#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2klo s ALA 2 N 0.00 2.54 0.29 0.55 0.00 -1.26 -5.13 121.76 118.75 2klo s ALA 2 Ca 0.00 -1.29 -0.05 0.00 0.00 0.00 0.00 51.96 50.63 2klo s ALA 2 Cb 0.00 -2.63 -0.01 0.00 0.00 0.00 0.00 23.12 20.48 2klo s ALA 2 CO 0.00 -2.22 0.39 0.00 0.00 0.00 0.00 175.76 173.93 2klo s ALA 3 N -3.73 0.63 -0.42 0.00 0.00 -1.26 -5.14 121.76 111.84 2klo s ALA 3 Ca 0.72 -1.41 0.05 0.00 0.00 0.00 0.00 51.96 51.32 2klo s ALA 3 Cb -0.04 1.20 0.18 0.00 0.00 0.00 0.00 23.12 24.46 2klo s ALA 3 CO 0.51 -0.76 0.40 0.43 0.00 0.00 0.00 175.76 176.34 2klo n SER 4 N -0.89 -0.70 -4.67 0.00 7.64 -1.26 -5.11 113.62 108.64 2klo n SER 4 Ca 0.01 -2.46 -0.42 0.00 1.01 0.00 0.00 58.87 57.01 2klo n SER 4 Cb 0.63 -0.35 -0.03 0.00 -1.01 0.00 0.00 64.21 63.45 2klo n SER 4 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2klo s PRO 5 N 0.00 4.19 0.46 1.43 0.04 -1.26 -4.96 135.00 134.90 2klo s PRO 5 Ca 0.33 2.20 -0.24 0.00 0.04 0.00 0.00 61.00 63.33 2klo s PRO 5 Cb 0.05 -3.90 -0.08 0.00 0.04 0.00 0.00 34.50 30.61 2klo s PRO 5 CO -0.18 -0.81 1.29 0.43 0.04 0.00 0.00 177.00 177.77 2klo n SER 6 N 6.79 2.56 -4.54 6.66 7.64 -1.26 -4.92 113.62 126.55 2klo n SER 6 Ca 0.17 1.06 -0.42 0.00 1.01 0.00 0.00 58.87 60.69 2klo n SER 6 Cb 0.42 -1.52 -0.03 0.00 -1.01 0.00 0.00 64.21 62.07 2klo n SER 6 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2klo s ALA 7 N -1.24 2.90 0.03 -0.43 0.00 -1.26 -5.00 121.76 116.76 2klo s ALA 7 Ca 0.64 -1.32 0.04 0.00 0.00 0.00 0.00 51.96 51.32 2klo s ALA 7 Cb -0.48 -4.10 -0.02 0.00 0.00 0.00 0.00 23.12 18.52 2klo s ALA 7 CO 0.55 -3.00 -0.12 -0.51 0.00 0.00 0.00 175.76 172.68 2klo s LEU 8 N 5.15 2.15 -0.29 0.00 1.43 -1.26 -5.06 118.68 120.80 2klo s LEU 8 Ca 0.34 -0.41 0.19 0.00 -1.03 0.00 0.00 54.13 53.22 2klo s LEU 8 Cb -0.10 -0.52 0.49 0.00 0.03 0.00 0.00 46.19 46.09 2klo s LEU 8 CO 0.17 0.02 1.08 0.29 0.23 0.00 0.00 176.35 178.14 2klo n LYS 9 N 2.03 1.88 -3.09 1.70 4.01 -1.26 -5.01 118.16 118.43 2klo n LYS 9 Ca -0.18 -3.57 0.05 0.00 -0.51 0.00 0.00 58.31 54.10 2klo n LYS 9 Cb 0.55 -1.62 0.00 0.00 -0.51 0.00 0.00 35.03 33.45 2klo n LYS 9 CO 0.00 0.00 0.00 0.20 -1.11 0.00 0.00 177.40 176.49 2klo s GLY 10 N -3.59 -1.07 -0.02 0.72 0.00 -1.26 -5.17 107.32 96.93 2klo s GLY 10 Ca 0.31 1.86 -0.26 0.00 0.00 0.00 0.00 44.72 46.63 2klo s GLY 10 CO -0.02 4.11 0.58 0.54 0.00 0.00 0.00 173.10 178.32 2klo s VAL 11 N 2.75 0.02 -0.84 1.40 0.11 -1.26 -5.07 120.40 117.51 2klo s VAL 11 Ca 0.24 -0.12 -0.08 0.00 -2.93 0.00 0.00 61.98 59.09 2klo s VAL 11 Cb -0.01 -0.92 -0.17 0.00 -1.53 0.00 0.00 36.38 33.74 2klo s VAL 11 CO -0.21 -0.07 3.27 -1.20 -3.33 0.00 0.00 175.10 173.55 2klo n SER 12 N 0.86 7.07 0.23 3.54 7.64 -1.26 -4.69 113.62 127.01 2klo n SER 12 Ca -0.19 -2.55 -0.12 0.00 1.01 0.00 0.00 58.87 57.02 2klo n SER 12 Cb 0.58 -1.48 -0.06 0.00 -1.01 0.00 0.00 64.21 62.23 2klo n SER 12 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 2klo h GLN 13 N 4.02 -0.61 0.00 1.43 4.20 -1.98 -2.25 115.11 119.91 2klo h GLN 13 Ca 0.54 0.04 0.00 0.00 0.06 0.00 0.00 58.65 59.30 2klo h GLN 13 Cb 0.87 0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.79 2klo h GLN 13 CO 1.04 -0.32 0.00 0.00 -0.67 0.00 0.00 178.83 178.87 2klo n ALA 14 N -2.64 1.24 -0.07 3.87 0.00 -1.26 -1.87 120.51 119.77 2klo n ALA 14 Ca -0.09 -0.02 -0.05 0.00 0.00 0.00 0.00 53.44 53.28 2klo n ALA 14 Cb 0.29 -1.07 -0.02 0.00 0.00 0.00 0.00 19.45 18.66 2klo n ALA 14 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2klo n LEU 15 N -1.45 1.80 0.31 0.00 7.94 -1.21 -4.40 117.00 119.98 2klo n LEU 15 Ca 0.01 0.63 0.18 0.00 -1.11 0.00 0.00 56.01 55.73 2klo n LEU 15 Cb 0.05 -0.87 1.02 0.00 0.53 0.00 0.00 43.42 44.15 2klo n LEU 15 CO 0.04 -0.47 1.15 -0.07 -1.11 0.00 0.00 177.39 176.93 2klo h LEU 16 N -1.00 0.00 -1.55 -1.96 4.07 -1.13 -2.54 115.31 111.20 2klo h LEU 16 Ca 0.00 0.00 0.05 0.00 0.08 0.00 0.00 57.88 58.01 2klo h LEU 16 Cb 0.52 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.23 2klo h LEU 16 CO 0.00 0.00 0.36 1.05 -1.08 0.00 0.00 178.44 178.77 2klo h GLU 17 N 0.00 0.56 0.04 1.13 -0.00 -1.58 -1.70 114.58 113.03 2klo h GLU 17 Ca 0.01 -0.03 -0.20 0.00 -0.00 0.00 0.00 59.36 59.14 2klo h GLU 17 Cb 0.08 -0.13 0.02 0.00 -0.00 0.00 0.00 28.75 28.73 2klo h GLU 17 CO -0.00 0.37 -0.80 0.00 -0.00 0.00 0.00 179.01 178.58 2klo h ARG 18 N 0.58 0.48 0.68 1.06 3.08 -1.70 -2.97 114.38 115.58 2klo h ARG 18 Ca 0.23 -0.56 -0.03 0.00 0.07 0.00 0.00 59.98 59.69 2klo h ARG 18 Cb 0.18 0.17 -0.00 0.00 0.08 0.00 0.00 29.97 30.40 2klo h ARG 18 CO -0.06 1.20 -0.43 0.82 -1.07 0.00 0.00 179.97 180.43 