#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2klm s LYS 2 N 0.00 0.98 1.70 3.17 2.20 -1.26 -5.05 119.74 121.48 2klm s LYS 2 Ca 0.00 -0.62 0.00 0.00 -0.36 0.00 0.00 55.97 54.99 2klm s LYS 2 Cb 0.00 0.28 0.00 0.00 -1.51 0.00 0.00 37.83 36.60 2klm s LYS 2 CO 0.00 -0.46 0.00 1.63 -0.36 0.00 0.00 175.35 176.16 2klm n LYS 3 N -0.73 0.00 -1.52 4.03 5.02 -1.26 -4.30 118.16 119.39 2klm n LYS 3 Ca -0.02 0.00 -0.51 0.00 -2.02 0.00 0.00 58.31 55.77 2klm n LYS 3 Cb 0.59 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 35.54 2klm n LYS 3 CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43 2klm n VAL 4 N -0.30 0.27 -0.01 -0.18 3.14 -1.26 -2.46 118.33 117.54 2klm n VAL 4 Ca 0.00 -0.23 0.00 0.00 -2.96 0.00 0.00 64.34 61.16 2klm n VAL 4 Cb 0.00 -1.70 -0.03 0.00 -1.06 0.00 0.00 33.84 31.05 2klm n VAL 4 CO 0.00 0.00 0.00 1.33 -6.46 0.00 0.00 176.83 171.70 2klm n VAL 5 N 6.64 0.12 -3.77 1.55 0.24 -0.99 -4.93 118.33 117.19 2klm n VAL 5 Ca 0.36 -0.14 -0.13 0.00 -2.04 0.00 0.00 64.34 62.39 2klm n VAL 5 Cb 0.24 -0.14 -0.14 0.00 -1.47 0.00 0.00 33.84 32.33 2klm n VAL 5 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2klm s ALA 6 N -2.23 -0.22 -0.29 2.33 0.00 -0.76 -5.05 121.76 115.55 2klm s ALA 6 Ca -0.02 0.54 0.02 0.00 0.00 0.00 0.00 51.96 52.50 2klm s ALA 6 Cb 0.02 -0.36 0.08 0.00 0.00 0.00 0.00 23.12 22.86 2klm s ALA 6 CO 0.18 -0.13 -0.02 0.54 0.00 0.00 0.00 175.76 176.34 2klm s VAL 7 N 0.90 1.93 -0.93 0.00 0.11 -1.26 0.89 120.40 122.03 2klm s VAL 7 Ca -0.07 -1.78 -0.24 0.00 -2.93 0.00 0.00 61.98 56.96 2klm s VAL 7 Cb -0.09 -2.25 0.02 0.00 -1.53 0.00 0.00 36.38 32.52 2klm s VAL 7 CO -0.04 -0.32 1.59 -0.69 -3.33 0.00 0.00 175.10 172.31 2klm s VAL 8 N 1.15 3.74 -0.52 2.04 1.01 -0.36 -4.78 120.40 122.67 2klm s VAL 8 Ca 0.01 -0.47 -0.22 0.00 0.00 0.00 0.00 61.98 61.30 2klm s VAL 8 Cb -0.19 -4.69 0.04 0.00 0.00 0.00 0.00 36.38 31.54 2klm s VAL 8 CO -0.08 -1.60 0.81 -0.75 0.00 0.00 0.00 175.10 173.47 2klm s LYS 9 N 5.73 3.27 0.01 2.72 2.20 -1.26 -1.40 119.74 131.01 2klm s LYS 9 Ca 0.53 -0.44 -0.10 0.00 -0.36 0.00 0.00 55.97 55.59 2klm s LYS 9 Cb -0.03 -4.05 0.03 0.00 -1.51 0.00 0.00 37.83 32.27 2klm s LYS 9 CO -0.03 -1.33 0.47 1.47 -0.36 0.00 0.00 175.35 175.57 2klm n LEU 10 N 6.91 0.00 -4.96 5.43 -0.00 -0.69 -5.02 117.00 118.66 2klm n LEU 10 Ca -0.01 -0.23 -0.20 0.00 -0.00 0.00 0.00 56.01 55.57 2klm n LEU 10 Cb 0.47 0.78 -0.01 0.00 -0.00 0.00 0.00 43.42 44.65 2klm n LEU 10 CO 0.60 -0.08 0.00 -1.10 -0.00 0.00 0.00 177.39 176.81 2klm s GLN 11 N -2.01 3.17 -0.19 1.47 -0.21 -1.26 -0.85 119.66 119.78 2klm s GLN 11 Ca 0.11 -0.96 -0.15 0.00 0.02 0.00 0.00 55.36 54.38 2klm s GLN 11 Cb -0.00 -2.79 0.05 0.00 1.00 0.00 0.00 33.01 31.26 2klm s GLN 11 CO 0.00 0.20 0.48 -0.51 -2.12 0.00 0.00 175.29 173.35 2klm s LEU 12 N -4.07 0.02 -0.16 2.90 1.43 -0.79 -4.85 118.68 113.16 2klm s LEU 12 Ca 0.40 1.00 -0.22 0.00 -1.03 0.00 0.00 54.13 54.28 2klm s LEU 12 Cb -0.09 1.65 -0.03 0.00 0.03 0.00 0.00 46.19 47.75 2klm s LEU 12 CO 0.30 -0.18 0.69 -2.16 0.23 0.00 0.00 176.35 175.23 2klm s PRO 13 N 0.58 4.29 0.36 1.29 0.04 -1.26 -1.71 135.00 138.58 2klm s PRO 13 Ca -0.03 0.77 -0.28 0.00 0.04 0.00 0.00 61.00 61.50 2klm s PRO 13 Cb -0.05 -3.54 -0.11 0.00 0.04 0.00 0.00 34.50 30.84 2klm s PRO 13 CO -0.03 -0.17 1.49 0.00 0.04 0.00 0.00 177.00 178.32 2klm n ALA 14 N 4.75 2.29 -1.50 8.56 0.00 0.13 -4.25 120.51 130.48 2klm n ALA 14 Ca -0.00 0.35 0.04 0.00 0.00 0.00 0.00 53.44 53.83 2klm n ALA 14 Cb 0.50 -2.41 -0.02 0.00 0.00 0.00 0.00 19.45 17.51 2klm n ALA 14 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2klm n GLY 15 N 0.77 -3.50 2.11 0.00 0.00 -1.26 -1.78 105.19 101.53 2klm n GLY 15 Ca 0.03 -0.79 -0.01 0.00 0.00 0.00 0.00 46.02 45.24 2klm n GLY 15 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2klm n LYS 16 N -3.05 -0.24 -3.12 1.61 4.81 -1.26 -4.72 118.16 112.19 2klm n LYS 16 Ca -0.02 0.28 -0.27 0.00 -0.87 0.00 0.00 58.31 57.43 2klm n LYS 16 Cb 0.50 -3.64 -0.02 0.00 0.02 0.00 0.00 35.03 31.89 2klm n LYS 16 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2klm s ALA 17 N -1.96 3.57 0.05 3.14 0.00 -1.26 -4.97 121.76 120.32 2klm s ALA 17 Ca 0.00 -0.64 -0.28 0.00 0.00 0.00 0.00 51.96 51.04 2klm s ALA 17 Cb 0.00 -2.34 0.09 0.00 0.00 0.00 