02 0.00 0.03 0.00 0.00 46.19 43.30 2bki s LEU 4 CO 0.00 -1.95 1.02 -0.89 0.23 0.00 0.00 176.35 174.77 2bki s THR 5 N -3.49 3.39 0.17 5.49 2.01 -1.26 -4.96 115.64 116.99 2bki s THR 5 Ca 0.64 0.23 -0.11 0.00 0.31 0.00 0.00 61.69 62.76 2bki s THR 5 Cb -0.09 -3.41 0.06 0.00 0.01 0.00 0.00 72.50 69.06 2bki s THR 5 CO 0.48 -0.50 1.67 -0.08 -0.69 0.00 0.00 174.62 175.50 2bki h GLU 6 N -0.50 0.92 0.00 4.92 4.22 -2.00 -2.22 114.58 119.93 2bki h GLU 6 Ca -0.45 -0.23 -0.04 0.00 0.08 0.00 0.00 59.36 58.71 2bki h GLU 6 Cb 1.26 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.39 2bki h GLU 6 CO 0.63 0.87 -0.19 0.93 -2.18 0.00 0.00 179.01 179.07 2bki h GLU 7 N 0.82 0.00 0.00 1.92 4.39 -2.00 -2.65 114.58 117.06 2bki h GLU 7 Ca 0.18 0.00 -0.19 0.00 0.34 0.00 0.00 59.36 59.69 2bki h GLU 7 Cb 0.38 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.00 2bki h GLU 7 CO 0.01 0.19 -0.91 1.96 -1.16 0.00 0.00 179.01 179.10 2bki h GLN 8 N 0.00 0.00 -0.27 2.33 4.20 -1.90 -3.25 115.11 116.22 2bki h GLN 8 Ca -0.00 -0.00 -0.19 0.00 0.06 0.00 0.00 58.65 58.52 2bki h GLN 8 Cb 0.57 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.35 2bki h GLN 8 CO 0.02 0.91 -0.57 0.82 -0.67 0.00 0.00 178.83 179.35 2bki h ILE 9 N 0.00 1.28 -0.95 2.54 2.04 -1.14 -2.96 117.51 118.32 2bki h ILE 9 Ca -0.01 -1.76 -0.00 0.00 1.00 0.00 0.00 64.86 64.09 2bki h ILE 9 Cb 1.60 1.67 -0.05 0.00 -0.74 0.00 0.00 36.82 39.30 2bki h ILE 9 CO 0.12 0.57 0.59 0.00 0.00 0.00 0.00 178.15 179.43 2bki h ALA 10 N 0.71 1.25 -0.03 1.87 0.00 -1.56 -1.54 119.26 119.96 2bki h ALA 10 Ca 0.01 -0.09 -0.18 0.00 0.00 0.00 0.00 54.91 54.65 2bki h ALA 10 Cb 1.17 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 2bki h ALA 10 CO 0.12 0.66 -0.77 0.93 0.00 0.00 0.00 179.25 180.19 2bki h GLU 11 N 1.31 0.23 0.00 0.00 4.39 -1.59 -2.89 114.58 116.03 2bki h GLU 11 Ca 0.34 -0.21 -0.10 0.00 0.34 0.00 0.00 59.36 59.74 2bki h GLU 11 Cb -0.09 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.60 2bki h GLU 11 CO -0.07 0.89 -0.47 0.74 -1.16 0.00 0.00 179.01 178.94 2bki h PHE 12 N 0.15 0.00 -0.36 4.33 0.05 -1.37 -2.92 116.94 116.82 2bki h PHE 12 Ca -0.03 0.00 -0.11 0.00 3.82 0.00 0.00 57.97 61.65 2bki h PHE 12 Cb 1.35 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 39.29 2bki h PHE 12 CO 0.03 0.47 -0.24 -0.22 -0.18 0.00 0.00 178.31 178.16 2bki h LYS 13 N 0.00 0.71 0.00 1.51 3.64 -1.07 0.53 116.57 121.89 2bki h LYS 13 Ca -0.00 -0.29 -0.16 0.00 -1.27 0.00 0.00 60.65 58.92 2bki h LYS 13 Cb 1.12 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.88 2bki h LYS 13 CO 0.06 0.89 -0.78 0.93 -2.27 0.00 0.00 179.45 178.28 2bki h GLU 14 N 0.62 0.00 0.00 1.90 4.39 -1.56 -3.08 114.58 116.86 2bki h GLU 14 Ca 0.08 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.68 2bki h GLU 14 Cb 0.74 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.38 2bki h GLU 14 CO 0.06 0.78 -0.48 0.00 -1.16 0.00 0.00 179.01 178.21 2bki h ALA 15 N 1.22 0.87 0.00 3.43 0.00 -1.31 -2.97 119.26 120.51 2bki h ALA 15 Ca -0.01 -0.43 -0.00 0.00 0.00 0.00 0.00 54.91 54.47 2bki h ALA 15 Cb 1.45 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 19.16 2bki h ALA 15 CO 0.10 0.60 -0.00 0.35 0.00 0.00 0.00 179.25 180.30 2bki h PHE 16 N 0.00 0.00 0.00 0.00 -0.00 -0.80 -2.55 116.94 113.59 2bki h PHE 16 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.97 2bki h PHE 16 Cb 1.10 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.05 2bki h PHE 16 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 178.31 178.97 2bki h SER 17 N 0.00 0.00 1.15 0.41 4.64 -1.52 -2.05 113.55 116.18 2bki h SER 17 Ca -0.00 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.15 2bki h SER 17 Cb 0.46 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.52 2bki h SER 17 CO 0.00 0.00 -0.86 -0.07 -0.87 0.00 0.00 176.83 175.03 2bki h LEU 18 N 0.00 0.00 -0.13 5.97 3.38 -1.60 -3.22 115.31 119.70 2bki h LEU 18 Ca 0.00 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 2bki h LEU 18 Cb 0.61 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.36 2bki h LEU 18 CO 0.00 0.80 -0.37 -0.26 0.09 0.00 0.00 178.44 178.69 2bki h PHE 19 N 0.00 0.63 -3.16 1.13 -1.00 -1.61 -3.40 116.94 109.53 2bki h PHE 19 Ca -0.03 -0.25 -0.79 0.00 2.81 0.00 0.00 57.97 59.72 2bki h PHE 19 Cb 1.63 -0.11 -0.26 0.00 3.61 0.00 0.00 35.95 40.82 2bki h PHE 19 CO 0.00 0.99 0.71 -3.47 -1.61 0.00 0.00 178.31 174.93 2bki n ASP 20 N -4.33 5.61 -0.05 2.17 2.03 -0.79 -4.67 116.55 116.53 2bki n ASP 20 Ca -0.07 -3.09 -0.14 0.00 0.52 0.00 0.00 54.79 52.01 2bki n ASP 20 Cb 0.52 -1.40 -0.08 0.00 -0.72 0.00 0.00 41.12 39.45 2bki n ASP 20 CO 0.00 0.00 0.00 0.50 -1.92 0.00 0.00 177.20 175.78 2bki h LYS 21 N 6.49 0.36 0.00 -0.67 3.64 -1.78 -3.27 116.57 121.34 2bki h LYS 21 Ca 0.21 -0.21 -0.03 0.00 -1.27 0.00 0.00 60.65 59.36 2bki h LYS 21 Cb 0.82 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.65 2bki h LYS 21 CO 