2klo h ILE 19 N -0.00 0.00 -0.86 2.04 2.04 -1.53 -2.85 117.51 116.34 2klo h ILE 19 Ca -0.11 0.00 0.09 0.00 1.00 0.00 0.00 64.86 65.84 2klo h ILE 19 Cb 1.51 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 37.53 2klo h ILE 19 CO 0.16 0.00 0.56 0.08 0.00 0.00 0.00 178.15 178.94 2klo h ARG 20 N -1.05 0.84 -0.88 2.37 0.11 -1.47 -1.59 114.38 112.73 2klo h ARG 20 Ca -0.09 -0.05 0.11 0.00 0.10 0.00 0.00 59.98 60.05 2klo h ARG 20 Cb 0.84 -0.19 -0.06 0.00 1.11 0.00 0.00 29.97 31.67 2klo h ARG 20 CO 0.08 0.55 0.57 0.00 0.10 0.00 0.00 179.97 181.27 2klo h ALA 21 N 1.56 1.70 -0.63 0.08 0.00 -1.33 -0.35 119.26 120.29 2klo h ALA 21 Ca 0.39 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.30 2klo h ALA 21 Cb 0.37 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 2klo h ALA 21 CO -0.16 0.10 0.37 0.87 0.00 0.00 0.00 179.25 180.44 2klo h LYS 22 N 0.81 0.86 -0.03 0.00 1.57 -1.11 -1.19 116.57 117.48 2klo h LYS 22 Ca 0.42 -0.08 -0.20 0.00 -1.87 0.00 0.00 60.65 58.92 2klo h LYS 22 Cb 0.49 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.62 2klo h LYS 22 CO -0.18 0.61 -0.83 0.93 -0.57 0.00 0.00 179.45 179.41 2klo h GLU 23 N 0.87 0.37 -0.23 3.15 4.39 -1.20 -3.20 114.58 118.74 2klo h GLU 23 Ca 0.23 -0.35 -0.03 0.00 0.34 0.00 0.00 59.36 59.54 2klo h GLU 23 Cb -0.02 0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.71 2klo h GLU 23 CO -0.04 1.01 -0.01 0.28 -1.16 0.00 0.00 179.01 179.09 2klo h VAL 24 N 0.23 1.15 0.00 3.13 2.07 -0.07 -1.47 116.25 121.29 2klo h VAL 24 Ca -0.05 -0.60 -0.05 0.00 0.82 0.00 0.00 66.70 66.83 2klo h VAL 24 Cb 1.44 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 32.20 2klo h VAL 24 CO 0.14 0.20 -0.22 1.56 0.02 0.00 0.00 177.57 179.27 2klo h GLN 25 N 0.33 0.00 0.00 1.57 4.20 -1.25 0.15 115.11 120.11 2klo h GLN 25 Ca 0.08 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.78 2klo h GLN 25 Cb 0.24 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.02 2klo h GLN 25 CO 0.01 0.22 -0.02 0.87 -0.67 0.00 0.00 178.83 179.23 2klo h LYS 26 N 0.00 0.00 0.00 1.46 1.79 -1.44 -3.34 116.57 115.04 2klo h LYS 26 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2klo h LYS 26 Cb 0.54 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.19 2klo h LYS 26 CO 0.03 0.33 0.00 1.04 -1.08 0.00 0.00 179.45 179.77 2klo n GLN 27 N -4.72 0.13 -0.07 3.15 6.02 -0.64 -2.93 117.38 118.32 2klo n GLN 27 Ca -0.04 0.59 0.05 0.00 -0.01 0.00 0.00 57.00 57.60 2klo n GLN 27 Cb 0.16 -1.89 0.41 0.00 1.02 0.00 0.00 30.24 29.93 2klo n GLN 27 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 2klo h LEU 28 N 0.00 0.53 -3.58 1.08 3.38 -0.82 -3.47 115.31 112.44 2klo h LEU 28 Ca 0.00 -0.01 -0.34 0.00 0.09 0.00 0.00 57.88 57.62 2klo h LEU 28 Cb 0.05 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 2klo h LEU 28 CO 0.00 0.37 -0.61 0.00 0.09 0.00 0.00 178.44 178.28 2klo n ALA 29 N -2.47 -1.98 -3.24 1.53 0.00 -1.15 -4.92 120.51 108.27 2klo n ALA 29 Ca 0.06 -0.31 -0.13 0.00 0.00 0.00 0.00 53.44 53.07 2klo n ALA 29 Cb 0.14 -1.23 -0.02 0.00 0.00 0.00 0.00 19.45 18.35 2klo n ALA 29 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2klo s ARG 30 N -5.80 2.05 0.00 0.00 3.52 -1.26 -5.19 118.95 112.26 2klo s ARG 30 Ca 0.22 -1.64 0.00 0.00 -0.13 0.00 0.00 55.73 54.18 2klo s ARG 30 Cb -0.12 0.51 0.00 0.00 -1.56 0.00 0.00 34.95 33.78 2klo s ARG 30 CO 0.56 -0.89 0.00 -1.33 -0.81 0.00 0.00 175.30 172.83 2klo n MET 31 N -0.56 0.00 -2.71 5.12 2.81 -1.26 -5.09 117.12 115.43 2klo n MET 31 Ca -0.03 0.00 -0.04 0.00 -1.81 0.00 0.00 57.70 55.82 2klo n MET 31 Cb 0.61 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.12 2klo n MET 31 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 2klo n THR 32 N 0.00-11.01 -2.39 2.03 -1.04 -1.26 -5.00 114.28 95.61 2klo n THR 32 Ca 0.00 1.27 -0.35 0.00 -2.04 0.00 0.00 64.05 62.93 2klo n THR 32 Cb 0.00 -6.95 -0.02 0.00 -1.82 0.00 0.00 70.33 61.54 2klo n THR 32 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2klo s ARG 33 N -2.05 3.65 0.38 -2.82 1.70 -1.26 -4.91 118.95 113.64 2klo s ARG 33 Ca 0.12 1.53 0.00 0.00 -0.47 0.00 0.00 55.73 56.91 2klo s ARG 33 Cb -0.03 -2.14 0.00 0.00 -0.57 0.00 0.00 34.95 32.21 2klo s ARG 33 CO 0.73 -0.59 0.00 0.00 -1.08 0.00 0.00 175.30 174.36 2klo h PRO 35 N 0.00 0.00 0.00 0.00 0.13 -2.03 -2.97 132.00 127.13 2klo h PRO 35 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2klo h PRO 35 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2klo h PRO 35 CO 0.00 0.17 0.03 0.39 -0.23 0.00 0.00 178.00 178.36 2klo n GLU 36 N -3.75 0.03 0.24 0.86 -0.58 -1.26 -1.63 120.64 114.56 2klo n GLU 36 Ca -0.02 0.50 0.07 0.00 -0.42 0.00 0.00 57.16 57.30 2klo n GLU 36 Cb 0.28 -1.63 0.60 0.00 -0.57 0.00 0.00 31.44 30.12 2klo n GLU 36 CO 0.00 0.00 0.00 0.37 -0.48 0.00 0.00 177.13 177.02 2klo h GLN 37 N 0.00 0.02 -0.79 3.49 4.15 -1.92 -2.64 115.11 117.42 2klo h GLN 37 Ca 0.00 -0.00 0.18 0.00 0.77 0.00 0.00 58.65 59.60 2klo h GLN 37 Cb 0.07 -0.00 -0.14 0.00 0.21 0.00 0.00 27.48 27.61 2klo h GLN 37 CO 0.00 0.05 -0.03 1.49 -1.93 0.00 0.00 178.83 178.41 2klo h GLU 38 N 0.02 0.07 -0.85 1.69 4.57 -1.59 0.12 114.58 118.60 2klo h GLU 38 Ca 0.00 -0.00 0.18 0.00 -1.18 0.00 0.00 59.36 58.36 2klo h GLU 38 Cb 0.07 -0.02 -0.06 0.00 -0.16 0.00 0.00 28.75 28.58 2klo h GLU 38 CO 0.00 0.05 0.57 1.25 -1.18 0.00 0.00 179.01 179.70 2klo h LEU 39 N 0.07 0.41 -0.01 1.64 5.85 -1.72 0.33 115.31 121.88 2klo h LEU 39 Ca 0.43 0.04 -0.10 0.00 0.84 0.00 0.00 57.88 59.08 2klo h LEU 39 Cb 0.76 -0.04 0.01 0.00 0.37 0.00 0.00 40.66 41.75 2klo h LEU 39 CO -0.73 0.18 -0.40 0.03 -0.34 0.00 0.00 178.44 177.19 2klo h ARG 40 N 0.42 0.29 -0.30 1.25 -0.00 -1.16 -2.69 114.38 112.20 2klo h ARG 40 Ca 0.44 -0.30 0.02 0.00 -0.50 0.00 0.00 59.98 59.64 2klo h ARG 40 Cb 1.04 0.08 -0.03 0.00 0.00 0.00 0.00 29.97 31.07 2klo h ARG 40 CO -0.16 0.99 0.14 -0.07 0.00 0.00 0.00 179.97 180.87 2klo h LEU 41 N -0.29 0.21 -0.23 3.04 3.38 -0.78 -1.64 115.31 119.01 2klo h LEU 41 Ca -0.05 0.02 0.05 0.00 0.09 0.00 0.00 57.88 57.99 2klo h LEU 41 Cb 1.12 -0.02 -0.07 0.00 0.09 0.00 0.00 40.66 41.77 2klo h LEU 41 CO 0.08 0.16 -0.39 -0.61 0.09 0.00 0.00 178.44 177.76 2klo h GLN 42 N 0.30 -0.39 -0.43 1.13 4.15 -0.48 0.98 115.11 120.36 2klo h GLN 42 Ca 0.12 0.03 -0.10 0.00 0.77 0.00 0.00 58.65 59.47 2klo h GLN 42 Cb 0.05 0.09 -0.02 0.00 0.21 0.00 0.00 27.48 27.81 2klo h GLN 42 CO -0.09 -0.26 -0.14 0.07 -1.93 0.00 0.00 178.83 176.48 2klo h ARG 43 N -0.41 0.80 0.00 1.69 0.11 -1.30 -1.89 114.38 113.39 2klo h ARG 43 Ca 0.11 -0.28 0.00 0.00 0.10 0.00 0.00 59.98 59.90 2klo h ARG 43 Cb 0.59 -0.06 0.00 0.00 1.11 0.00 0.00 29.97 31.61 2klo h ARG 43 CO -0.45 0.90 0.00 -0.07 0.10 0.00 0.00 179.97 180.45 2klo h LEU 44 N 0.72 0.00 0.00 0.08 3.38 -0.26 -2.86 115.31 116.37 2klo h LEU 44 Ca 0.12 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 2klo h LEU 44 Cb 0.63 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.38 2klo h LEU 44 CO 0.04 0.00 -1.78 -0.62 0.09 0.00 0.00 178.44 176.17 2klo n GLU 45 N -2.80 0.65 0.00 1.13 -0.58 0.23 -4.41 120.64 114.85 2klo n GLU 45 Ca 0.01 -0.11 0.09 0.00 -0.42 0.00 0.00 57.16 56.73 2klo n GLU 45 Cb 0.25 -1.60 0.42 0.00 -0.57 0.00 0.00 31.44 29.95 2klo n GLU 45 CO 0.00 0.00 0.00 -2.13 -0.48 0.00 0.00 177.13 174.52 2klo n ARG 46 N -2.39 0.10 -0.15 3.49 3.00 -0.74 -4.21 116.66 115.77 2klo n ARG 46 Ca -0.05 0.16 -0.12 0.00 -0.00 0.00 0.00 57.85 57.85 2klo n ARG 46 Cb 0.60 -1.50 -0.07 0.00 0.00 0.00 0.00 32.46 31.49 2klo n ARG 46 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.63 177.56 2klo h LEU 47 N 0.00 -1.67 -2.72 6.15 3.38 -1.77 0.16 115.31 118.83 2klo h LEU 47 Ca 0.00 0.24 -0.00 0.00 0.09 0.00 0.00 57.88 58.21 2klo h LEU 47 Cb 0.26 0.71 -0.00 0.00 0.09 0.00 0.00 40.66 41.72 2klo h LEU 47 CO 0.00 -0.38 -0.01 1.55 0.09 0.00 0.00 178.44 179.69 2klo h PRO 48 N -0.35 0.00 -0.00 1.13 0.13 -1.93 -2.02 132.00 128.96 2klo h PRO 48 Ca 0.11 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 65.11 2klo h PRO 48 Cb 0.59 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.73 2klo h PRO 48 CO -0.61 0.01 -0.53 1.49 -0.23 0.00 0.00 178.00 178.13 2klo h GLU 49 N 0.00 0.36 -0.33 0.86 4.57 -1.27 -2.44 114.58 116.33 2klo h GLU 49 Ca -0.00 -0.39 0.04 0.00 -1.18 0.00 0.00 59.36 57.84 2klo h GLU 49 Cb 0.05 0.11 -0.04 0.00 -0.16 0.00 0.00 28.75 28.70 2klo h GLU 49 CO 0.00 1.07 0.08 -0.07 -1.18 0.00 0.00 179.01 178.90 2klo h LEU 50 N -0.19 0.04 -0.44 1.64 -0.00 -0.62 -0.27 115.31 115.47 2klo h LEU 50 Ca -0.07 0.05 -0.03 0.00 -0.00 0.00 0.00 57.88 57.83 2klo h LEU 50 Cb 1.25 0.06 -0.02 0.00 -0.00 0.00 0.00 40.66 41.95 2klo h LEU 50 CO 0.10 0.06 0.16 0.00 -0.00 0.00 0.00 178.44 178.76 2klo h ALA 51 N 1.23 0.57 -0.28 1.53 0.00 -1.56 -0.66 119.26 120.09 2klo h ALA 51 Ca 0.15 -0.16 0.07 0.00 0.00 0.00 0.00 54.91 54.97 2klo h ALA 51 Cb 0.16 -0.17 -0.07 0.00 0.00 0.00 0.00 17.79 17.71 2klo h ALA 51 CO -0.19 0.20 -0.18 0.00 0.00 0.00 0.00 179.25 179.08 2klo h ARG 52 N 0.56 -0.14 0.10 0.00 3.08 -0.85 0.28 114.38 117.42 2klo h ARG 52 Ca 0.14 0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.20 2klo h ARG 52 Cb 0.22 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.31 2klo h ARG 52 CO -0.01 -0.10 -0.05 0.28 -1.07 0.00 0.00 179.97 179.03 