0.00 23.12 20.87 2klm s ALA 17 CO 0.00 -0.03 1.06 0.95 0.00 0.00 0.00 175.76 177.74 2klm s THR 18 N -2.37 0.00 0.00 0.00 -4.23 -1.26 -5.00 115.64 102.78 2klm s THR 18 Ca 0.44 -0.38 0.00 0.00 -1.18 0.00 0.00 61.69 60.57 2klm s THR 18 Cb -0.10 -1.76 0.00 0.00 1.34 0.00 0.00 72.50 71.98 2klm s THR 18 CO 0.36 0.00 0.11 -2.65 -0.54 0.00 0.00 174.62 171.90 2klm n PRO 19 N -0.41 0.05 -2.82 3.99 -0.02 -1.26 -3.49 135.00 131.05 2klm n PRO 19 Ca -0.07 0.00 -0.11 0.00 -2.02 0.00 0.00 63.50 61.30 2klm n PRO 19 Cb 0.61 -1.47 0.04 0.00 -0.02 0.00 0.00 33.50 32.66 2klm n PRO 19 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2klm n ALA 20 N 1.95 2.05 -1.97 3.55 0.00 -1.26 -5.08 120.51 119.74 2klm n ALA 20 Ca 0.00 -2.63 -0.29 0.00 0.00 0.00 0.00 53.44 50.52 2klm n ALA 20 Cb 0.03 -0.98 0.04 0.00 0.00 0.00 0.00 19.45 18.54 2klm n ALA 20 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2klm s PRO 21 N -1.84 2.94 0.55 0.00 0.04 -1.23 -4.95 135.00 130.51 2klm s PRO 21 Ca 0.29 0.30 0.27 0.00 0.04 0.00 0.00 61.00 61.90 2klm s PRO 21 Cb 0.40 -2.13 1.57 0.00 0.04 0.00 0.00 34.50 34.38 2klm s PRO 21 CO -0.03 -0.86 2.15 -1.00 0.04 0.00 0.00 177.00 177.30 2klm h PRO 22 N -0.44 0.00 0.00 0.56 0.13 -1.98 -3.26 132.00 127.02 2klm h PRO 22 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2klm h PRO 22 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 2klm h PRO 22 CO 0.63 0.07 0.00 0.28 -0.23 0.00 0.00 178.00 178.74 2klm n VAL 23 N -3.83 0.00 0.00 1.56 0.31 -1.26 -4.89 118.33 110.22 2klm n VAL 23 Ca -0.02 0.42 0.00 0.00 -0.01 0.00 0.00 64.34 64.73 2klm n VAL 23 Cb 0.16 -1.27 0.00 0.00 -0.91 0.00 0.00 33.84 31.83 2klm n VAL 23 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2klm n GLY 24 N 2.08 0.68 0.39 2.92 0.00 -1.23 -1.66 105.19 108.37 2klm n GLY 24 Ca 0.00 0.76 -0.07 0.00 0.00 0.00 0.00 46.02 46.71 2klm n GLY 24 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2klm h PRO 25 N 0.00 -0.15 -0.75 1.61 0.11 -1.90 4.56 132.00 135.47 2klm h PRO 25 Ca 0.00 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.12 2klm h PRO 25 Cb 0.00 0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.14 2klm h PRO 25 CO 0.00 -0.10 0.00 0.00 -0.21 0.00 0.00 178.00 177.69 2klm n ALA 26 N -3.22 1.12 0.00 -0.75 0.00 -0.66 -2.83 120.51 114.16 2klm n ALA 26 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2klm n ALA 26 Cb 0.35 -0.94 0.00 0.00 0.00 0.00 0.00 19.45 18.86 2klm n ALA 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2klm n LEU 27 N 0.66 0.00 0.09 0.00 7.94 0.18 -4.99 117.00 120.89 2klm n LEU 27 Ca 0.00 0.00 -0.13 0.00 -1.11 0.00 0.00 56.01 54.77 2klm n LEU 27 Cb 0.00 0.18 -0.07 0.00 0.53 0.00 0.00 43.42 44.07 2klm n LEU 27 CO 0.00 -0.18 0.82 1.23 -1.11 0.00 0.00 177.39 178.14 2klm h GLY 28 N 0.00 -0.18 -3.45 -3.96 0.00 0.87 -2.50 103.07 93.85 2klm h GLY 28 Ca 0.00 0.08 -0.02 0.00 0.00 0.00 0.00 47.33 47.40 2klm h GLY 28 CO 0.00 -0.08 -0.01 -0.18 0.00 0.00 0.00 176.54 176.27 2klm n GLN 29 N -5.18 0.77 0.10 4.80 7.27 -1.13 -3.41 117.38 120.59 2klm n GLN 29 Ca -0.08 -0.09 0.09 0.00 0.07 0.00 0.00 57.00 57.00 2klm n GLN 29 Cb 0.11 -1.25 -0.01 0.00 2.41 0.00 0.00 30.24 31.51 2klm n GLN 29 CO 0.00 0.00 0.00 1.12 0.07 0.00 0.00 177.06 178.25 2klm h HIS 30 N 2.22 0.00 0.00 3.69 2.07 -1.70 -3.48 115.15 117.95 2klm h HIS 30 Ca 0.02 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.54 2klm h HIS 30 Cb 0.72 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.70 2klm h HIS 30 CO 0.47 0.13 0.00 0.41 -3.07 0.00 0.00 177.93 175.87 2klm n GLY 31 N 1.22 2.98 0.00 6.13 0.00 -1.22 -5.04 105.19 109.27 2klm n GLY 31 Ca -0.02 -0.86 0.00 0.00 0.00 0.00 0.00 46.02 45.14 2klm n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2klm n ALA 32 N 0.00 0.00 -3.71 4.61 0.00 -1.26 -4.99 120.51 115.16 2klm n ALA 32 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.25 2klm n ALA 32 Cb 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.28 2klm n ALA 32 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2klm s ASN 33 N -2.46 0.88 0.00 0.00 0.01 -1.26 -5.07 114.94 107.04 2klm s ASN 33 Ca 0.00 -0.04 0.00 0.00 -0.71 0.00 0.00 52.86 52.11 2klm s ASN 33 Cb 0.00 -0.29 0.00 0.00 0.41 0.00 0.00 41.25 41.37 2klm s ASN 33 CO 0.00 -0.14 0.59 -0.38 -1.51 