1.13 0.79 -0.13 0.38 -2.27 0.00 0.00 179.45 179.34 2bki h ASP 22 N -0.04 0.00 0.00 4.20 2.03 -1.90 -3.47 116.42 117.24 2bki h ASP 22 Ca 0.01 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.31 2bki h ASP 22 Cb 0.75 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.25 2bki h ASP 22 CO 0.04 0.13 0.00 0.61 -1.03 0.00 0.00 179.24 178.99 2bki n GLY 23 N -0.54 1.10 0.38 7.15 0.00 -1.23 -5.00 105.19 107.05 2bki n GLY 23 Ca -0.01 -0.23 0.14 0.00 0.00 0.00 0.00 46.02 45.91 2bki n GLY 23 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2bki n ASP 24 N 0.45 1.28 -0.10 1.61 5.75 -1.26 -4.96 116.55 119.33 2bki n ASP 24 Ca 0.00 -1.26 -0.01 0.00 -0.01 0.00 0.00 54.79 53.50 2bki n ASP 24 Cb 0.03 0.04 -0.01 0.00 -1.03 0.00 0.00 41.12 40.16 2bki n ASP 24 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2bki n GLY 25 N 1.23 0.49 3.37 6.12 0.00 -1.26 -5.03 105.19 110.11 2bki n GLY 25 Ca 0.17 -0.94 -0.15 0.00 0.00 0.00 0.00 46.02 45.11 2bki n GLY 25 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bki s THR 26 N -2.04 0.03 0.13 2.61 2.01 -1.26 -4.40 115.64 112.73 2bki s THR 26 Ca 0.00 -0.29 -0.00 0.00 0.31 0.00 0.00 61.69 61.71 2bki s THR 26 Cb 0.00 -0.87 -0.04 0.00 0.01 0.00 0.00 72.50 71.60 2bki s THR 26 CO 0.00 -0.16 0.03 0.27 -0.69 0.00 0.00 174.62 174.07 2bki s ILE 27 N -1.73 0.28 0.22 1.82 -4.36 -1.16 -4.83 121.20 111.44 2bki s ILE 27 Ca -0.10 -1.92 0.01 0.00 -0.26 0.00 0.00 60.65 58.38 2bki s ILE 27 Cb -0.02 -2.00 -0.00 0.00 1.25 0.00 0.00 42.46 41.68 2bki s ILE 27 CO 0.03 -0.53 0.02 0.35 0.24 0.00 0.00 174.94 175.06 2bki n THR 28 N -0.11 0.00 0.47 8.37 -2.24 -1.26 -3.05 114.28 116.45 2bki n THR 28 Ca -0.07 -1.10 0.13 0.00 -2.27 0.00 0.00 64.05 60.74 2bki n THR 28 Cb 0.63 0.28 0.40 0.00 -2.10 0.00 0.00 70.33 69.54 2bki n THR 28 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 2bki h THR 29 N 1.19 0.00 0.00 4.28 1.35 -1.97 -2.38 112.91 115.38 2bki h THR 29 Ca -0.18 -0.54 -0.07 0.00 -0.55 0.00 0.00 66.41 65.07 2bki h THR 29 Cb 0.58 1.49 -0.01 0.00 -1.73 0.00 0.00 68.15 68.48 2bki h THR 29 CO 0.29 0.00 -0.34 0.11 -0.25 0.00 0.00 175.52 175.33 2bki h LYS 30 N 0.00 0.00 0.00 4.72 6.56 -1.97 -2.37 116.57 123.51 2bki h LYS 30 Ca 0.00 0.00 -0.35 0.00 -1.06 0.00 0.00 60.65 59.24 2bki h LYS 30 Cb 0.70 0.00 -0.05 0.00 -0.57 0.00 0.00 32.23 32.31 2bki h LYS 30 CO 0.00 0.34 -2.15 0.39 -2.06 0.00 0.00 179.45 175.98 2bki n GLU 31 N -3.37 0.55 0.28 3.15 1.02 -1.15 -3.69 120.64 117.43 2bki n GLU 31 Ca 0.01 0.24 0.16 0.00 -0.02 0.00 0.00 57.16 57.55 2bki n GLU 31 Cb 0.55 -1.42 0.77 0.00 -0.02 0.00 0.00 31.44 31.31 2bki n GLU 31 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2bki h LEU 32 N -0.95 0.00 -0.26 -4.62 6.46 -1.61 -2.36 115.31 111.98 2bki h LEU 32 Ca -0.53 0.00 -0.17 0.00 -0.12 0.00 0.00 57.88 57.06 2bki h LEU 32 Cb 1.45 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.38 2bki h LEU 32 CO -0.32 0.06 -0.50 1.23 -0.62 0.00 0.00 178.44 178.29 2bki h GLY 33 N 1.38 0.86 2.00 3.75 0.00 -1.62 -3.16 103.07 106.29 2bki h GLY 33 Ca -0.00 -1.02 -0.05 0.00 0.00 0.00 0.00 47.33 46.26 2bki h GLY 33 CO 0.01 0.91 -0.22 -0.84 0.00 0.00 0.00 176.54 176.40 2bki h THR 34 N 0.54 0.52 0.10 4.70 2.02 -1.50 -2.42 112.91 116.87 2bki h THR 34 Ca 0.01 -1.12 -0.28 0.00 0.77 0.00 0.00 66.41 65.79 2bki h THR 34 Cb 1.10 1.78 0.03 0.00 -1.74 0.00 0.00 68.15 69.32 2bki h THR 34 CO 0.11 0.21 -1.14 0.58 0.37 0.00 0.00 175.52 175.65 2bki h VAL 35 N 0.00 1.31 -0.52 3.16 2.07 -1.63 -2.95 116.25 117.69 2bki h VAL 35 Ca -0.00 -2.41 0.02 0.00 0.82 0.00 0.00 66.70 65.14 2bki h VAL 35 Cb 0.76 2.69 -0.03 0.00 -1.52 0.00 0.00 31.29 33.19 2bki h VAL 35 CO 0.03 0.73 0.31 0.24 0.02 0.00 0.00 177.57 178.89 2bki h MET 36 N 0.21 0.59 0.00 1.57 2.86 -1.46 -2.56 114.93 116.14 2bki h MET 36 Ca -0.17 -0.04 -0.08 0.00 -2.06 0.00 0.00 59.70 57.36 2bki h MET 36 Cb 1.83 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 33.34 2bki h MET 36 CO 0.22 0.39 -0.37 0.00 1.06 0.00 0.00 176.91 178.22 2bki h ARG 37 N 0.61 0.00 0.00 1.72 3.08 -1.54 -2.77 114.38 115.49 2bki h ARG 37 Ca 0.21 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.25 2bki h ARG 37 Cb 0.03 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.07 2bki h ARG 37 CO -0.10 0.37 -0.06 0.66 -1.07 0.00 0.00 179.97 179.77 2bki h SER 38 N 0.00 0.00 -0.83 7.04 4.64 -1.27 -3.30 113.55 119.83 2bki h SER 38 Ca -0.00 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 60.73 2bki h SER 38 Cb 0.66 0.00 -0.37 0.00 -0.31 0.00 0.00 62.40 62.38 2bki h SER 38 CO 0.05 0.06 -0.15 0.18 -0.87 0.00 0.00 176.83 176.10 2bki n LEU 39 N -3.15 5.95 0.00 5.97 4.32 -1.09 -4.90 117.00 124.11 2bki n LEU 39 Ca 0.01 -4.54 0.00 0.00 -0.02 0.00 0.00 56.01 51.47 2bki n LEU 39 Cb 0.40 -0.59 0.00 0.00 -1.62 0.00 0.00 43.42 41.61 2bki n LEU 39 CO 0.31 1.84 0.00 0.61 -1.22 0.00 0.00 177.39 178.92 2bki n GLY 40 N -0.81 3.16 3.89 -0.72 0.00 -1.24 -5.01 105.19 104.46 2bki n GLY 40 Ca 0.51 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.23 2bki n GLY 40 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2bki s GLN 41 N -0.37 2.49 -0.47 1.61 2.00 -1.06 -5.02 119.66 118.84 2bki s GLN 41 Ca 0.00 0.32 0.06 0.00 -2.00 0.00 0.00 55.36 53.75 2bki s GLN 41 Cb 0.00 -1.99 0.23 0.00 0.80 0.00 0.00 33.01 32.05 2bki s GLN 41 CO 0.00 -1.26 0.76 -1.71 -0.50 0.00 0.00 175.29 172.58 2bki n ASN 42 N -3.13 -2.18 -4.81 6.67 2.85 -1.26 -3.98 115.26 109.42 2bki n ASN 42 Ca 0.07 -3.08 -0.34 0.00 -0.11 0.00 0.00 54.58 51.12 2bki n ASN 42 Cb 0.59 1.17 -0.06 0.00 1.24 0.00 0.00 39.78 42.71 2bki n ASN 42 CO 0.00 0.00 0.00 -2.16 -2.11 0.00 0.00 177.26 172.99 2bki s PRO 43 N 0.27 4.18 0.61 1.20 0.04 -1.26 -5.06 135.00 134.98 2bki s PRO 43 Ca 0.32 1.21 -0.07 0.00 0.04 0.00 0.00 61.00 62.50 2bki s PRO 43 Cb 0.18 -2.25 0.00 0.00 0.04 0.00 0.00 34.50 32.47 2bki s PRO 43 CO -0.19 -0.08 0.94 -0.08 0.04 0.00 0.00 177.00 177.63 2bki s THR 44 N -2.05 3.81 -1.32 1.26 -1.32 -1.26 -4.97 115.64 109.80 2bki s THR 44 Ca 0.61 0.19 -0.17 0.00 -1.21 0.00 0.00 61.69 61.12 2bki s THR 44 Cb -0.12 -3.53 0.02 0.00 -1.51 0.00 0.00 72.50 67.36 2bki s THR 44 CO 0.16 -0.59 2.03 1.21 -2.21 0.00 0.00 174.62 175.23 2bki n GLU 45 N -2.66 2.74 0.00 7.08 4.07 -1.26 -3.58 120.64 127.02 2bki n GLU 45 Ca 0.05 -2.72 0.00 0.00 -0.06 0.00 0.00 57.16 54.43 2bki n GLU 45 Cb 0.57 -3.34 0.00 0.00 -0.06 0.00 0.00 31.44 28.61 2bki n GLU 45 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2bki n ALA 46 N 7.43 0.00 -0.20 4.31 0.00 -1.26 -4.99 120.51 125.80 2bki n ALA 46 Ca 0.50 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.87 2bki n ALA 46 Cb 0.42 0.00 0.06 0.00 0.00 0.00 0.00 19.45 19.93 2bki n ALA 46 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2bki h GLU 47 N 0.00 1.04 0.00 0.00 5.08 -1.97 -2.92 114.58 115.80 2bki h GLU 47 Ca 0.00 -0.30 0.00 0.00 -1.00 0.00 0.00 59.36 58.06 2bki h GLU 47 Cb 0.00 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.14 2bki h GLU 47 CO 0.00 0.99 0.00 1.37 -1.00 0.00 0.00 179.01 180.37 2bki h LEU 48 N 0.96 0.00 -0.73 1.33 8.10 -1.95 -3.02 115.31 120.01 2bki h LEU 48 Ca 0.18 0.00 -0.08 0.00 0.11 0.00 0.00 57.88 58.09 2bki h LEU 48 Cb 0.50 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 40.69 2bki h LEU 48 CO 0.02 0.00 0.07 -0.61 -4.11 0.00 0.00 178.44 173.81 2bki h GLN 49 N 0.00 1.04 -0.43 0.17 5.75 -1.87 -2.57 115.11 117.21 2bki h GLN 49 Ca 0.00 -0.29 -0.12 0.00 -0.15 0.00 0.00 58.65 58.09 2bki h GLN 49 Cb 0.64 -0.12 -0.01 0.00 1.07 0.00 0.00 27.48 29.05 2bki h GLN 49 CO 0.00 0.98 -0.23 0.22 -2.65 0.00 0.00 178.83 177.15 2bki h ASP 50 N 0.97 0.89 1.56 -0.69 1.82 -1.61 -2.84 116.42 116.52 2bki h ASP 50 Ca 0.19 -0.33 -0.04 0.00 -0.39 0.00 0.00 57.03 56.46 2bki h ASP 50 Cb 0.46 -0.24 -0.01 0.00 0.68 0.00 0.00 39.33 40.23 2bki h ASP 50 CO 0.02 1.08 -0.45 0.00 -1.61 0.00 0.00 179.24 178.27 2bki h MET 51 N 0.75 0.00 -0.84 0.28 -0.00 -1.63 -2.84 114.93 110.65 2bki h MET 51 Ca 0.10 0.00 -0.03 0.00 -0.00 0.00 0.00 59.70 59.77 2bki h MET 51 Cb 0.77 0.00 -0.04 0.00 -0.00 0.00 0.00 31.60 32.33 2bki h MET 51 CO 0.06 0.13 0.42 0.82 -0.00 0.00 0.00 176.91 178.34 2bki h ILE 52 N 0.00 1.26 0.00 -0.10 2.04 -1.44 -3.14 117.51 116.12 2bki h ILE 52 Ca -0.01 -0.70 0.00 0.00 1.00 0.00 0.00 64.86 65.15 2bki h ILE 52 Cb 1.13 0.16 0.00 0.00 -0.74 0.00 0.00 36.82 37.37 2bki h ILE 52 CO 0.02 0.30 0.00 0.59 0.00 0.00 0.00 178.15 179.06 2bki n ASN 53 N -4.31 0.00 -0.01 1.72 5.03 -1.08 -2.38 115.26 114.23 2bki n ASN 53 Ca 0.08 0.19 -0.05 0.00 0.87 0.00 0.00 54.58 55.67 2bki n ASN 53 Cb 0.13 -0.36 -0.04 0.00 -1.02 0.00 0.00 39.78 38.49 2bki n ASN 53 CO 0.00 0.00 0.00 -0.08 -1.83 0.00 0.00 177.26 175.35 2bki h GLU 54 N 0.00 -0.09 0.21 3.52 4.81 -1.57 -3.41 114.58 118.04 2bki h GLU 54 Ca 0.00 0.01 -0.32 0.00 -0.13 0.00 0.00 59.36 58.92 2bki h GLU 54 Cb 0.21 0.02 0.02 0.00 0.63 0.00 0.00 28.75 29.64 2bki h GLU 54 CO 0.00 0.20 -1.42 -0.39 -0.73 0.00 0.00 179.01 176.67 2bki h VAL 55 N -1.00 1.33 -1.41 0.32 -1.51 -1.70 -3.43 116.25 108.85 2bki h VAL 55 Ca -0.01 -2.82 -0.38 0.00 -1.23 0.00 0.00 66.70 62.26 2bki h VAL 55 Cb 0.34 2.99 -0.00 0.00 -2.13 0.00 0.00 31.29 32.48 2bki h VAL 55 CO 0.02 0.84 1.27 -0.62 -1.23 0.00 0.00 177.57 177.85 2bki s ASP 56 N -7.40 4.49 0.09 4.19 3.68 -1.00 -4.78 116.67 115.94 2bki s ASP 56 Ca -0.08 0.71 0.05 0.00 2.13 0.00 0.00 52.55 55.36 2bki s ASP 56 Cb 0.05 -2.52 -0.23 0.00 -1.45 0.00 0.00 42.92 38.78 2bki s ASP 56 CO 0.92 -2.98 1.18 0.00 0.13 0.00 0.00 175.17 174.42 2bki h ALA 57 N 17.36 0.32 -0.07 3.66 0.00 -1.91 -3.34 119.26 135.28 2bki h ALA 57 Ca -0.19 -0.96 -0.15 0.00 0.00 0.00 0.00 54.91 53.61 2bki h ALA 57 Cb 1.19 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 2bki h ALA 57 CO 1.14 1.21 -0.62 -0.44 0.00 0.00 0.00 179.25 180.54 2bki h ASP 58 N 0.02 0.29 -3.64 0.00 3.32 -1.95 -3.49 116.42 110.97 2bki h ASP 58 Ca -0.07 -0.17 0.00 0.00 0.02 0.00 0.00 57.03 56.81 2bki h ASP 58 Cb 1.84 -0.09 -0.04 0.00 0.22 0.00 0.00 39.33 41.26 2bki h ASP 58 CO 0.14 0.84 -0.52 0.61 -1.72 0.00 0.00 179.24 178.60 2bki n GLY 59 N 0.32 -3.72 0.00 2.75 0.00 -1.26 -5.04 105.19 98.24 2bki n GLY 59 Ca -0.03 0.31 0.00 0.00 0.00 0.00 0.00 46.02 46.31 2bki n GLY 59 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2bki n ASN 60 N 0.56 0.00 0.00 1.61 0.23 -1.26 -5.04 115.26 111.35 2bki n ASN 60 Ca -0.14 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 53.91 2bki n ASN 60 Cb 0.21 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.91 2bki n ASN 60 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2bki n GLY 61 N -0.47 1.87 3.01 4.83 0.00 -1.26 -5.14 105.19 108.03 2bki n GLY 61 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 2bki n GLY 61 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2bki s THR 62 N -2.00 0.98 -0.17 2.61 -4.23 -1.26 -4.55 115.64 107.02 2bki s THR 62 Ca 0.00 -0.42 -0.02 0.00 -1.18 0.00 0.00 61.69 60.07 2bki s THR 62 Cb 0.00 -0.89 -0.01 0.00 1.34 0.00 0.00 72.50 72.93 2bki s THR 62 CO 0.00 0.31 -0.08 -0.63 -0.54 0.00 0.00 174.62 173.68 2bki s ILE 63 N 0.51 3.29 0.70 2.99 1.09 -1.17 -4.90 121.20 123.71 2bki s ILE 63 Ca -0.10 -0.55 -0.04 0.00 -1.10 0.00 0.00 60.65 58.85 2bki s ILE 63 Cb -0.13 -2.44 0.08 0.00 -1.06 0.00 0.00 42.46 38.91 2bki s ILE 63 CO 0.02 0.48 0.99 1.51 -0.10 0.00 0.00 174.94 177.84 2bki s ASP 64 N 0.81 4.64 0.08 3.58 1.47 -1.26 -2.99 116.67 123.00 2bki s ASP 64 Ca -0.03 0.14 -0.27 0.00 1.18 0.00 0.00 52.55 53.57 2bki s ASP 64 Cb -0.15 -0.72 -0.17 0.00 -0.34 0.00 0.00 42.92 41.55 2bki s ASP 64 CO 0.01 -1.67 1.68 0.15 0.68 0.00 0.00 175.17 176.02 2bki h PHE 65 N -0.53 -0.33 -0.22 2.11 3.57 -2.00 -1.44 116.94 118.10 2bki h PHE 65 Ca -0.42 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.14 2bki h PHE 65 Cb 1.29 0.11 -0.01 0.00 2.79 0.00 0.00 35.95 40.13 2bki h PHE 65 CO 0.07 -0.20 0.20 -1.00 -2.23 0.00 0.00 178.31 175.16 2bki h PRO 66 N -0.37 0.00 0.07 6.41 0.13 -1.98 -0.09 132.00 136.18 2bki h PRO 66 Ca -0.04 0.00 -0.29 0.00 -0.87 0.00 0.00 66.00 64.81 2bki h PRO 66 Cb 0.28 0.00 0.03 0.00 0.13 0.00 0.00 31.00 31.44 2bki h PRO 66 CO 0.06 0.00 -1.17 0.93 -0.23 0.00 0.00 178.00 177.59 2bki h GLU 67 N 0.00 0.65 -0.29 0.86 5.08 -1.86 -3.22 114.58 115.80 2bki h GLU 67 Ca 0.10 -0.80 0.04 0.00 -1.00 0.00 0.00 59.36 57.70 2bki h GLU 67 Cb 0.51 0.25 -0.02 0.00 0.50 0.00 0.00 28.75 30.00 2bki h GLU 67 CO -0.00 1.36 0.20 0.35 -1.00 0.00 0.00 179.01 179.91 2bki h PHE 68 N 0.32 0.23 -0.31 4.33 3.57 0.04 -1.41 116.94 123.71 2bki h PHE 68 Ca -0.16 0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.25 2bki h PHE 68 Cb 1.83 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 40.49 2bki h PHE 68 CO 0.11 0.13 -0.18 -0.07 -2.23 0.00 0.00 178.31 176.07 2bki h LEU 69 N 0.24 0.70 -0.11 0.59 3.38 -1.33 -3.04 115.31 115.73 2bki h LEU 69 Ca 0.12 -0.42 0.00 0.00 0.09 0.00 0.00 57.88 57.67 2bki h LEU 69 Cb 0.20 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2bki h LEU 69 CO -0.02 0.97 -0.07 0.35 0.09 0.00 0.00 178.44 179.75 2bki n THR 70 N -4.35 0.00 0.09 0.22 -2.24 -1.05 -2.70 114.28 104.25 2bki n THR 70 Ca -0.03 -0.03 -0.01 0.00 -2.27 0.00 0.00 64.05 61.71 2bki n THR 70 Cb 0.40 -0.27 -0.04 0.00 -2.10 0.00 0.00 70.33 68.31 2bki n THR 70 CO 0.00 0.00 0.00 -0.03 -0.57 0.00 0.00 175.07 174.47 2bki h MET 71 N 0.27 0.00 -0.00 -0.78 -1.53 -1.15 -3.32 114.93 108.42 2bki h MET 71 Ca 0.00 0.00 0.00 0.00 -3.44 0.00 0.00 59.70 56.26 2bki h MET 71 Cb 0.34 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.39 2bki h MET 71 CO 0.00 0.61 -0.54 0.00 0.14 0.00 0.00 176.91 177.12 2bki n MET 72 N -3.20 2.44 -2.71 0.39 0.00 -1.21 -4.97 117.12 107.85 2bki n MET 72 Ca -0.02 -0.18 -0.41 0.00 0.00 0.00 0.00 57.70 57.10 2bki n MET 72 Cb 0.83 -1.14 -0.05 0.00 0.00 0.00 0.00 33.22 32.86 2bki n MET 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2bki s ALA 73 N -2.12 3.28 0.24 3.17 0.00 -1.10 -5.05 121.76 120.19 2bki s ALA 73 Ca 0.07 0.61 -0.14 0.00 0.00 0.00 0.00 51.96 52.50 2bki s ALA 73 Cb 0.10 -3.27 -0.00 0.00 0.00 0.00 0.00 23.12 19.95 2bki s ALA 73 CO 0.50 0.01 0.50 1.03 0.00 0.00 0.00 175.76 177.79 2bki s ARG 74 N -0.33 1.55 -0.48 0.00 1.81 -1.26 -4.94 118.95 115.30 2bki s ARG 74 Ca 0.46 -1.20 -0.27 0.00 -1.72 0.00 0.00 55.73 53.00 2bki s ARG 74 Cb -0.25 0.48 -0.03 0.00 -0.45 0.00 0.00 34.95 34.70 2bki s ARG 74 CO 0.31 -0.65 2.01 -1.59 -0.68 0.00 0.00 175.30 174.70 2bki s LYS 75 N -4.00 2.71 -0.08 3.54 0.00 -1.26 -4.94 119.74 115.71 2bki s LYS 75 Ca 0.20 1.13 -0.04 0.00 0.00 0.00 0.00 55.97 57.26 2bki s LYS 75 Cb -0.01 -4.39 -0.04 0.00 0.00 0.00 0.00 37.83 33.39 2bki s LYS 75 CO 0.08 -2.60 0.11 -1.64 0.00 0.00 0.00 175.35 171.30 2bki s MET 76 N 6.94 3.28 0.62 1.78 1.00 -1.26 -5.11 119.30 126.55 