2klo h VAL 53 N -0.15 0.98 -0.46 2.04 2.07 -0.89 -2.16 116.25 117.68 2klo h VAL 53 Ca 0.15 -0.31 0.09 0.00 0.82 0.00 0.00 66.70 67.46 2klo h VAL 53 Cb 0.38 1.18 -0.09 0.00 -1.52 0.00 0.00 31.29 31.24 2klo h VAL 53 CO -0.37 0.08 -0.17 0.25 0.02 0.00 0.00 177.57 177.38 2klo h LEU 54 N -0.28 -0.58 -0.95 2.57 5.85 -0.73 0.37 115.31 121.56 2klo h LEU 54 Ca -0.01 0.16 0.03 0.00 0.84 0.00 0.00 57.88 58.90 2klo h LEU 54 Cb 0.23 0.34 -0.06 0.00 0.37 0.00 0.00 40.66 41.55 2klo h LEU 54 CO 0.02 -0.20 0.62 -0.09 -0.34 0.00 0.00 178.44 178.45 2klo h ARG 55 N -0.06 1.18 -0.67 1.25 1.12 -0.89 -1.85 114.38 114.46 2klo h ARG 55 Ca 0.22 -0.07 -0.01 0.00 -1.11 0.00 0.00 59.98 59.01 2klo h ARG 55 Cb 0.40 -0.27 -0.03 0.00 -0.01 0.00 0.00 29.97 30.07 2klo h ARG 55 CO -0.51 0.78 0.38 -0.97 -3.11 0.00 0.00 179.97 176.54 2klo h ASN 56 N 1.21 0.82 0.18 -3.80 -1.24 -0.30 -0.37 115.58 112.09 2klo h ASN 56 Ca 0.38 -0.08 -0.01 0.00 0.71 0.00 0.00 56.30 57.30 2klo h ASN 56 Cb -0.01 -0.21 0.00 0.00 0.73 0.00 0.00 38.32 38.83 2klo h ASN 56 CO -0.12 0.66 -0.09 0.58 -1.29 0.00 0.00 177.43 177.18 2klo h VAL 57 N 0.91 0.92 -0.75 2.57 2.07 -0.54 -1.25 116.25 120.19 2klo h VAL 57 Ca 0.24 -0.48 -0.03 0.00 0.82 0.00 0.00 66.70 67.25 2klo h VAL 57 Cb 0.01 1.21 -0.03 0.00 -1.52 0.00 0.00 31.29 30.95 2klo h VAL 57 CO -0.04 0.11 0.36 -0.26 0.02 0.00 0.00 177.57 177.76 2klo h PHE 58 N -0.47 1.08 -0.56 1.57 -1.00 -1.29 -0.55 116.94 115.72 2klo h PHE 58 Ca -0.02 -0.05 -0.10 0.00 2.81 0.00 0.00 57.97 60.60 2klo h PHE 58 Cb 0.36 -0.33 -0.02 0.00 3.61 0.00 0.00 35.95 39.57 2klo h PHE 58 CO 0.00 0.79 -0.06 -0.24 -1.61 0.00 0.00 178.31 177.19 2klo h VAL 59 N 1.05 1.27 -0.74 -0.55 3.04 -1.04 -2.77 116.25 116.51 2klo h VAL 59 Ca 0.26 -1.21 -0.06 0.00 -1.01 0.00 0.00 66.70 64.68 2klo h VAL 59 Cb 0.12 0.90 -0.03 0.00 -2.01 0.00 0.00 31.29 30.27 2klo h VAL 59 CO -0.03 0.43 0.25 -1.28 -1.01 0.00 0.00 177.57 175.92 2klo h SER 60 N 0.91 1.07 0.25 3.17 0.87 -0.75 -2.17 113.55 116.89 2klo h SER 60 Ca 0.15 -0.19 0.00 0.00 -1.23 0.00 0.00 61.79 60.52 2klo h SER 60 Cb 0.61 -0.28 0.00 0.00 -0.44 0.00 0.00 62.40 62.30 2klo h SER 60 CO 0.04 0.98 0.00 1.21 -0.53 0.00 0.00 176.83 178.53 2klo n GLU 61 N -4.26 0.05 -1.31 2.24 4.07 -0.26 -4.85 120.64 116.33 2klo n GLU 61 Ca 0.06 0.29 -0.11 0.00 -0.06 0.00 0.00 57.16 57.34 2klo n GLU 61 Cb 0.22 -1.50 -0.05 0.00 -0.06 0.00 0.00 31.44 30.05 2klo n GLU 61 CO 0.00 0.00 0.00 -2.13 -0.06 0.00 0.00 177.13 174.94 2klo n ARG 62 N -1.41 -1.70 -3.77 5.31 3.00 -0.82 -4.94 116.66 112.34 2klo n ARG 62 Ca 0.03 0.88 -0.14 0.00 -0.00 0.00 0.00 57.85 58.62 2klo n ARG 62 Cb 0.09 -5.28 -0.14 0.00 0.00 0.00 0.00 32.46 27.12 2klo n ARG 62 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.63 176.04 2klo s LYS 63 N -2.92 0.08 0.00 -0.14 -2.85 -1.23 -5.03 119.74 107.65 2klo s LYS 63 Ca 0.00 0.31 0.26 0.00 -1.00 0.00 0.00 55.97 55.54 2klo s LYS 63 Cb 0.00 -0.15 1.51 0.00 -2.06 0.00 0.00 37.83 37.13 2klo s LYS 63 CO 0.00 -0.14 1.90 -0.35 0.10 0.00 0.00 175.35 176.86 2klo n PRO 64 N 4.01 0.73 -4.06 1.78 -0.04 -1.26 -4.65 135.00 131.52 2klo n PRO 64 Ca -0.24 0.01 -0.31 0.00 -0.04 0.00 0.00 63.50 62.91 2klo n PRO 64 Cb 0.53 -1.50 -0.16 0.00 -0.04 0.00 0.00 33.50 32.33 2klo n PRO 64 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2klo s ALA 65 N -2.11 2.11 0.05 0.55 0.00 -1.26 -1.02 121.76 120.07 2klo s ALA 65 Ca 0.36 -1.14 0.09 0.00 0.00 0.00 0.00 51.96 51.27 2klo s ALA 65 Cb 0.18 -1.18 -0.03 0.00 0.00 0.00 0.00 23.12 22.08 2klo s ALA 65 CO 0.32 -0.51 -0.24 -0.51 0.00 0.00 0.00 175.76 174.81 2klo s LEU 66 N 1.37 2.29 0.54 0.00 2.01 -0.57 -4.95 118.68 119.37 2klo s LEU 66 Ca 0.03 -0.55 -0.20 0.00 0.01 0.00 0.00 54.13 53.42 2klo s LEU 66 Cb -0.14 -1.35 -0.06 0.00 0.01 0.00 0.00 46.19 44.65 2klo s LEU 66 CO -0.11 0.26 1.14 -0.89 1.01 0.00 0.00 176.35 177.76 2klo s THR 67 N -0.84 3.09 0.21 5.49 2.01 -1.26 -0.29 115.64 124.04 2klo s THR 67 Ca 0.13 0.70 -0.09 0.00 0.31 0.00 0.00 61.69 62.73 2klo s THR 67 Cb -0.10 -3.29 0.15 0.00 0.01 0.00 0.00 72.50 69.27 2klo s THR 67 CO 0.03 -0.13 1.75 -0.03 -0.69 0.00 0.00 174.62 175.55 2klo h MET 68 N 1.26 0.43 0.12 4.92 4.05 -0.97 -0.44 114.93 124.30 2klo h MET 68 Ca -0.50 -0.03 0.02 0.00 -0.28 0.00 0.00 59.70 58.91 2klo h MET 68 Cb 1.26 -0.10 -0.04 0.00 -0.80 0.00 0.00 31.60 31.93 2klo h MET 68 CO 0.57 0.28 -0.30 1.49 0.23 0.00 0.00 176.91 179.18 2klo h GLU 69 N 0.44 -0.51 -0.26 0.39 4.81 -1.92 0.41 114.58 117.94 2klo h GLU 69 Ca 0.31 0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.58 2klo h GLU 69 Cb 0.37 0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.86 