0.00 0.00 177.10 175.66 2klm n ILE 34 N 4.55 0.00 -0.43 0.60 2.08 -1.26 -2.06 119.36 122.83 2klm n ILE 34 Ca -0.18 1.08 0.38 0.00 0.56 0.00 0.00 62.75 64.58 2klm n ILE 34 Cb 0.50 -2.06 0.65 0.00 -0.75 0.00 0.00 39.64 37.99 2klm n ILE 34 CO 0.00 0.00 0.00 0.80 0.56 0.00 0.00 176.55 177.91 2klm n MET 35 N -1.92 -0.04 -0.07 0.38 1.56 -1.26 0.31 117.12 116.08 2klm n MET 35 Ca 0.00 1.26 -0.10 0.00 -0.27 0.00 0.00 57.70 58.59 2klm n MET 35 Cb 0.00 -2.43 -0.03 0.00 2.15 0.00 0.00 33.22 32.91 2klm n MET 35 CO 0.00 0.00 0.00 1.49 -0.73 0.00 0.00 175.97 176.73 2klm h GLU 36 N 0.00 0.36 0.06 2.12 4.57 -1.97 1.34 114.58 121.06 2klm h GLU 36 Ca 0.86 -0.05 0.01 0.00 -1.18 0.00 0.00 59.36 59.00 2klm h GLU 36 Cb 2.67 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 31.16 2klm h GLU 36 CO -0.52 0.34 -0.26 0.35 -1.18 0.00 0.00 179.01 177.73 2klm h PHE 37 N 0.30 -0.76 -0.80 0.92 3.57 0.54 -1.13 116.94 119.58 2klm h PHE 37 Ca 0.09 0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.67 2klm h PHE 37 Cb 0.08 0.32 -0.06 0.00 2.79 0.00 0.00 35.95 39.09 2klm h PHE 37 CO -0.03 -0.30 0.48 0.28 -2.23 0.00 0.00 178.31 176.52 2klm h VAL 38 N -0.37 1.02 -0.01 1.41 2.07 -1.14 -1.63 116.25 117.59 2klm h VAL 38 Ca -0.00 -0.30 0.02 0.00 0.82 0.00 0.00 66.70 67.23 2klm h VAL 38 Cb 0.37 0.06 -0.05 0.00 -1.52 0.00 0.00 31.29 30.15 2klm h VAL 38 CO -0.14 0.16 -0.49 0.50 0.02 0.00 0.00 177.57 177.62 2klm h LYS 39 N 0.88 -0.59 -0.95 1.57 3.64 0.22 2.21 116.57 123.56 2klm h LYS 39 Ca 0.35 0.04 0.06 0.00 -1.27 0.00 0.00 60.65 59.83 2klm h LYS 39 Cb 0.17 0.13 -0.06 0.00 -0.41 0.00 0.00 32.23 32.06 2klm h LYS 39 CO -0.17 -0.39 0.61 0.00 -2.27 0.00 0.00 179.45 177.22 2klm h ALA 40 N -0.52 1.29 -1.93 5.00 0.00 -0.88 1.00 119.26 123.22 2klm h ALA 40 Ca 0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2klm h ALA 40 Cb 0.66 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2klm h ALA 40 CO -0.33 0.40 0.00 1.19 0.00 0.00 0.00 179.25 180.51 2klm n PHE 41 N -4.53 0.00 -0.35 0.00 3.01 -0.53 -1.20 117.46 113.86 2klm n PHE 41 Ca 0.14 0.00 0.07 0.00 1.01 0.00 0.00 57.45 58.67 2klm n PHE 41 Cb 0.16 -0.18 0.16 0.00 -0.01 0.00 0.00 39.48 39.61 2klm n PHE 41 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 2klm n ASN 42 N -1.03 -0.31 -0.07 4.37 2.85 0.74 0.15 115.26 121.95 2klm n ASN 42 Ca 0.00 1.66 0.10 0.00 -0.11 0.00 0.00 54.58 56.22 2klm n ASN 42 Cb 0.00 -0.52 0.47 0.00 1.24 0.00 0.00 39.78 40.97 2klm n ASN 42 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2klm h ALA 43 N 1.93 1.91 0.05 5.20 0.00 0.10 2.11 119.26 130.56 2klm h ALA 43 Ca 0.48 -0.02 -0.24 0.00 0.00 0.00 0.00 54.91 55.14 2klm h ALA 43 Cb 0.79 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 2klm h ALA 43 CO -0.98 -0.02 -1.27 0.00 0.00 0.00 0.00 179.25 176.98 2klm h ALA 44 N 1.70 0.24 0.00 0.00 0.00 0.29 -0.56 119.26 120.92 2klm h ALA 44 Ca 0.25 -1.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.02 2klm h ALA 44 Cb 0.37 0.59 -0.00 0.00 0.00 0.00 0.00 17.79 18.75 2klm h ALA 44 CO -0.07 0.75 -0.06 1.79 0.00 0.00 0.00 179.25 181.66 2klm h THR 45 N -0.66 0.44 0.11 0.00 1.35 0.90 0.23 112.91 115.28 2klm h THR 45 Ca -0.31 -0.29 -0.31 0.00 -0.55 0.00 0.00 66.41 64.95 2klm h THR 45 Cb 1.50 1.20 -0.01 0.00 -1.73 0.00 0.00 68.15 69.11 2klm h THR 45 CO -0.07 0.06 -1.56 0.00 -0.25 0.00 0.00 175.52 173.69 2klm h ALA 46 N 1.94 0.30 0.00 6.62 0.00 0.34 1.14 119.26 129.60 2klm h ALA 46 Ca -0.00 -1.14 -0.00 0.00 0.00 0.00 0.00 54.91 53.77 2klm h ALA 46 Cb 0.19 0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 2klm h ALA 46 CO 0.01 1.17 -0.01 -0.97 0.00 0.00 0.00 179.25 179.44 2klm h ASN 47 N 0.07 0.00 0.00 0.00 -1.24 0.68 -3.26 115.58 111.82 2klm h ASN 47 Ca -0.25 0.00 -0.13 0.00 0.71 0.00 0.00 56.30 56.62 2klm h ASN 47 Cb 2.02 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 41.05 2klm h ASN 47 CO 0.15 0.01 -1.23 1.15 -1.29 0.00 0.00 177.43 176.22 2klm n MET 48 N -3.89 0.36 0.00 6.67 0.00 -0.40 -5.06 117.12 114.79 2klm n MET 48 Ca -0.03 0.15 0.00 0.00 0.00 0.00 0.00 57.70 57.82 2klm n MET 48 Cb 0.10 -1.11 0.00 0.00 0.00 0.00 0.00 33.22 32.20 2klm n MET 48 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2klm n GLY 49 N 2.05 2.25 3.76 3.17 0.00 0.39 -5.09 105.19 111.73 2klm