2bki s MET 76 Ca 0.80 -0.28 -0.12 0.00 0.00 0.00 0.00 55.69 56.10 2bki s MET 76 Cb -0.18 -3.04 -0.03 0.00 0.00 0.00 0.00 34.83 31.58 2bki s MET 76 CO 0.26 0.73 1.03 -1.59 0.00 0.00 0.00 175.02 175.45 2bki s LYS 77 N -1.25 3.49 0.26 2.03 0.00 -1.26 -4.98 119.74 118.04 2bki s LYS 77 Ca 0.18 0.83 -0.02 0.00 0.00 0.00 0.00 55.97 56.96 2bki s LYS 77 Cb -0.12 -2.07 0.46 0.00 0.00 0.00 0.00 37.83 36.10 2bki s LYS 77 CO 0.07 -0.65 1.84 -0.44 0.00 0.00 0.00 175.35 176.17 2bki h ASP 78 N -0.24 0.86 1.00 0.03 3.45 -2.05 -2.61 116.42 116.87 2bki h ASP 78 Ca -0.44 0.04 -0.01 0.00 0.43 0.00 0.00 57.03 57.04 2bki h ASP 78 Cb 1.19 -0.13 -0.00 0.00 -0.56 0.00 0.00 39.33 39.83 2bki h ASP 78 CO 0.61 0.49 -1.01 0.74 -1.57 0.00 0.00 179.24 178.50 2bki h THR 79 N 0.96 0.04 -1.01 0.35 2.02 -2.02 -3.37 112.91 109.88 2bki h THR 79 Ca 0.44 -1.08 0.23 0.00 0.77 0.00 0.00 66.41 66.77 2bki h THR 79 Cb 0.36 1.56 -0.12 0.00 -1.74 0.00 0.00 68.15 68.21 2bki h THR 79 CO -0.24 0.02 0.61 0.44 0.37 0.00 0.00 175.52 176.72 2bki h ASP 80 N 0.00 0.69 0.09 4.18 3.45 -1.85 -2.12 116.42 120.87 2bki h ASP 80 Ca -0.01 0.12 -0.00 0.00 0.43 0.00 0.00 57.03 57.56 2bki h ASP 80 Cb 1.05 0.01 0.00 0.00 -0.56 0.00 0.00 39.33 39.82 2bki h ASP 80 CO 0.00 0.16 -0.04 -1.28 -1.57 0.00 0.00 179.24 176.51 2bki h SER 81 N 0.62 -0.10 0.24 6.45 0.87 -1.73 -2.48 113.55 117.42 2bki h SER 81 Ca 0.62 -0.04 -0.06 0.00 -1.23 0.00 0.00 61.79 61.07 2bki h SER 81 Cb 1.14 0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 63.12 2bki h SER 81 CO -0.43 -0.02 -0.28 -0.08 -0.53 0.00 0.00 176.83 175.49 2bki h GLU 82 N -0.17 0.07 0.00 2.24 4.57 -1.72 -2.91 114.58 116.66 2bki h GLU 82 Ca -0.01 -0.02 -0.06 0.00 -1.18 0.00 0.00 59.36 58.09 2bki h GLU 82 Cb 0.14 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.71 2bki h GLU 82 CO 0.02 0.35 -0.27 0.93 -1.18 0.00 0.00 179.01 178.86 2bki h GLU 83 N 0.07 0.00 0.17 1.92 3.07 -1.16 -2.76 114.58 115.89 2bki h GLU 83 Ca 0.01 0.00 -0.30 0.00 -0.50 0.00 0.00 59.36 58.57 2bki h GLU 83 Cb 0.53 0.00 0.02 0.00 -0.84 0.00 0.00 28.75 28.46 2bki h GLU 83 CO 0.04 0.27 -1.33 0.93 -1.40 0.00 0.00 179.01 177.51 2bki h GLU 84 N 0.00 0.36 -0.55 2.33 5.08 -1.25 -2.37 114.58 118.17 2bki h GLU 84 Ca -0.00 -0.62 -0.11 0.00 -1.00 0.00 0.00 59.36 57.63 2bki h GLU 84 Cb 0.85 0.23 -0.02 0.00 0.50 0.00 0.00 28.75 30.31 2bki h GLU 84 CO 0.03 1.29 -0.10 0.82 -1.00 0.00 0.00 179.01 180.06 2bki h ILE 85 N 0.10 1.27 -0.45 3.13 2.04 -1.43 -2.04 117.51 120.12 2bki h ILE 85 Ca -0.18 -1.26 -0.10 0.00 1.00 0.00 0.00 64.86 64.33 2bki h ILE 85 Cb 2.04 0.95 -0.02 0.00 -0.74 0.00 0.00 36.82 39.05 2bki h ILE 85 CO 0.23 0.45 -0.10 0.03 0.00 0.00 0.00 178.15 178.75 2bki h ARG 86 N 0.92 0.81 0.00 2.37 3.08 -1.56 -2.84 114.38 117.16 2bki h ARG 86 Ca 0.14 -0.27 -0.07 0.00 0.07 0.00 0.00 59.98 59.85 2bki h ARG 86 Cb 0.67 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.64 2bki h ARG 86 CO 0.05 0.88 -0.33 1.49 -1.07 0.00 0.00 179.97 181.00 2bki h GLU 87 N 0.74 0.00 0.06 0.04 4.81 -1.20 -2.64 114.58 116.39 2bki h GLU 87 Ca 0.12 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.35 2bki h GLU 87 Cb 0.60 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.98 2bki h GLU 87 CO 0.04 0.33 -0.03 0.00 -0.73 0.00 0.00 179.01 178.62 2bki h ALA 88 N 1.67 -0.08 -1.00 2.92 0.00 -1.21 -2.88 119.26 118.68 2bki h ALA 88 Ca -0.00 -0.20 0.22 0.00 0.00 0.00 0.00 54.91 54.93 2bki h ALA 88 Cb 0.68 0.03 -0.11 0.00 0.00 0.00 0.00 17.79 18.39 2bki h ALA 88 CO 0.04 -0.34 0.62 0.35 0.00 0.00 0.00 179.25 179.92 2bki h PHE 89 N -0.49 0.95 0.00 0.00 3.57 -1.37 -2.39 116.94 117.22 2bki h PHE 89 Ca -0.01 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.48 2bki h PHE 89 Cb 0.43 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 38.88 2bki h PHE 89 CO 0.06 0.15 -0.19 0.00 -2.23 0.00 0.00 178.31 176.10 2bki h ARG 90 N 0.62 0.00 -0.04 1.11 3.08 -1.37 -1.63 114.38 116.15 2bki h ARG 90 Ca 0.60 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 60.50 2bki h ARG 90 Cb 1.12 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.16 2bki h ARG 90 CO -0.38 0.19 -0.64 -0.39 -1.07 0.00 0.00 179.97 177.68 2bki h VAL 91 N 0.00 1.42 -0.05 2.04 -1.51 -1.21 -3.16 116.25 113.78 2bki h VAL 91 Ca -0.00 -2.11 -0.19 0.00 -1.23 0.00 0.00 66.70 63.17 2bki h VAL 91 Cb 0.94 2.10 -0.01 0.00 -2.13 0.00 0.00 31.29 32.20 2bki h VAL 91 CO 0.02 0.61 -0.78 -0.26 -1.23 0.00 0.00 177.57 175.94 2bki h PHE 92 N 0.11 0.47 -3.54 5.19 0.05 -1.26 -3.41 116.94 114.55 2bki h PHE 92 Ca -0.01 -0.22 -0.78 0.00 3.82 0.00 0.00 57.97 60.78 2bki h PHE 92 Cb 1.15 -0.07 -0.30 0.00 2.00 0.00 0.00 35.95 38.74 2bki h PHE 92 CO 0.01 0.99 0.28 0.34 -0.18 0.00 0.00 178.31 179.75 2bki s ASP 93 N -6.97 6.93 0.04 2.17 2.15 -0.66 -4.66 116.67 115.67 2bki s ASP 93 Ca -0.05 -3.52 -0.23 0.00 0.43 0.00 0.00 52.55 49.19 2bki s ASP 93 Cb 0.10 -2.13 -0.12 0.00 -0.30 0.00 0.00 42.92 