2klo h GLU 69 CO -0.30 -0.34 0.16 0.28 -0.73 0.00 0.00 179.01 178.08 2klo h VAL 70 N -0.53 1.10 -0.04 0.32 2.07 -1.76 0.21 116.25 117.63 2klo h VAL 70 Ca 0.03 -0.24 -0.09 0.00 0.82 0.00 0.00 66.70 67.21 2klo h VAL 70 Cb 0.56 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 31.10 2klo h VAL 70 CO -0.18 0.10 -0.41 1.62 0.02 0.00 0.00 177.57 178.72 2klo h VAL 71 N 0.33 1.30 0.20 2.57 3.04 -0.93 -2.38 116.25 120.38 2klo h VAL 71 Ca 0.09 -1.46 -0.01 0.00 -1.01 0.00 0.00 66.70 64.31 2klo h VAL 71 Cb 0.02 1.74 0.00 0.00 -2.01 0.00 0.00 31.29 31.04 2klo h VAL 71 CO -0.02 0.42 -0.10 0.00 -1.01 0.00 0.00 177.57 176.87 2klo h ALA 73 N -0.09 0.88 0.00 0.00 0.00 -0.98 -0.07 119.26 119.00 2klo h ALA 73 Ca -0.03 0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 2klo h ALA 73 Cb 0.50 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2klo h ALA 73 CO 0.04 -0.10 -0.19 0.00 0.00 0.00 0.00 179.25 179.01 2klo h ARG 74 N 0.53 0.00 0.05 0.00 2.47 -1.34 -0.66 114.38 115.43 2klo h ARG 74 Ca 0.32 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 59.04 2klo h ARG 74 Cb 0.34 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.66 2klo h ARG 74 CO -0.27 0.19 -0.03 1.98 0.56 0.00 0.00 179.97 182.41 2klo h MET 75 N 0.00 -0.07 -0.10 0.04 4.05 0.62 -3.32 114.93 116.15 2klo h MET 75 Ca -0.00 0.00 0.03 0.00 -0.28 0.00 0.00 59.70 59.45 2klo h MET 75 Cb 0.37 0.02 -0.00 0.00 -0.80 0.00 0.00 31.60 31.18 2klo h MET 75 CO 0.02 0.43 0.07 -0.24 0.23 0.00 0.00 176.91 177.43 2klo h VAL 76 N -0.96 0.89 0.00 -5.77 3.04 -1.07 -0.78 116.25 111.60 2klo h VAL 76 Ca -0.01 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.68 2klo h VAL 76 Cb 0.54 0.95 0.00 0.00 -2.01 0.00 0.00 31.29 30.76 2klo h VAL 76 CO 0.01 0.00 0.01 0.44 -1.01 0.00 0.00 177.57 177.02 2klo h ASP 77 N 0.00 0.00 0.27 3.17 3.32 -1.21 0.63 116.42 122.60 2klo h ASP 77 Ca 0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.10 2klo h ASP 77 Cb 0.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.74 2klo h ASP 77 CO -0.00 0.00 -0.05 -0.24 -1.72 0.00 0.00 179.24 177.23 2klo n SER 78 N -2.84 0.37 0.00 6.45 2.88 -0.30 -4.06 113.62 116.12 2klo n SER 78 Ca -0.03 -0.70 0.08 0.00 -1.33 0.00 0.00 58.87 56.90 2klo n SER 78 Cb 0.07 -0.08 0.48 0.00 -0.75 0.00 0.00 64.21 63.92 2klo n SER 78 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2klo n GLN 80 N -1.02 0.38 0.00 0.00 6.02 -1.26 -0.86 117.38 120.65 2klo n GLN 80 Ca 0.12 0.00 0.04 0.00 -0.01 0.00 0.00 57.00 57.15 2klo n GLN 80 Cb 0.06 -1.11 -0.01 0.00 1.02 0.00 0.00 30.24 30.20 2klo n GLN 80 CO 0.00 0.00 0.00 -2.37 -1.01 0.00 0.00 177.06 173.68 2klo n THR 81 N -0.04 0.00 -3.00 5.09 5.66 -1.25 -5.05 114.28 115.69 2klo n THR 81 Ca 0.00 -0.39 -0.02 0.00 -3.05 0.00 0.00 64.05 60.59 2klo n THR 81 Cb 0.05 1.09 0.00 0.00 -1.55 0.00 0.00 70.33 69.93 2klo n THR 81 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2klo n ALA 82 N -0.41 -2.64 -2.55 1.79 0.00 -0.04 -5.08 120.51 111.58 2klo n ALA 82 Ca 0.03 0.32 -0.26 0.00 0.00 0.00 0.00 53.44 53.53 2klo n ALA 82 Cb 0.18 -2.12 -0.10 0.00 0.00 0.00 0.00 19.45 17.41 2klo n ALA 82 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 2klo s LEU 83 N -3.63 2.84 0.48 0.00 0.05 -1.26 -5.14 118.68 112.03 2klo s LEU 83 Ca 0.07 -1.19 -0.19 0.00 0.05 0.00 0.00 54.13 52.86 2klo s LEU 83 Cb -0.02 -1.07 -0.09 0.00 -2.05 0.00 0.00 46.19 42.96 2klo s LEU 83 CO 0.76 -0.29 1.00 -0.44 -0.55 0.00 0.00 176.35 176.82 2klo s SER 84 N -3.67 6.57 0.50 1.48 0.01 -1.26 -4.96 113.70 112.36 2klo s SER 84 Ca 0.34 1.75 0.17 0.00 1.31 0.00 0.00 55.95 59.52 2klo s SER 84 Cb 0.04 -2.54 1.21 0.00 0.21 0.00 0.00 66.02 64.94 2klo s SER 84 CO 0.18 -0.62 2.09 1.55 0.41 0.00 0.00 173.24 176.84 2klo h PRO 85 N 1.44 0.00 0.00 12.44 0.13 -2.01 -1.14 132.00 142.85 2klo h PRO 85 Ca -0.48 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.62 2klo h PRO 85 Cb 1.20 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 2klo h PRO 85 CO 0.60 0.08 -0.14 0.78 -0.23 0.00 0.00 178.00 179.10 2klo h GLY 86 N 0.26 0.00 0.80 1.56 0.00 -1.99 -2.66 103.07 101.04 2klo h GLY 86 Ca -0.00 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 2klo h GLY 86 CO 0.01 0.00 -0.05 0.83 0.00 0.00 0.00 176.54 177.33 2klo h GLU 87 N 0.00 0.37 -0.59 4.80 5.08 -1.58 0.11 114.58 122.77 2klo h GLU 87 Ca -0.00 -0.15 0.06 0.00 -1.00 0.00 0.00 59.36 58.27 2klo h GLU 87 Cb 0.59 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.77 2klo h GLU 87 CO 0.02 0.64 0.29 1.98 -1.00 0.00 0.00 179.01 180.94 2klo h MET 88 N 0.09 0.53 0.33 2.33 4.05 -1.55 0.72 114.93 121.43 2klo h MET 88 Ca 0.05 -0.03 -0.02 