n GLY 49 Ca -0.20 -1.35 -0.40 0.00 0.00 0.00 0.00 46.02 44.07 2klm n GLY 49 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2klm s ASP 50 N 0.00 7.09 0.00 1.61 -4.77 -1.25 -4.46 116.67 114.89 2klm s ASP 50 Ca 0.00 2.27 0.00 0.00 -3.30 0.00 0.00 52.55 51.52 2klm s ASP 50 Cb 0.00 -2.62 0.00 0.00 -1.09 0.00 0.00 42.92 39.21 2klm s ASP 50 CO 0.00 -0.27 0.00 0.00 0.70 0.00 0.00 175.17 175.60 2klm n ALA 51 N 0.87 0.00 -3.70 2.11 0.00 -0.73 -4.92 120.51 114.14 2klm n ALA 51 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.29 2klm n ALA 51 Cb 0.45 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.74 2klm n ALA 51 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2klm s ILE 52 N -1.31 0.04 -0.08 0.00 -1.09 -1.26 0.17 121.20 117.67 2klm s ILE 52 Ca 0.00 0.15 -0.05 0.00 -2.23 0.00 0.00 60.65 58.52 2klm s ILE 52 Cb 0.00 -0.16 0.03 0.00 -1.58 0.00 0.00 42.46 40.76 2klm s ILE 52 CO 0.00 0.11 0.19 -0.69 -1.23 0.00 0.00 174.94 173.32 2klm s VAL 53 N 0.99 -0.02 0.44 2.92 1.01 -0.70 -4.87 120.40 120.18 2klm s VAL 53 Ca -0.09 0.09 -0.22 0.00 0.00 0.00 0.00 61.98 61.76 2klm s VAL 53 Cb -0.13 -0.29 -0.09 0.00 0.00 0.00 0.00 36.38 35.88 2klm s VAL 53 CO -0.02 0.04 1.02 -2.16 0.00 0.00 0.00 175.10 173.98 2klm s PRO 54 N 0.69 4.02 -0.09 2.72 0.04 -1.26 -1.88 135.00 139.24 2klm s PRO 54 Ca -0.05 1.37 -0.07 0.00 0.04 0.00 0.00 61.00 62.29 2klm s PRO 54 Cb -0.06 -2.28 0.03 0.00 0.04 0.00 0.00 34.50 32.23 2klm s PRO 54 CO -0.04 -0.24 0.22 0.14 0.04 0.00 0.00 177.00 177.12 2klm s VAL 55 N -1.90 -0.01 -0.72 -0.36 -7.23 -0.03 -4.48 120.40 105.66 2klm s VAL 55 Ca 0.63 0.05 0.04 0.00 -1.81 0.00 0.00 61.98 60.88 2klm s VAL 55 Cb -0.17 -0.32 0.22 0.00 0.56 0.00 0.00 36.38 36.66 2klm s VAL 55 CO 0.21 0.02 0.70 -0.62 -0.31 0.00 0.00 175.10 175.10 2klm n GLU 56 N 3.34 2.39 -1.55 4.82 1.02 -1.24 -1.70 120.64 127.72 2klm n GLU 56 Ca -0.16 -4.58 -0.22 0.00 -0.02 0.00 0.00 57.16 52.18 2klm n GLU 56 Cb 0.57 -2.30 -0.07 0.00 -0.02 0.00 0.00 31.44 29.62 2klm n GLU 56 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 2klm n ILE 57 N 1.46 -0.03 -2.17 -3.67 5.41 -0.49 -4.60 119.36 115.27 2klm n ILE 57 Ca 0.25 -0.58 -0.35 0.00 1.00 0.00 0.00 62.75 63.07 2klm n ILE 57 Cb 0.38 -2.10 -0.04 0.00 -0.71 0.00 0.00 39.64 37.17 2klm n ILE 57 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 176.55 175.66 2klm s THR 58 N 13.08 3.50 -0.26 1.39 2.01 -0.74 -1.23 115.64 133.40 2klm s THR 58 Ca 0.98 -0.09 -0.15 0.00 0.31 0.00 0.00 61.69 62.74 2klm s THR 58 Cb -0.22 -4.23 -0.04 0.00 0.01 0.00 0.00 72.50 68.03 2klm s THR 58 CO 0.18 -1.17 0.39 -0.63 -0.69 0.00 0.00 174.62 172.70 2klm s ILE 59 N 8.50 5.17 -0.05 1.82 1.01 0.26 -1.00 121.20 136.91 2klm s ILE 59 Ca 0.61 0.63 -0.08 0.00 0.00 0.00 0.00 60.65 61.81 2klm s ILE 59 Cb -0.08 -3.72 -0.04 0.00 0.01 0.00 0.00 42.46 38.62 2klm s ILE 59 CO 0.09 0.17 0.23 -0.31 0.00 0.00 0.00 174.94 175.11 2klm s TYR 60 N 1.95 3.61 0.66 3.97 1.51 -0.38 -1.83 117.35 126.84 2klm s TYR 60 Ca 0.16 0.60 0.23 0.00 -1.01 0.00 0.00 57.07 57.06 2klm s TYR 60 Cb -0.16 -2.00 1.27 0.00 -0.11 0.00 0.00 41.96 40.96 2klm s TYR 60 CO 0.09 0.68 1.72 0.00 -1.11 0.00 0.00 175.55 176.93 2klm h ALA 61 N 4.51 1.51 0.00 3.71 0.00 -1.78 0.17 119.26 127.38 2klm h ALA 61 Ca -0.52 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2klm h ALA 61 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2klm h ALA 61 CO 0.62 -0.50 0.00 -0.25 0.00 0.00 0.00 179.25 179.12 2klm n ASP 62 N -2.83 2.04 -3.80 0.00 8.00 -1.26 -4.75 116.55 113.95 2klm n ASP 62 Ca -0.01 -1.35 -0.25 0.00 0.71 0.00 0.00 54.79 53.89 2klm n ASP 62 Cb 0.53 -0.35 0.00 0.00 -0.02 0.00 0.00 41.12 41.28 2klm n ASP 62 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 2klm n ARG 63 N 0.71 -1.52 -3.71 -1.24 1.85 0.57 -4.98 116.66 108.34 2klm n ARG 63 Ca 0.00 0.74 -0.14 0.00 -1.00 0.00 0.00 57.85 57.45 2klm n ARG 63 Cb 0.33 -2.27 -0.14 0.00 -1.05 0.00 0.00 32.46 29.33 2klm n ARG 63 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 2klm s SER 64 N -3.00 0.16 -0.49 2.89 1.04 -0.92 -4.98 113.70 108.39 2klm s SER 64 Ca 0.01 0.42 -0.13 0.00 0.48 0.00 0.00 55.95 56.73 2klm s SER 64 Cb -0.01 0.36 0.11 0.00 0.10 0.00 0.00 66.02 66.58 2klm s SER 64 CO 0.90 -0.19 0.40 -0.36 0.98 0.00 0.00 173.24 