40.47 2bki s ASP 93 CO 0.84 -0.29 1.35 0.07 -0.17 0.00 0.00 175.17 176.96 2bki h LYS 94 N 6.64 -0.73 0.00 4.34 2.10 -1.79 -2.99 116.57 124.14 2bki h LYS 94 Ca 0.16 0.05 -0.02 0.00 -2.00 0.00 0.00 60.65 58.84 2bki h LYS 94 Cb 0.88 0.17 -0.00 0.00 -0.90 0.00 0.00 32.23 32.37 2bki h LYS 94 CO 0.94 -0.48 -0.11 0.38 -2.00 0.00 0.00 179.45 178.18 2bki h ASP 95 N -0.75 0.00 -3.37 7.07 3.04 -1.93 -3.48 116.42 117.00 2bki h ASP 95 Ca -0.07 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.72 2bki h ASP 95 Cb 0.60 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.89 2bki h ASP 95 CO 0.07 0.11 -0.04 0.61 -2.04 0.00 0.00 179.24 177.95 2bki n GLY 96 N -0.62 -0.62 0.81 7.15 0.00 -1.13 -5.03 105.19 105.75 2bki n GLY 96 Ca -0.02 0.01 0.03 0.00 0.00 0.00 0.00 46.02 46.04 2bki n GLY 96 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2bki n ASN 97 N -0.79 0.63 -0.62 1.61 0.23 -1.26 -5.01 115.26 110.05 2bki n ASN 97 Ca 0.01 -2.20 -0.08 0.00 -0.53 0.00 0.00 54.58 51.79 2bki n ASN 97 Cb 0.29 -0.27 -0.03 0.00 -2.08 0.00 0.00 39.78 37.68 2bki n ASN 97 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2bki n GLY 98 N -0.01 0.94 2.99 4.83 0.00 -1.26 -5.03 105.19 107.65 2bki n GLY 98 Ca 0.04 -0.68 -0.09 0.00 0.00 0.00 0.00 46.02 45.29 2bki n GLY 98 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2bki s TYR 99 N -2.30 0.31 -0.23 1.61 1.51 -1.26 -4.07 117.35 112.92 2bki s TYR 99 Ca 0.00 -0.57 -0.00 0.00 -1.01 0.00 0.00 57.07 55.49 2bki s TYR 99 Cb 0.00 -0.22 0.03 0.00 -0.11 0.00 0.00 41.96 41.66 2bki s TYR 99 CO 0.00 -0.20 -0.11 0.42 -1.11 0.00 0.00 175.55 174.55 2bki s ILE 100 N -1.66 2.51 0.80 2.71 1.01 -0.68 -4.80 121.20 121.09 2bki s ILE 100 Ca -0.14 -1.10 -0.06 0.00 0.00 0.00 0.00 60.65 59.36 2bki s ILE 100 Cb -0.09 -2.24 0.15 0.00 0.01 0.00 0.00 42.46 40.29 2bki s ILE 100 CO -0.02 0.27 1.11 -0.94 0.00 0.00 0.00 174.94 175.36 2bki s SER 101 N 1.28 3.94 0.20 3.58 1.04 -1.26 -1.88 113.70 120.60 2bki s SER 101 Ca 0.00 -0.14 -0.10 0.00 0.48 0.00 0.00 55.95 56.19 2bki s SER 101 Cb -0.16 -0.13 0.14 0.00 0.10 0.00 0.00 66.02 65.97 2bki s SER 101 CO -0.07 -2.15 1.82 0.00 0.98 0.00 0.00 173.24 173.81 2bki h ALA 102 N -0.91 0.94 -0.36 5.32 0.00 -1.93 -2.15 119.26 120.17 2bki h ALA 102 Ca -0.39 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.31 2bki h ALA 102 Cb 1.26 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 2bki h ALA 102 CO 0.40 0.45 -0.16 0.00 0.00 0.00 0.00 179.25 179.94 2bki h ALA 103 N 1.20 1.05 -0.00 0.00 0.00 -1.98 -2.06 119.26 117.47 2bki h ALA 103 Ca 0.26 -0.32 -0.24 0.00 0.00 0.00 0.00 54.91 54.61 2bki h ALA 103 Cb 0.04 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 17.68 2bki h ALA 103 CO -0.04 0.58 -0.97 0.93 0.00 0.00 0.00 179.25 179.75 2bki h GLU 104 N 0.59 0.50 -0.17 0.00 5.08 -1.85 -2.93 114.58 115.80 2bki h GLU 104 Ca 0.10 -0.54 -0.16 0.00 -1.00 0.00 0.00 59.36 57.76 2bki h GLU 104 Cb 0.61 0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.00 2bki h GLU 104 CO 0.04 1.17 -0.58 1.25 -1.00 0.00 0.00 179.01 179.90 2bki h LEU 105 N 0.28 0.59 -1.45 1.33 6.46 -1.37 -3.18 115.31 117.98 2bki h LEU 105 Ca -0.09 -0.33 -0.05 0.00 -0.12 0.00 0.00 57.88 57.29 2bki h LEU 105 Cb 1.61 -0.17 -0.01 0.00 -0.73 0.00 0.00 40.66 41.36 2bki h LEU 105 CO 0.18 1.04 -0.17 0.03 -0.62 0.00 0.00 178.44 178.90 2bki h ARG 106 N 0.40 0.15 -0.05 1.25 3.08 -1.38 -2.64 114.38 115.18 2bki h ARG 106 Ca 0.00 -0.03 -0.19 0.00 0.07 0.00 0.00 59.98 59.83 2bki h ARG 106 Cb 1.13 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.15 2bki h ARG 106 CO 0.11 0.32 -0.76 1.25 -1.07 0.00 0.00 179.97 179.82 2bki h HIS 107 N 0.14 0.48 -0.09 3.04 2.76 -1.50 -2.34 115.15 117.64 2bki h HIS 107 Ca 0.03 -0.22 -0.21 0.00 -2.20 0.00 0.00 60.37 57.76 2bki h HIS 107 Cb 0.39 -0.07 0.00 0.00 1.55 0.00 0.00 27.41 29.28 2bki h HIS 107 CO 0.00 0.98 -0.81 0.28 -1.30 0.00 0.00 177.93 177.09 2bki h VAL 108 N 0.23 1.34 0.44 5.26 2.07 -1.56 -2.67 116.25 121.35 2bki h VAL 108 Ca -0.04 -2.13 -0.02 0.00 0.82 0.00 0.00 66.70 65.33 2bki h VAL 108 Cb 1.34 2.13 -0.00 0.00 -1.52 0.00 0.00 31.29 33.24 2bki h VAL 108 CO 0.13 0.65 -0.25 -0.03 0.02 0.00 0.00 177.57 178.09 2bki h MET 109 N 0.38 -0.62 -0.02 1.57 4.05 -1.45 -2.32 114.93 116.52 2bki h MET 109 Ca -0.05 0.04 -0.03 0.00 -0.28 0.00 0.00 59.70 59.38 2bki h MET 109 Cb 1.42 0.14 -0.00 0.00 -0.80 0.00 0.00 31.60 32.35 2bki h MET 109 CO 0.15 -0.41 -0.12 1.79 0.23 0.00 0.00 176.91 178.55 2bki h THR 110 N -0.64 1.10 0.00 -0.77 1.35 -1.49 -2.33 112.91 110.12 2bki h THR 110 Ca -0.05 -0.47 -0.07 0.00 -0.55 0.00 0.00 66.41 65.27 2bki h THR 110 Cb 0.52 1.22 -0.01 0.00 -1.73 0.00 0.00 68.15 68.15 2bki h THR 110 CO 0.06 0.14 -0.33 0.78 -0.25 0.00 0.00 175.52 175.92 2bki h ASN 111 N 0.03 0.00 0.44 5.36 -0.26 -1.18 -3.05 115.58 116.92 2bki h ASN 111 Ca 0.01 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.75 2bki h ASN 111 Cb 0.23 