0.00 -0.28 0.00 0.00 59.70 59.42 2klo h MET 88 Cb 0.50 -0.12 0.00 0.00 -0.80 0.00 0.00 31.60 31.19 2klo h MET 88 CO 0.02 0.35 -0.16 1.49 0.23 0.00 0.00 176.91 178.84 2klo h GLU 89 N 0.55 -0.42 -0.52 0.39 4.81 -1.40 -2.28 114.58 115.70 2klo h GLU 89 Ca 0.27 0.03 0.05 0.00 -0.13 0.00 0.00 59.36 59.58 2klo h GLU 89 Cb 0.21 0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.66 2klo h GLU 89 CO -0.20 -0.17 0.35 0.87 -0.73 0.00 0.00 179.01 179.12 2klo h LYS 90 N -0.61 0.49 -0.15 1.92 1.57 -0.62 -1.44 116.57 117.72 2klo h LYS 90 Ca -0.04 -0.03 -0.20 0.00 -1.87 0.00 0.00 60.65 58.50 2klo h LYS 90 Cb 0.44 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.65 2klo h LYS 90 CO 0.07 0.32 -0.73 0.45 -0.57 0.00 0.00 179.45 179.00 2klo h HIS 91 N 0.50 0.90 -0.14 -1.35 3.86 -0.69 -0.96 115.15 117.27 2klo h HIS 91 Ca 0.22 -0.38 -0.22 0.00 -1.16 0.00 0.00 60.37 58.82 2klo h HIS 91 Cb 0.24 -0.14 0.01 0.00 1.06 0.00 0.00 27.41 28.58 2klo h HIS 91 CO -0.00 1.19 -0.79 1.37 0.86 0.00 0.00 177.93 180.56 2klo h LEU 92 N 0.47 0.94 -0.45 2.43 8.10 -0.87 -2.69 115.31 123.24 2klo h LEU 92 Ca -0.04 -0.64 -0.14 0.00 0.11 0.00 0.00 57.88 57.18 2klo h LEU 92 Cb 1.33 -0.28 -0.01 0.00 -0.44 0.00 0.00 40.66 41.27 2klo h LEU 92 CO 0.14 1.43 -0.26 1.62 -4.11 0.00 0.00 178.44 177.26 2klo h VAL 93 N 0.52 1.27 0.01 0.15 3.04 -1.32 -2.05 116.25 117.86 2klo h VAL 93 Ca -0.06 -1.42 0.03 0.00 -1.01 0.00 0.00 66.70 64.24 2klo h VAL 93 Cb 1.42 1.22 -0.05 0.00 -2.01 0.00 0.00 31.29 31.87 2klo h VAL 93 CO 0.16 0.49 -0.30 0.25 -1.01 0.00 0.00 177.57 177.15 2klo h LEU 94 N 0.80 -0.90 -0.82 3.16 5.85 -1.20 0.31 115.31 122.51 2klo h LEU 94 Ca 0.09 0.12 -0.03 0.00 0.84 0.00 0.00 57.88 58.90 2klo h LEU 94 Cb 0.84 0.36 -0.04 0.00 0.37 0.00 0.00 40.66 42.19 2klo h LEU 94 CO 0.07 -0.37 0.38 -0.07 -0.34 0.00 0.00 178.44 178.11 2klo h LEU 95 N -0.46 1.09 -0.76 2.25 4.07 -1.46 -1.89 115.31 118.15 2klo h LEU 95 Ca 0.06 -0.15 -0.00 0.00 0.08 0.00 0.00 57.88 57.87 2klo h LEU 95 Cb 0.54 -0.28 -0.00 0.00 1.08 0.00 0.00 40.66 42.00 2klo h LEU 95 CO -0.25 0.93 -0.01 0.00 -1.08 0.00 0.00 178.44 178.03 2klo h ALA 96 N 1.20 1.00 0.02 1.53 0.00 -0.78 -0.78 119.26 121.45 2klo h ALA 96 Ca 0.28 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 2klo h ALA 96 Cb 0.14 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2klo h ALA 96 CO -0.03 0.01 -0.01 1.49 0.00 0.00 0.00 179.25 180.71 2klo h GLU 97 N 0.00 -0.02 0.00 0.00 4.57 0.02 -2.85 114.58 116.30 2klo h GLU 97 Ca -0.00 0.00 -0.13 0.00 -1.18 0.00 0.00 59.36 58.05 2klo h GLU 97 Cb 0.75 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.33 2klo h GLU 97 CO 0.00 0.70 -0.64 -0.07 -1.18 0.00 0.00 179.01 177.82 2klo h LEU 98 N -0.95 0.00 -5.67 1.64 3.38 -1.43 -3.37 115.31 108.92 2klo h LEU 98 Ca -0.00 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.40 2klo h LEU 98 Cb 0.73 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 41.07 2klo h LEU 98 CO 0.00 0.64 -0.77 0.18 0.09 0.00 0.00 178.44 178.58 2klo n LEU 99 N -3.31 3.32 0.22 1.67 4.77 -0.30 -4.90 117.00 118.46 2klo n LEU 99 Ca 0.01 -5.43 0.06 0.00 -0.03 0.00 0.00 56.01 50.62 2klo n LEU 99 Cb 0.77 -0.25 0.50 0.00 -2.33 0.00 0.00 43.42 42.11 2klo n LEU 99 CO 0.42 2.26 0.85 1.55 -1.33 0.00 0.00 177.39 181.14 2klo h PRO 100 N 3.31 0.00 0.00 3.23 0.13 -1.67 -0.90 132.00 136.09 2klo h PRO 100 Ca 0.13 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 65.17 2klo h PRO 100 Cb 0.65 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.77 2klo h PRO 100 CO 0.74 0.24 -0.44 0.38 -0.23 0.00 0.00 178.00 178.68 2klo h ASP 101 N 0.00 0.00 0.08 1.44 2.03 -1.90 -3.30 116.42 114.76 2klo h ASP 101 Ca -0.00 0.00 -0.27 0.00 -0.73 0.00 0.00 57.03 56.03 2klo h ASP 101 Cb 0.47 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 38.95 2klo h ASP 101 CO 0.03 0.44 -1.42 -0.25 -1.03 0.00 0.00 179.24 177.02 2klo h TRP 102 N 0.00 0.29 -3.24 4.15 7.01 -1.67 -3.43 115.95 119.07 2klo h TRP 102 Ca -0.00 -0.21 -0.67 0.00 2.11 0.00 0.00 58.89 60.11 2klo h TRP 102 Cb 0.92 -0.01 -0.33 0.00 -2.10 0.00 0.00 29.16 27.64 2klo h TRP 102 CO 0.00 1.56 -0.85 -1.17 -2.79 0.00 0.00 178.44 175.19 2klo s LEU 103 N -7.58 2.22 0.14 0.65 2.96 -0.44 -2.92 118.68 113.71 2klo s LEU 103 Ca -0.23 -0.56 -0.13 0.00 -0.22 0.00 0.00 54.13 52.99 2klo s LEU 103 Cb 0.05 -1.48 0.02 0.00 0.50 0.00 0.00 46.19 45.28 2klo s LEU 103 CO 0.71 0.09 0.35 -0.44 -1.32 0.00 0.00 176.35 175.73 2klo s SER 104 N 0.76 -0.10 0.07 3.68 0.01 -1.00 -4.35 113.70 112.79 2klo s SER 104 Ca -0.08 -0.54 0.03 0.00 1.31 0.00 0.00 55.95 56.68 2klo s SER 104 Cb -0.16 0.45 -0.03 0.00 0.21 0.00 0.00 