174.97 2klm s PHE 65 N 1.71 3.31 0.69 5.02 0.40 -1.26 -1.25 117.98 126.60 2klm s PHE 65 Ca -0.04 -1.41 0.02 0.00 -0.60 0.00 0.00 56.93 54.90 2klm s PHE 65 Cb -0.11 -3.46 0.12 0.00 0.51 0.00 0.00 43.02 40.07 2klm s PHE 65 CO -0.07 -0.94 0.95 0.95 0.70 0.00 0.00 175.22 176.81 2klm s THR 66 N 1.52 2.13 0.00 0.64 -4.23 -0.17 -4.91 115.64 110.63 2klm s THR 66 Ca 0.04 -0.69 0.00 0.00 -1.18 0.00 0.00 61.69 59.86 2klm s THR 66 Cb -0.27 -2.44 0.00 0.00 1.34 0.00 0.00 72.50 71.13 2klm s THR 66 CO 0.03 0.00 0.00 0.33 -0.54 0.00 0.00 174.62 174.44 2klm n PHE 67 N -2.70 0.00 -1.33 3.99 7.35 -1.26 -1.79 117.46 121.71 2klm n PHE 67 Ca 0.15 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.84 2klm n PHE 67 Cb 0.61 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.44 2klm n PHE 67 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 2klm n VAL 68 N 0.00 -1.07 -1.77 -2.13 0.31 -1.26 -4.96 118.33 107.44 2klm n VAL 68 Ca 0.00 0.00 -0.34 0.00 -0.01 0.00 0.00 64.34 63.99 2klm n VAL 68 Cb 0.00 -3.20 0.05 0.00 -0.91 0.00 0.00 33.84 29.78 2klm n VAL 68 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 2klm s THR 69 N -2.47 3.07 0.00 2.52 -1.32 -1.26 -5.02 115.64 111.16 2klm s THR 69 Ca 0.00 0.53 -0.28 0.00 -1.21 0.00 0.00 61.69 60.73 2klm s THR 69 Cb 0.00 -3.06 0.10 0.00 -1.51 0.00 0.00 72.50 68.02 2klm s THR 69 CO 0.00 -0.28 1.26 -1.59 -2.21 0.00 0.00 174.62 171.80 2klm s LYS 70 N -3.95 0.48 -0.37 7.08 -2.85 -1.26 -4.93 119.74 113.94 2klm s LYS 70 Ca 0.69 -0.31 -0.19 0.00 -1.00 0.00 0.00 55.97 55.16 2klm s LYS 70 Cb -0.22 0.13 0.03 0.00 -2.06 0.00 0.00 37.83 35.71 2klm s LYS 70 CO 0.40 -0.22 0.46 0.25 0.10 0.00 0.00 175.35 176.34 2klm n THR 71 N -0.84 -8.02 -0.69 3.79 -2.24 -1.26 -4.96 114.28 100.06 2klm n THR 71 Ca 0.02 0.75 -0.30 0.00 -2.27 0.00 0.00 64.05 62.25 2klm n THR 71 Cb 0.59 -5.61 0.26 0.00 -2.10 0.00 0.00 70.33 63.48 2klm n THR 71 CO 0.00 0.00 0.00 -2.84 -0.57 0.00 0.00 175.07 171.66 2klm s PRO 72 N -2.23 -1.99 0.00 -0.78 0.02 -1.26 -4.88 135.00 123.88 2klm s PRO 72 Ca 0.23 0.14 0.13 0.00 0.02 0.00 0.00 61.00 61.52 2klm s PRO 72 Cb -0.04 -1.49 0.77 0.00 0.02 0.00 0.00 34.50 33.76 2klm s PRO 72 CO 0.72 -4.26 1.31 -0.35 -0.33 0.00 0.00 177.00 174.09 2klm n PRO 73 N -5.19 0.75 0.00 5.54 -0.04 -1.26 -4.33 135.00 130.47 2klm n PRO 73 Ca 0.11 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.57 2klm n PRO 73 Cb 0.59 -1.27 0.00 0.00 -0.04 0.00 0.00 33.50 32.78 2klm n PRO 73 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2klm n ALA 74 N -0.77 0.00 0.19 0.55 0.00 -1.26 -4.39 120.51 114.83 2klm n ALA 74 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.54 2klm n ALA 74 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.49 2klm n ALA 74 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2klm n SER 75 N 0.00 0.00 -0.35 0.00 2.88 -1.26 -1.64 113.62 113.25 2klm n SER 75 Ca 0.00 0.29 0.11 0.00 -1.33 0.00 0.00 58.87 57.94 2klm n SER 75 Cb 0.00 0.00 0.24 0.00 -0.75 0.00 0.00 64.21 63.70 2klm n SER 75 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 2klm h TYR 76 N 0.00 -0.21 0.00 0.66 3.20 -1.82 -2.40 116.97 116.39 2klm h TYR 76 Ca 0.00 0.08 0.00 0.00 3.14 0.00 0.00 58.73 61.95 2klm h TYR 76 Cb 1.55 0.25 0.00 0.00 1.54 0.00 0.00 36.73 40.07 2klm h TYR 76 CO 0.00 -0.43 -0.16 1.47 -1.64 0.00 0.00 178.16 177.40 2klm n LEU 77 N -5.54 0.00 -0.25 2.82 -0.00 -0.65 -4.75 117.00 108.64 2klm n LEU 77 Ca 0.21 -0.08 -0.01 0.00 -0.00 0.00 0.00 56.01 56.13 2klm n LEU 77 Cb 0.67 0.00 0.20 0.00 -0.00 0.00 0.00 43.42 44.29 2klm n LEU 77 CO -0.08 0.00 1.22 0.40 -0.00 0.00 0.00 177.39 178.93 2klm h ILE 78 N 0.00 1.21 -0.76 1.47 2.04 -1.33 -1.81 117.51 118.33 2klm h ILE 78 Ca 0.00 -0.44 0.16 0.00 1.00 0.00 0.00 64.86 65.58 2klm h ILE 78 Cb 0.00 0.07 -0.10 0.00 -0.74 0.00 0.00 36.82 36.05 2klm h ILE 78 CO 0.00 0.22 0.27 0.03 0.00 0.00 0.00 178.15 178.66 2klm h ARG 79 N 1.09 0.37 0.62 2.37 2.47 -1.67 1.45 114.38 121.07 2klm h ARG 79 Ca 0.29 -0.02 -0.03 0.00 -1.26 0.00 0.00 59.98 58.96 2klm h ARG 79 Cb -0.08 -0.08 0.01 0.00 -1.65 0.00 0.00 29.97 28.16 2klm h ARG 79 CO -0.06 0.24 -0.30 -0.22 0.56 0.00 0.00 179.97 180.20 2klm h LYS 80 N 0.38 -0.80 -0.11 0.04 3.11 -1.60 0.41 116.57 117.99 2klm h LYS 80 Ca 0.43 0.05 0.03 0.00 -2.81 