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.49 2bki h ASN 111 CO 0.02 0.33 -0.81 0.18 -1.06 0.00 0.00 177.43 176.09 2bki n LEU 112 N -3.34 0.64 -0.23 1.61 4.77 -0.90 -4.84 117.00 114.72 2bki n LEU 112 Ca 0.01 -0.05 0.00 0.00 -0.03 0.00 0.00 56.01 55.94 2bki n LEU 112 Cb 0.55 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.50 2bki n LEU 112 CO 0.36 0.09 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 2bki n GLY 113 N 1.43 0.76 2.88 -0.72 0.00 -0.94 -5.01 105.19 103.58 2bki n GLY 113 Ca 0.04 -0.50 -0.28 0.00 0.00 0.00 0.00 46.02 45.28 2bki n GLY 113 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2bki s GLU 114 N -1.34 1.38 -0.16 1.61 0.41 -0.92 -5.03 118.70 114.65 2bki s GLU 114 Ca 0.00 -0.45 -0.19 0.00 -0.41 0.00 0.00 54.97 53.92 2bki s GLU 114 Cb 0.00 -1.91 -0.04 0.00 -1.78 0.00 0.00 34.13 30.40 2bki s GLU 114 CO 0.00 -0.41 0.53 -1.59 -0.49 0.00 0.00 175.26 173.29 2bki s LYS 115 N 1.67 4.27 -0.17 1.61 -2.85 -1.26 -4.14 119.74 118.86 2bki s LYS 115 Ca 0.01 0.48 -0.30 0.00 -1.00 0.00 0.00 55.97 55.17 2bki s LYS 115 Cb -0.15 -3.51 0.12 0.00 -2.06 0.00 0.00 37.83 32.24 2bki s LYS 115 CO -0.08 -0.02 0.99 -0.48 0.10 0.00 0.00 175.35 175.86 2bki s LEU 116 N 1.21 -0.39 1.07 2.77 2.34 -1.26 -5.15 118.68 119.26 2bki s LEU 116 Ca 0.26 0.46 -0.13 0.00 0.06 0.00 0.00 54.13 54.79 2bki s LEU 116 Cb -0.15 1.89 0.23 0.00 -0.56 0.00 0.00 46.19 47.59 2bki s LEU 116 CO 0.11 -0.33 1.07 0.42 -1.06 0.00 0.00 176.35 176.55 2bki s THR 117 N -0.97 2.06 0.31 5.48 -4.23 -1.26 -4.89 115.64 112.14 2bki s THR 117 Ca -0.02 0.02 0.04 0.00 -1.18 0.00 0.00 61.69 60.55 2bki s THR 117 Cb -0.01 -2.32 0.10 0.00 1.34 0.00 0.00 72.50 71.60 2bki s THR 117 CO 0.01 -0.03 1.78 -2.24 -0.54 0.00 0.00 174.62 173.60 2bki h ASP 118 N -2.21 0.44 0.28 3.99 2.03 -2.02 -2.99 116.42 115.94 2bki h ASP 118 Ca -0.57 -0.13 -0.10 0.00 -0.73 0.00 0.00 57.03 55.50 2bki h ASP 118 Cb 1.33 -0.12 -0.01 0.00 -0.83 0.00 0.00 39.33 39.70 2bki h ASP 118 CO 0.54 0.64 -0.39 1.05 -1.03 0.00 0.00 179.24 180.06 2bki h GLU 119 N 0.40 0.15 -0.16 4.15 9.09 -2.00 -2.71 114.58 123.50 2bki h GLU 119 Ca 0.07 -0.07 -0.17 0.00 0.05 0.00 0.00 59.36 59.24 2bki h GLU 119 Cb 0.57 -0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.66 2bki h GLU 119 CO 0.04 0.52 -0.62 0.93 0.05 0.00 0.00 179.01 179.93 2bki h GLU 120 N 0.13 0.55 -0.45 1.06 5.08 -1.91 -2.84 114.58 116.20 2bki h GLU 120 Ca 0.01 -0.38 -0.03 0.00 -1.00 0.00 0.00 59.36 57.96 2bki h GLU 120 Cb 0.75 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.04 2bki h GLU 120 CO 0.06 1.00 0.15 0.28 -1.00 0.00 0.00 179.01 179.50 2bki h VAL 121 N 0.40 1.22 -0.16 3.13 2.07 -1.35 -2.68 116.25 118.89 2bki h VAL 121 Ca -0.01 -0.72 -0.04 0.00 0.82 0.00 0.00 66.70 66.75 2bki h VAL 121 Cb 1.19 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.78 2bki h VAL 121 CO 0.12 0.26 -0.09 0.44 0.02 0.00 0.00 177.57 178.32 2bki h ASP 122 N 0.59 0.22 -0.58 0.57 3.32 -1.49 -2.58 116.42 116.47 2bki h ASP 122 Ca 0.15 -0.04 -0.05 0.00 0.02 0.00 0.00 57.03 57.11 2bki h ASP 122 Cb 0.25 -0.06 -0.03 0.00 0.22 0.00 0.00 39.33 39.72 2bki h ASP 122 CO -0.01 0.34 0.18 -0.08 -1.72 0.00 0.00 179.24 177.95 2bki h GLU 123 N 0.23 0.95 0.35 3.56 4.81 -1.23 -1.93 114.58 121.32 2bki h GLU 123 Ca 0.05 -0.19 -0.02 0.00 -0.13 0.00 0.00 59.36 59.07 2bki h GLU 123 Cb 0.31 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.55 2bki h GLU 123 CO 0.02 0.82 -0.17 0.52 -0.73 0.00 0.00 179.01 179.47 2bki h MET 124 N 0.91 -0.45 -1.03 1.92 2.86 -1.22 -3.04 114.93 114.88 2bki h MET 124 Ca 0.20 0.03 0.27 0.00 -2.06 0.00 0.00 59.70 58.14 2bki h MET 124 Cb 0.29 0.10 -0.12 0.00 0.06 0.00 0.00 31.60 31.93 2bki h MET 124 CO -0.01 -0.13 0.62 0.82 1.06 0.00 0.00 176.91 179.27 2bki h ILE 125 N -0.87 0.48 -0.40 -1.22 5.03 -1.41 -1.76 117.51 117.37 2bki h ILE 125 Ca -0.05 -0.17 -0.12 0.00 -0.12 0.00 0.00 64.86 64.41 2bki h ILE 125 Cb 0.53 -0.04 -0.01 0.00 -3.03 0.00 0.00 36.82 34.27 2bki h ILE 125 CO 0.08 0.09 -0.22 -0.09 -0.68 0.00 0.00 178.15 177.32 2bki h ARG 126 N 0.48 0.79 -0.29 2.37 2.43 -1.30 -2.07 114.38 116.79 2bki h ARG 126 Ca 0.65 -0.32 -0.17 0.00 -0.81 0.00 0.00 59.98 59.34 2bki h ARG 126 Cb 1.41 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 30.92 2bki h ARG 126 CO -0.45 0.94 -0.47 0.93 -1.51 0.00 0.00 179.97 179.41 2bki h GLU 127 N 0.69 0.83 0.00 0.20 4.39 -1.21 -3.09 114.58 116.39 2bki h GLU 127 Ca 0.09 -0.50 -0.07 0.00 0.34 0.00 0.00 59.36 59.22 2bki h GLU 127 Cb 0.74 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.43 2bki h GLU 127 CO 0.06 1.14 -0.34 0.00 -1.16 0.00 0.00 179.01 178.71 2bki h ALA 128 N 0.68 1.16 -1.15 3.43 0.00 -1.50 -3.42 119.26 118.46 2bki h ALA 128 Ca 0.02 -0.31 -0.52 0.00 0.00 0.00 0.00 54.91 54.11 2bki h ALA 128 Cb 1.07 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 18.73 2bki h ALA 128 CO 0.11 0.42 1.23 0.34 0.00 0.00 0.00 179.25 