66.02 66.49 2klo s SER 104 CO -0.00 -0.86 -0.10 -1.48 0.41 0.00 0.00 173.24 171.20 2klo s LEU 105 N -2.86 2.34 -0.22 2.44 0.05 -1.26 -0.75 118.68 118.42 2klo s LEU 105 Ca 0.07 -0.70 -0.04 0.00 0.05 0.00 0.00 54.13 53.51 2klo s LEU 105 Cb 0.02 -0.28 0.07 0.00 -2.05 0.00 0.00 46.19 43.96 2klo s LEU 105 CO -0.08 -0.22 0.09 -1.00 -0.55 0.00 0.00 176.35 174.59 2klo s HIS 106 N -1.95 0.57 0.07 3.48 3.76 0.27 -4.94 115.29 116.55 2klo s HIS 106 Ca -0.01 -0.71 -0.30 0.00 -0.15 0.00 0.00 55.06 53.89 2klo s HIS 106 Cb -0.06 -0.92 -0.05 0.00 1.11 0.00 0.00 32.58 32.66 2klo s HIS 106 CO 0.00 -0.64 0.96 0.50 -0.85 0.00 0.00 174.74 174.71 2klo s ARG 107 N 2.01 4.64 0.27 1.40 3.00 -1.26 -2.27 118.95 126.73 2klo s ARG 107 Ca 0.04 1.42 0.10 0.00 -1.00 0.00 0.00 55.73 56.29 2klo s ARG 107 Cb -0.16 -3.41 -0.05 0.00 0.00 0.00 0.00 34.95 31.33 2klo s ARG 107 CO -0.17 0.12 -0.16 0.42 0.00 0.00 0.00 175.30 175.51 2klo s ILE 108 N 0.36 2.19 -1.59 4.11 -1.09 0.51 -4.98 121.20 120.70 2klo s ILE 108 Ca 0.48 -2.31 0.00 0.00 -2.23 0.00 0.00 60.65 56.59 2klo s ILE 108 Cb -0.22 -2.28 0.00 0.00 -1.58 0.00 0.00 42.46 38.38 2klo s ILE 108 CO 0.29 -0.42 0.56 -2.11 -1.23 0.00 0.00 174.94 172.03 2klo n ARG 109 N -0.57 0.00 0.00 2.79 1.85 -1.26 -1.95 116.66 117.52 2klo n ARG 109 Ca -0.06 0.10 0.00 0.00 -1.00 0.00 0.00 57.85 56.89 2klo n ARG 109 Cb 0.61 -1.51 0.00 0.00 -1.05 0.00 0.00 32.46 30.51 2klo n ARG 109 CO 0.00 0.00 0.00 -2.37 -0.01 0.00 0.00 177.63 175.25 2klo n THR 110 N -1.06 0.00 -3.76 8.89 5.66 -1.26 -5.14 114.28 117.61 2klo n THR 110 Ca 0.00 0.00 0.04 0.00 -3.05 0.00 0.00 64.05 61.04 2klo n THR 110 Cb 0.01 -0.05 0.00 0.00 -1.55 0.00 0.00 70.33 68.75 2klo n THR 110 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 2klo s ASP 111 N -1.65 -0.00 -0.01 1.09 -1.08 -0.82 -5.17 116.67 109.02 2klo s ASP 111 Ca 0.00 -0.01 0.02 0.00 -0.52 0.00 0.00 52.55 52.04 2klo s ASP 111 Cb 0.00 0.01 -0.03 0.00 -1.46 0.00 0.00 42.92 41.43 2klo s ASP 111 CO 0.00 -0.01 -0.03 -0.89 0.52 0.00 0.00 175.17 174.75 2klo s THR 112 N -2.01 3.93 0.04 1.71 2.01 -1.26 -0.37 115.64 119.69 2klo s THR 112 Ca 0.22 -0.62 -0.04 0.00 0.31 0.00 0.00 61.69 61.57 2klo s THR 112 Cb 0.05 -2.71 -0.02 0.00 0.01 0.00 0.00 72.50 69.83 2klo s THR 112 CO -0.05 0.43 0.05 -0.31 -0.69 0.00 0.00 174.62 174.04 2klo s TYR 113 N -1.00 0.30 -0.10 4.92 1.51 -0.96 -0.29 117.35 121.73 2klo s TYR 113 Ca 0.17 -0.68 -0.02 0.00 -1.01 0.00 0.00 57.07 55.53 2klo s TYR 113 Cb -0.11 -0.22 -0.03 0.00 -0.11 0.00 0.00 41.96 41.49 2klo s TYR 113 CO 0.07 -0.36 -0.01 0.08 -1.11 0.00 0.00 175.55 174.22 2klo s VAL 114 N -2.93 4.17 -0.19 0.71 1.01 0.60 -0.56 120.40 123.20 2klo s VAL 114 Ca -0.02 -0.29 -0.05 0.00 0.00 0.00 0.00 61.98 61.62 2klo s VAL 114 Cb 0.01 -2.76 -0.02 0.00 0.00 0.00 0.00 36.38 33.60 2klo s VAL 114 CO -0.06 0.58 -0.01 -0.54 0.00 0.00 0.00 175.10 175.07 2klo s LYS 115 N -0.62 3.63 -0.04 2.72 3.01 0.07 -1.51 119.74 127.00 2klo s LYS 115 Ca 0.10 -0.52 -0.01 0.00 -1.01 0.00 0.00 55.97 54.52 2klo s LYS 115 Cb -0.12 -3.04 0.03 0.00 -1.01 0.00 0.00 37.83 33.69 2klo s LYS 115 CO 0.02 0.06 0.04 -1.17 0.51 0.00 0.00 175.35 174.81 2klo s LEU 116 N 0.87 0.47 -0.83 3.17 0.20 -0.19 -2.37 118.68 120.00 2klo s LEU 116 Ca 0.01 0.04 -0.25 0.00 0.69 0.00 0.00 54.13 54.61 2klo s LEU 116 Cb -0.14 -0.18 0.01 0.00 -0.43 0.00 0.00 46.19 45.44 2klo s LEU 116 CO 0.02 -0.21 1.59 -1.81 -0.29 0.00 0.00 176.35 175.65 2klo s ASP 117 N 1.84 5.87 0.31 3.68 1.11 -1.15 -4.67 116.67 123.66 2klo s ASP 117 Ca 0.01 -0.63 0.23 0.00 0.18 0.00 0.00 52.55 52.34 2klo s ASP 117 Cb -0.12 -2.56 1.14 0.00 1.07 0.00 0.00 42.92 42.45 2klo s ASP 117 CO -0.03 -2.04 1.71 0.11 1.18 0.00 0.00 175.17 176.10 2klo h LYS 118 N 11.23 0.00 0.00 8.23 1.57 -1.91 -2.24 116.57 133.44 2klo h LYS 118 Ca -0.06 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.69 2klo h LYS 118 Cb 1.05 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.36 2klo h LYS 118 CO 1.30 0.00 -0.18 0.00 -0.57 0.00 0.00 179.45 179.99 2klo h ALA 119 N 2.11 0.96 -2.77 3.86 0.00 -2.01 -3.46 119.26 117.95 2klo h ALA 119 Ca 0.00 -0.17 -0.53 0.00 0.00 0.00 0.00 54.91 54.22 2klo h ALA 119 Cb 0.17 -0.03 0.06 0.00 0.00 0.00 0.00 17.79 17.99 2klo h ALA 119 CO 0.00 0.23 0.76 0.08 0.00 0.00 0.00 179.25 180.32 2klo s VAL 120 N -3.47 2.58 -0.45 0.00 1.01 -0.85 -4.88 120.40 114.35 2klo s VAL 120 Ca 0.02 0.50 -0.27 0.00 0.00 0.00 0.00 61.98 62.23 2klo s VAL 120 Cb 0.09 -3.32 -0.03 0.00 0.00 0.00 0.00 36.38 33.11 2klo s VAL 120 CO 0.64 0.08 2.00 -1.81 0.00 0.00 0.00 175.10 176.01 2klo s ASP 121 N 0.28 5.32 0.57 3.32 1.11 -1.26 -4.85 116.67 