0.00 0.00 60.65 58.36 2klm h LYS 80 Cb 0.70 0.18 -0.00 0.00 -1.00 0.00 0.00 32.23 32.11 2klm h LYS 80 CO -0.45 -0.53 0.34 0.00 -2.81 0.00 0.00 179.45 175.99 2klm h ALA 81 N -1.33 1.54 -2.37 5.00 0.00 -0.83 -3.20 119.26 118.07 2klm h ALA 81 Ca -0.08 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2klm h ALA 81 Cb 0.64 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2klm h ALA 81 CO 0.14 -0.40 0.00 0.00 0.00 0.00 0.00 179.25 178.99 2klm n ALA 82 N -2.03 0.00 0.00 0.00 0.00 0.49 -4.45 120.51 114.52 2klm n ALA 82 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2klm n ALA 82 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 2klm n ALA 82 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2klm n GLY 83 N 2.36 1.91 3.76 0.00 0.00 0.14 -4.49 105.19 108.87 2klm n GLY 83 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2klm n GLY 83 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2klm s LEU 84 N 0.00 4.46 -0.21 0.99 1.43 -1.25 -4.95 118.68 119.14 2klm s LEU 84 Ca 0.00 2.54 -0.12 0.00 -1.03 0.00 0.00 54.13 55.53 2klm s LEU 84 Cb 0.00 -3.64 -0.19 0.00 0.03 0.00 0.00 46.19 42.39 2klm s LEU 84 CO 0.00 -0.44 0.05 -1.84 0.23 0.00 0.00 176.35 174.35 2klm n GLU 85 N 1.20 0.64 0.00 1.70 0.28 -1.26 -4.98 120.64 118.22 2klm n GLU 85 Ca 0.01 0.34 0.00 0.00 -0.16 0.00 0.00 57.16 57.35 2klm n GLU 85 Cb 0.43 -1.64 0.00 0.00 1.43 0.00 0.00 31.44 31.66 2klm n GLU 85 CO 0.00 0.00 0.00 0.36 -0.16 0.00 0.00 177.13 177.33 2klm n LYS 86 N -3.92 0.00 -2.90 3.44 2.85 -1.26 -5.03 118.16 111.34 2klm n LYS 86 Ca -0.40 0.00 -0.09 0.00 -1.05 0.00 0.00 58.31 56.77 2klm n LYS 86 Cb 0.88 0.00 0.03 0.00 -0.65 0.00 0.00 35.03 35.30 2klm n LYS 86 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2klm n GLY 87 N -0.46 0.36 2.42 2.58 0.00 -1.26 -5.00 105.19 103.83 2klm n GLY 87 Ca 0.00 -0.31 -0.18 0.00 0.00 0.00 0.00 46.02 45.52 2klm n GLY 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2klm n ALA 88 N -3.38 1.09 -2.94 4.61 0.00 -1.26 -5.12 120.51 113.51 2klm n ALA 88 Ca -0.01 -2.62 -0.10 0.00 0.00 0.00 0.00 53.44 50.72 2klm n ALA 88 Cb 0.53 -1.00 -0.05 0.00 0.00 0.00 0.00 19.45 18.92 2klm n ALA 88 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 2klm s HIS 89 N -0.32 0.05 0.75 0.00 -3.43 -1.26 -5.15 115.29 105.93 2klm s HIS 89 Ca 0.33 -0.41 -0.15 0.00 -0.80 0.00 0.00 55.06 54.03 2klm s HIS 89 Cb 0.15 0.16 0.01 0.00 -1.43 0.00 0.00 32.58 31.47 2klm s HIS 89 CO -0.16 -0.75 0.85 1.63 -2.00 0.00 0.00 174.74 174.32 2klm n LYS 90 N -0.23 0.35 -1.62 -0.38 5.02 -1.26 -4.88 118.16 115.16 2klm n LYS 90 Ca -0.12 0.17 -0.41 0.00 -2.02 0.00 0.00 58.31 55.94 2klm n LYS 90 Cb 0.63 -2.13 0.02 0.00 -0.02 0.00 0.00 35.03 33.53 2klm n LYS 90 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 2klm n PRO 91 N -1.77 1.32 0.00 1.97 -0.02 -1.26 -4.90 135.00 130.34 2klm n PRO 91 Ca 0.12 0.48 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 2klm n PRO 91 Cb 0.50 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 31.89 2klm n PRO 91 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2klm n GLY 92 N 1.18 -0.74 2.68 -1.23 0.00 -1.26 -5.11 105.19 100.71 2klm n GLY 92 Ca 0.10 0.18 -0.22 0.00 0.00 0.00 0.00 46.02 46.07 2klm n GLY 92 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2klm s ARG 93 N -0.44 0.11 -1.18 1.61 0.52 -1.26 -5.06 118.95 113.25 2klm s ARG 93 Ca 0.00 0.08 -0.20 0.00 -0.52 0.00 0.00 55.73 55.09 2klm s ARG 93 Cb 0.00 -1.46 -0.04 0.00 0.52 0.00 0.00 34.95 33.97 2klm s ARG 93 CO 0.00 -0.64 1.92 -0.85 0.02 0.00 0.00 175.30 175.75 2klm n GLU 94 N 5.30 2.26 -2.73 3.54 0.28 -1.26 -4.54 120.64 123.49 2klm n GLU 94 Ca -0.06 -2.60 -0.07 0.00 -0.16 0.00 0.00 57.16 54.27 2klm n GLU 94 Cb 0.49 -3.42 0.05 0.00 1.43 0.00 0.00 31.44 29.99 2klm n GLU 94 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 2klm n LYS 95 N 7.69 0.58 -3.98 3.44 4.81 -1.26 -5.15 118.16 124.29 2klm n LYS 95 Ca 0.48 -1.47 -0.09 0.00 -0.87 0.00 0.00 58.31 56.36 2klm n LYS 95 Cb 0.44 -1.12 -0.08 0.00 0.02 0.00 0.00 35.03 34.29 2klm n LYS 95 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 2klm s VAL 96 N 0.58 0.11 0.00 3.15 0.11 -1.26 -5.03 120.40 118.06 2klm s VAL 96 Ca 0.30 -1.46 0.00 0.00 -2.93 0.00 0.00 61.98 57.89 2klm s VAL 96 Cb 0.20 -1.71 