181.35 2bki s ASP 129 N -6.55 6.04 -0.04 0.00 2.15 -0.78 -4.87 116.67 112.62 2bki s ASP 129 Ca -0.01 -0.86 -0.21 0.00 0.43 0.00 0.00 52.55 51.90 2bki s ASP 129 Cb 0.12 -2.56 -0.15 0.00 -0.30 0.00 0.00 42.92 40.04 2bki s ASP 129 CO 0.68 -1.91 0.90 0.40 -0.17 0.00 0.00 175.17 175.07 2bki h ILE 130 N 6.68 0.70 -0.00 4.11 5.03 -1.85 -3.35 117.51 128.83 2bki h ILE 130 Ca 0.00 -0.96 -0.14 0.00 -0.12 0.00 0.00 64.86 63.65 2bki h ILE 130 Cb 1.04 1.14 -0.02 0.00 -3.03 0.00 0.00 36.82 35.95 2bki h ILE 130 CO 1.33 0.17 -0.65 -2.24 -0.68 0.00 0.00 178.15 176.08 2bki h ASP 131 N -0.88 0.02 -0.20 1.72 3.04 -1.95 -3.48 116.42 114.69 2bki h ASP 131 Ca -0.03 -0.01 0.00 0.00 -3.24 0.00 0.00 57.03 53.74 2bki h ASP 131 Cb 0.51 -0.01 0.00 0.00 -1.04 0.00 0.00 39.33 38.79 2bki h ASP 131 CO 0.05 0.66 0.00 0.61 -2.04 0.00 0.00 179.24 178.52 2bki n GLY 132 N 0.33 0.54 0.32 7.15 0.00 -1.26 -5.03 105.19 107.24 2bki n GLY 132 Ca -0.01 -0.05 0.04 0.00 0.00 0.00 0.00 46.02 45.99 2bki n GLY 132 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2bki n ASP 133 N -0.08 2.54 -1.61 1.61 5.75 -1.26 -5.01 116.55 118.49 2bki n ASP 133 Ca 0.00 -2.18 -0.14 0.00 -0.01 0.00 0.00 54.79 52.46 2bki n ASP 133 Cb 0.05 -0.17 -0.00 0.00 -1.03 0.00 0.00 41.12 39.97 2bki n ASP 133 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2bki n GLY 134 N -0.21 -0.17 3.44 6.12 0.00 -1.26 -5.02 105.19 108.09 2bki n GLY 134 Ca 0.08 -0.30 -0.15 0.00 0.00 0.00 0.00 46.02 45.64 2bki n GLY 134 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2bki s GLN 135 N -4.76 0.81 -0.47 1.61 1.03 -1.26 -4.72 119.66 111.90 2bki s GLN 135 Ca 0.03 0.39 -0.16 0.00 0.04 0.00 0.00 55.36 55.65 2bki s GLN 135 Cb -0.01 0.38 0.06 0.00 0.03 0.00 0.00 33.01 33.47 2bki s GLN 135 CO 0.03 -0.19 0.43 0.08 -2.54 0.00 0.00 175.29 173.11 2bki s VAL 136 N -0.58 5.16 0.70 3.63 1.01 -0.79 -4.81 120.40 124.71 2bki s VAL 136 Ca -0.07 -0.86 -0.09 0.00 0.00 0.00 0.00 61.98 60.96 2bki s VAL 136 Cb -0.03 -4.13 0.04 0.00 0.00 0.00 0.00 36.38 32.26 2bki s VAL 136 CO 0.05 -0.58 1.05 0.54 0.00 0.00 0.00 175.10 176.15 2bki s ASN 137 N 2.47 5.13 0.34 3.32 2.20 -1.26 -1.69 114.94 125.44 2bki s ASN 137 Ca 0.07 0.80 0.03 0.00 -0.94 0.00 0.00 52.86 52.81 2bki s ASN 137 Cb -0.22 -1.54 0.64 0.00 -2.00 0.00 0.00 41.25 38.12 2bki s ASN 137 CO 0.08 -1.46 1.96 0.22 -2.94 0.00 0.00 177.10 174.97 2bki h TYR 138 N -0.62 0.86 -0.98 1.54 3.20 -1.98 -1.23 116.97 117.77 2bki h TYR 138 Ca -0.45 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.44 2bki h TYR 138 Cb 1.29 -0.29 -0.05 0.00 1.54 0.00 0.00 36.73 39.22 2bki h TYR 138 CO 0.41 0.49 0.62 0.93 -1.64 0.00 0.00 178.16 178.98 2bki h GLU 139 N 0.88 1.31 0.02 1.82 4.39 -1.94 -2.49 114.58 118.57 2bki h GLU 139 Ca 0.31 -0.10 -0.22 0.00 0.34 0.00 0.00 59.36 59.70 2bki h GLU 139 Cb 0.11 -0.29 -0.02 0.00 -0.10 0.00 0.00 28.75 28.45 2bki h GLU 139 CO -0.09 0.89 -1.01 0.93 -1.16 0.00 0.00 179.01 178.56 2bki h GLU 140 N 1.34 0.05 -0.21 2.33 5.08 -1.66 -3.22 114.58 118.29 2bki h GLU 140 Ca 0.36 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.63 2bki h GLU 140 Cb -0.11 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 2bki h GLU 140 CO -0.07 1.01 0.10 0.35 -1.00 0.00 0.00 179.01 179.41 2bki h PHE 141 N 0.02 0.28 0.01 4.33 3.57 -0.82 -2.75 116.94 121.57 2bki h PHE 141 Ca -0.03 0.00 -0.25 0.00 3.53 0.00 0.00 57.97 61.22 2bki h PHE 141 Cb 1.76 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 40.37 2bki h PHE 141 CO 0.01 0.21 -1.31 0.28 -2.23 0.00 0.00 178.31 175.27 2bki h VAL 142 N 0.29 1.34 0.00 1.41 2.07 -1.53 -2.71 116.25 117.12 2bki h VAL 142 Ca 0.08 -3.10 -0.08 0.00 0.82 0.00 0.00 66.70 64.42 2bki h VAL 142 Cb 0.03 2.69 -0.01 0.00 -1.52 0.00 0.00 31.29 32.48 2bki h VAL 142 CO -0.01 0.78 -0.38 1.56 0.02 0.00 0.00 177.57 179.55 2bki h GLN 143 N 0.01 0.00 0.06 1.57 4.20 -1.53 -1.52 115.11 117.90 2bki h GLN 143 Ca -0.13 0.00 -0.15 0.00 0.06 0.00 0.00 58.65 58.42 2bki h GLN 143 Cb 1.89 0.00 0.02 0.00 0.30 0.00 0.00 27.48 29.68 2bki h GLN 143 CO 0.12 0.38 -0.63 1.98 -0.67 0.00 0.00 178.83 180.00 2bki h MET 144 N 0.00 0.33 -0.44 1.46 4.05 -1.54 -2.40 114.93 116.38 2bki h MET 144 Ca -0.00 -0.43 0.08 0.00 -0.28 0.00 0.00 59.70 59.07 2bki h MET 144 Cb 0.86 0.14 -0.07 0.00 -0.80 0.00 0.00 31.60 31.74 2bki h MET 144 CO 0.05 1.14 0.03 1.98 0.23 0.00 0.00 176.91 180.33 2bki h MET 145 N -0.27 0.14 0.12 0.39 1.85 -1.35 -3.18 114.93 112.62 2bki h MET 145 Ca -0.10 -0.01 -0.01 0.00 -0.61 0.00 0.00 59.70 58.98 2bki h MET 145 Cb 1.41 -0.03 0.00 0.00 0.43 0.00 0.00 31.60 33.41 2bki h MET 145 CO 0.12 0.09 -0.06 1.15 -0.40 0.00 0.00 176.91 177.82 2bki h THR 146 N 0.14 1.06 0.00 -0.77 2.02 -1.38 -3.51 112.91 110.46 2bki h THR 146 Ca 0.22 -1.18 0.00 0.00 0.77 0.00 0.00 66.41 66.22 2bki h THR 146 Cb 0.31 1.75 0.00 0.00 -1.74 0.00 0.00 68.15 68.47 2bki h THR 146 CO -0.34 0.26 0.00 0.00 0.37 0.00 0.00 175.52 175.81