121.16 2klo s ASP 121 Ca 0.59 0.99 0.26 0.00 0.18 0.00 0.00 52.55 54.57 2klo s ASP 121 Cb -0.42 -2.52 1.58 0.00 1.07 0.00 0.00 42.92 42.62 2klo s ASP 121 CO 0.45 -2.22 2.12 0.25 1.18 0.00 0.00 175.17 176.96 2klo h LEU 122 N 16.06 0.00 0.49 1.23 7.12 -1.92 -2.16 115.31 136.13 2klo h LEU 122 Ca -0.30 0.00 -0.02 0.00 0.13 0.00 0.00 57.88 57.70 2klo h LEU 122 Cb 1.20 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 41.32 2klo h LEU 122 CO 1.11 0.00 -0.33 0.00 -0.13 0.00 0.00 178.44 179.10 2klo h ALA 123 N 1.85 -0.80 -0.53 1.25 0.00 -1.99 0.15 119.26 119.19 2klo h ALA 123 Ca 0.08 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2klo h ALA 123 Cb 0.38 0.41 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 2klo h ALA 123 CO -0.00 -0.97 0.29 0.78 0.00 0.00 0.00 179.25 179.35 2klo h GLY 124 N -0.79 0.77 0.69 0.00 0.00 -1.81 -0.10 103.07 101.83 2klo h GLY 124 Ca -0.05 -0.33 -0.02 0.00 0.00 0.00 0.00 47.33 46.93 2klo h GLY 124 CO 0.04 0.32 -0.19 1.41 0.00 0.00 0.00 176.54 178.12 2klo h LEU 125 N 0.73 -0.44 -1.09 3.11 3.38 -1.15 -1.97 115.31 117.87 2klo h LEU 125 Ca 0.19 -0.12 0.09 0.00 0.09 0.00 0.00 57.88 58.13 2klo h LEU 125 Cb 0.02 0.11 -0.07 0.00 0.09 0.00 0.00 40.66 40.81 2klo h LEU 125 CO -0.03 -0.09 0.61 0.74 0.09 0.00 0.00 178.44 179.76 2klo h THR 126 N -0.84 0.99 0.86 0.22 2.02 -0.45 -0.92 112.91 114.81 2klo h THR 126 Ca -0.05 -0.35 -0.04 0.00 0.77 0.00 0.00 66.41 66.74 2klo h THR 126 Cb 0.54 -0.10 0.01 0.00 -1.74 0.00 0.00 68.15 66.86 2klo h THR 126 CO 0.09 0.18 -0.41 0.00 0.37 0.00 0.00 175.52 175.75 2klo h ALA 127 N 1.52 -1.29 -0.94 6.16 0.00 -0.93 -0.10 119.26 123.68 2klo h ALA 127 Ca 0.44 -0.25 0.04 0.00 0.00 0.00 0.00 54.91 55.14 2klo h ALA 127 Cb 0.35 0.45 -0.06 0.00 0.00 0.00 0.00 17.79 18.53 2klo h ALA 127 CO -0.20 -1.21 0.61 0.07 0.00 0.00 0.00 179.25 178.52 2klo h ARG 128 N -1.18 1.14 0.83 0.00 0.11 -1.23 -2.01 114.38 112.04 2klo h ARG 128 Ca -0.12 -0.07 -0.04 0.00 0.10 0.00 0.00 59.98 59.85 2klo h ARG 128 Cb 0.89 -0.26 0.01 0.00 1.11 0.00 0.00 29.97 31.72 2klo h ARG 128 CO 0.19 0.75 -0.40 1.25 0.10 0.00 0.00 179.97 181.87 2klo h LEU 129 N 1.17 -0.95 -2.32 0.08 5.85 -1.10 -2.85 115.31 115.19 2klo h LEU 129 Ca 0.38 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 59.12 2klo h LEU 129 Cb 0.04 0.24 -0.00 0.00 0.37 0.00 0.00 40.66 41.31 2klo h LEU 129 CO -0.13 -0.64 -0.03 0.00 -0.34 0.00 0.00 178.44 177.30 2klo h ALA 130 N -1.05 1.49 0.00 1.25 0.00 -0.92 -0.95 119.26 119.09 2klo h ALA 130 Ca -0.11 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2klo h ALA 130 Cb 0.86 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.65 2klo h ALA 130 CO 0.19 0.04 0.00 1.58 0.00 0.00 0.00 179.25 181.05 2klo n HIS 131 N -3.84 0.93 -3.13 0.00 -0.00 -0.76 -4.93 115.22 103.48 2klo n HIS 131 Ca -0.03 0.28 -0.21 0.00 -0.00 0.00 0.00 57.72 57.76 2klo n HIS 131 Cb 0.12 -0.95 0.00 0.00 -0.00 0.00 0.00 29.99 29.16 2klo n HIS 131 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 2klo n HIS 132 N -2.26 -1.74 0.06 1.57 -0.00 -0.36 -4.89 115.22 107.59 2klo n HIS 132 Ca 0.05 0.38 -0.12 0.00 -0.00 0.00 0.00 57.72 58.03 2klo n HIS 132 Cb 0.42 -3.11 -0.06 0.00 -0.00 0.00 0.00 29.99 27.24 2klo n HIS 132 CO 0.00 0.00 0.00 -0.39 -0.00 0.00 0.00 176.34 175.95 2klo h VAL 133 N -0.84 0.25 -0.19 1.59 -1.51 -1.84 -3.10 116.25 110.63 2klo h VAL 133 Ca -0.41 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.06 2klo h VAL 133 Cb 1.28 0.25 0.00 0.00 -2.13 0.00 0.00 31.29 30.70 2klo h VAL 133 CO 0.50 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.84 2klo n HIS 134 N -5.43 0.39 -3.62 5.19 -0.00 -1.26 -5.03 115.22 105.46 2klo n HIS 134 Ca -0.05 -0.66 -0.20 0.00 -0.00 0.00 0.00 57.72 56.81 2klo n HIS 134 Cb 0.34 -0.12 -0.01 0.00 -0.00 0.00 0.00 29.99 30.21 2klo n HIS 134 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2klo s ALA 135 N -1.69 4.14 0.00 1.59 0.00 -1.17 -5.04 121.76 119.59 2klo s ALA 135 Ca 0.23 -1.41 0.00 0.00 0.00 0.00 0.00 51.96 50.78 2klo s ALA 135 Cb 0.16 -1.66 0.00 0.00 0.00 0.00 0.00 23.12 21.63 2klo s ALA 135 CO 0.08 0.04 0.00 -0.85 0.00 0.00 0.00 175.76 175.03 2klo n GLU 136 N -1.56 2.54 0.00 0.00 0.00 -1.26 -4.91 120.64 115.45 2klo n GLU 136 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.14 2klo n GLU 136 Cb 0.58 -0.85 0.00 0.00 0.00 0.00 0.00 31.44 31.17 2klo n GLU 136 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2klo n GLY 137 N 2.29 0.78 0.00 -1.84 0.00 -1.26 -5.19 105.19 99.97 2klo n GLY 137 Ca 0.00 -0.71 0.05 0.00 0.00 0.00 0.00 46.02 45.36 2klo n GLY 137 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36