0.00 0.00 -1.53 0.00 0.00 36.38 33.34 2klm s VAL 96 CO -0.19 -0.49 0.00 0.61 -3.33 0.00 0.00 175.10 171.70 2klm n GLY 97 N -0.12 0.04 2.74 6.54 0.00 -1.26 -4.66 105.19 108.47 2klm n GLY 97 Ca -0.10 -0.39 -0.22 0.00 0.00 0.00 0.00 46.02 45.31 2klm n GLY 97 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2klm s ARG 98 N -1.70 0.41 0.06 1.61 0.52 -1.25 -1.32 118.95 117.28 2klm s ARG 98 Ca 0.00 0.15 0.04 0.00 -0.52 0.00 0.00 55.73 55.40 2klm s ARG 98 Cb 0.00 -0.92 -0.04 0.00 0.52 0.00 0.00 34.95 34.51 2klm s ARG 98 CO 0.00 -0.34 -0.00 0.96 0.02 0.00 0.00 175.30 175.94 2klm s ILE 99 N 2.03 4.03 0.34 1.52 -4.36 -1.22 -4.65 121.20 118.89 2klm s ILE 99 Ca 0.05 -0.88 -0.24 0.00 -0.26 0.00 0.00 60.65 59.32 2klm s ILE 99 Cb -0.12 -2.88 -0.10 0.00 1.25 0.00 0.00 42.46 40.61 2klm s ILE 99 CO -0.05 0.20 0.92 0.42 0.24 0.00 0.00 174.94 176.67 2klm s THR 100 N -1.24 4.30 0.00 8.37 -4.23 -1.26 -1.44 115.64 120.14 2klm s THR 100 Ca 0.24 1.67 0.00 0.00 -1.18 0.00 0.00 61.69 62.42 2klm s THR 100 Cb -0.12 -3.89 0.00 0.00 1.34 0.00 0.00 72.50 69.84 2klm s THR 100 CO 0.16 0.03 0.97 1.87 -0.54 0.00 0.00 174.62 177.11 2klm n TRP 101 N 0.27 0.00 -0.37 3.99 -0.00 -1.26 -1.69 117.44 118.38 2klm n TRP 101 Ca 0.03 0.00 0.29 0.00 -0.00 0.00 0.00 57.50 57.82 2klm n TRP 101 Cb 0.51 -0.47 0.56 0.00 -0.00 0.00 0.00 31.31 31.90 2klm n TRP 101 CO 0.00 0.00 0.00 1.49 -0.00 0.00 0.00 177.69 179.18 2klm h GLU 102 N 0.00 0.20 -0.14 5.87 4.57 -1.96 0.36 114.58 123.48 2klm h GLU 102 Ca 0.00 -0.01 -0.00 0.00 -1.18 0.00 0.00 59.36 58.17 2klm h GLU 102 Cb 0.00 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.54 2klm h GLU 102 CO 0.00 0.13 0.08 1.96 -1.18 0.00 0.00 179.01 180.00 2klm h GLN 103 N 0.21 0.19 0.00 1.92 4.20 -1.85 -1.43 115.11 118.36 2klm h GLN 103 Ca 0.76 -0.02 -0.03 0.00 0.06 0.00 0.00 58.65 59.42 2klm h GLN 103 Cb 2.04 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 29.78 2klm h GLN 103 CO -0.52 0.20 -0.15 -0.39 -0.67 0.00 0.00 178.83 177.30 2klm h VAL 104 N 0.13 0.88 0.00 -0.54 -1.51 0.59 -1.41 116.25 114.39 2klm h VAL 104 Ca 0.05 -0.55 0.00 0.00 -1.23 0.00 0.00 66.70 64.97 2klm h VAL 104 Cb 0.06 1.31 0.00 0.00 -2.13 0.00 0.00 31.29 30.54 2klm h VAL 104 CO -0.01 0.14 0.00 0.18 -1.23 0.00 0.00 177.57 176.66 2klm n LEU 105 N -4.04 0.03 -0.26 4.19 4.77 -0.63 0.75 117.00 121.82 2klm n LEU 105 Ca -0.02 0.90 0.04 0.00 -0.03 0.00 0.00 56.01 56.89 2klm n LEU 105 Cb 0.23 -0.46 0.14 0.00 -2.33 0.00 0.00 43.42 41.00 2klm n LEU 105 CO 0.33 -0.46 0.79 -0.33 -1.33 0.00 0.00 177.39 176.39 2klm h GLU 106 N 0.00 0.06 -0.04 3.23 4.39 -1.25 2.96 114.58 123.93 2klm h GLU 106 Ca 0.00 -0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 2klm h GLU 106 Cb 0.00 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.63 2klm h GLU 106 CO 0.00 0.04 -0.02 0.82 -1.16 0.00 0.00 179.01 178.69 2klm h ILE 107 N 0.06 1.04 -0.02 3.13 2.04 -1.23 -0.67 117.51 121.86 2klm h ILE 107 Ca 0.40 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 66.09 2klm h ILE 107 Cb 0.68 1.04 0.00 0.00 -0.74 0.00 0.00 36.82 37.80 2klm h ILE 107 CO -0.70 0.05 -0.24 0.00 0.00 0.00 0.00 178.15 177.26 2klm n ALA 108 N -2.53 3.02 -0.53 1.87 0.00 0.45 -3.72 120.51 119.07 2klm n ALA 108 Ca -0.02 -0.64 0.00 0.00 0.00 0.00 0.00 53.44 52.78 2klm n ALA 108 Cb 0.12 -0.84 0.00 0.00 0.00 0.00 0.00 19.45 18.74 2klm n ALA 108 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2klm n LYS 109 N 0.53 0.00 -0.00 0.00 4.81 0.88 -4.65 118.16 119.74 2klm n LYS 109 Ca 0.12 0.13 -0.10 0.00 -0.87 0.00 0.00 58.31 57.59 2klm n LYS 109 Cb 0.51 -0.51 0.04 0.00 0.02 0.00 0.00 35.03 35.09 2klm n LYS 109 CO 0.00 0.00 0.00 1.96 1.17 0.00 0.00 177.40 180.53 2klm h GLN 110 N 0.00 0.59 -2.42 1.64 4.20 -1.71 -3.32 115.11 114.10 2klm h GLN 110 Ca 0.00 -0.37 -0.09 0.00 0.06 0.00 0.00 58.65 58.25 2klm h GLN 110 Cb 0.00 0.04 -0.03 0.00 0.30 0.00 0.00 27.48 27.79 2klm h GLN 110 CO 0.00 0.99 0.03 1.17 -0.67 0.00 0.00 178.83 180.35 2klm n LYS 111 N -3.96 0.97 -2.68 1.46 3.00 -1.24 -3.71 118.16 112.00 2klm n LYS 111 Ca -0.03 -0.45 -0.05 0.00 -0.00 0.00 0.00 58.31 57.78 2klm n LYS 111 Cb 0.61 -1.69 0.09 0.00 0.00 0.00 0.00 35.03 34.04 2klm n LYS 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2klm n MET 112 N 2.61 0.44 -0.32 1.64 0.00 -1.25 -4.83 117.12 115.41 2klm n MET 112 Ca 0.19 -1.09 0.10 0.00 0.00 0.00 0.00 57.70 56.91 2klm n MET 112 Cb 0.45 -0.35 0.31 0.00 0.00 0.00 0.00 33.22 33.64 2klm n MET 112 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 175.97 174.62 2klm h PRO 113 N 2.22 0.81 0.00 3.17 0.11 -1.85 -3.37 132.00 133.09 2klm h PRO 113 Ca -0.30 -0.05 -0.09 0.00 0.11 0.00 0.00 66.00 65.67 2klm h PRO 113 Cb 1.20 -0.18 -0.08 0.00 0.11 0.00 0.00 31.00 32.04 2klm h PRO 113 CO -0.00 0.53 -0.17 -0.40 -0.21 0.00 0.00 178.00 177.75 2klm n ASP 114 N -4.60 -0.73 0.14 -2.05 5.75 -1.26 -5.02 116.55 108.78 2klm n ASP 114 Ca 0.18 -1.44 -0.14 0.00 -0.01 0.00 0.00 54.79 53.38 2klm n ASP 114 Cb 0.42 0.29 -0.08 0.00 -1.03 0.00 0.00 41.12 40.72 2klm n ASP 114 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 2klm h LEU 115 N 0.28 -0.24 0.00 -2.12 6.46 -1.93 -3.44 115.31 114.32 2klm h LEU 115 Ca -0.31 -0.04 0.00 0.00 -0.12 0.00 0.00 57.88 57.41 2klm h LEU 115 Cb 1.11 0.06 0.00 0.00 -0.73 0.00 0.00 40.66 41.10 2klm h LEU 115 CO -0.14 -0.11 0.00 -3.20 -0.62 0.00 0.00 178.44 174.37 2klm n ASN 116 N -5.18 0.00 -3.71 1.25 4.05 -1.26 -5.16 115.26 105.24 2klm n ASN 116 Ca -0.09 -0.08 -0.16 0.00 0.45 0.00 0.00 54.58 54.70 2klm n ASN 116 Cb 0.16 0.00 -0.09 0.00 1.23 0.00 0.00 39.78 41.08 2klm n ASN 116 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 177.26 174.63 2klm s THR 117 N 0.00 0.00 0.00 -0.44 -4.23 -1.26 -5.05 115.64 104.66 2klm s THR 117 Ca 0.00 -1.97 0.00 0.00 -1.18 0.00 0.00 61.69 58.54 2klm s THR 117 Cb 0.00 -2.50 0.00 0.00 1.34 0.00 0.00 72.50 71.34 2klm s THR 117 CO 0.00 0.00 0.00 1.07 -0.54 0.00 0.00 174.62 175.15 2klm n THR 118 N -0.47 0.00 -2.61 3.99 5.66 -1.26 -4.71 114.28 114.89 2klm n THR 118 Ca 0.05 0.00 -0.37 0.00 -3.05 0.00 0.00 64.05 60.68 2klm n THR 118 Cb 0.64 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.37 2klm n THR 118 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 2klm s ASP 119 N -2.41 6.95 0.15 1.09 1.01 -1.26 -4.93 116.67 117.26 2klm s ASP 119 Ca 0.00 1.99 -0.16 0.00 0.71 0.00 0.00 52.55 55.09 2klm s ASP 119 Cb 0.00 -2.58 0.01 0.00 1.01 0.00 0.00 42.92 41.36 2klm s ASP 119 CO 0.00 -0.36 1.77 -0.07 0.21 0.00 0.00 175.17 176.72 2klm h LEU 120 N 2.74 0.52 -1.33 1.23 -0.00 -1.98 -1.55 115.31 114.93 2klm h LEU 120 Ca -0.48 -0.07 0.09 0.00 -0.00 0.00 0.00 57.88 57.42 2klm h LEU 120 Cb 1.21 -0.13 -0.05 0.00 -0.00 0.00 0.00 40.66 41.68 2klm h LEU 120 CO 0.63 0.44 0.52 1.05 -0.00 0.00 0.00 178.44 181.08 2klm h GLU 121 N 0.55 0.74 0.04 1.13 4.11 -1.97 2.14 114.58 121.33 2klm h GLU 121 Ca 0.15 -0.04 -0.00 0.00 0.07 0.00 0.00 59.36 59.53 2klm h GLU 121 Cb 0.03 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.11 2klm h GLU 121 CO -0.03 0.49 -0.02 0.00 0.07 0.00 0.00 179.01 179.52 2klm h ALA 122 N 1.59 -0.44 -0.99 1.06 0.00 -1.78 -1.27 119.26 117.43 2klm h ALA 122 Ca 0.36 -0.01 0.21 0.00 0.00 0.00 0.00 54.91 55.47 2klm h ALA 122 Cb 0.40 0.02 -0.11 0.00 0.00 0.00 0.00 17.79 18.09 2klm h ALA 122 CO -0.14 -0.44 0.59 0.00 0.00 0.00 0.00 179.25 179.27 2klm h ALA 123 N -1.92 1.69 0.05 0.00 0.00 -1.20 -0.08 119.26 117.80 2klm h ALA 123 Ca -0.01 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 2klm h ALA 123 Cb 0.04 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 2klm h ALA 123 CO 0.01 -0.14 -0.05 0.00 0.00 0.00 0.00 179.25 179.07 2klm h ALA 124 N 1.68 -0.76 -1.40 0.00 0.00 0.35 0.07 119.26 119.19 2klm h ALA 124 Ca 0.60 -0.02 0.41 0.00 0.00 0.00 0.00 54.91 55.90 2klm h ALA 124 Cb 1.01 0.33 -0.06 0.00 0.00 0.00 0.00 17.79 19.08 2klm h ALA 124 CO -0.42 -0.77 1.10 0.00 0.00 0.00 0.00 179.25 179.16 2klm h ARG 125 N -0.10 0.00 0.00 0.00 3.08 -0.30 0.57 114.38 117.63 2klm h ARG 125 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.04 2klm h ARG 125 Cb 0.09 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.14 2klm h ARG 125 CO -0.01 0.00 0.00 -0.12 -1.07 0.00 0.00 179.97 178.77 2klm n MET 126 N -3.88 0.00 -0.12 0.04 1.56 -0.07 0.30 117.12 114.95 2klm n MET 126 Ca 0.31 0.45 -0.05 0.00 -0.27 0.00 0.00 57.70 58.14 2klm n MET 126 Cb 1.54 -1.45 0.01 0.00 2.15 0.00 0.00 33.22 35.48 2klm n MET 126 CO 0.00 0.00 0.00 0.82 -0.73 0.00 0.00 175.97 176.06 2klm h ILE 127 N 0.00 0.54 0.00 1.12 2.04 -0.08 2.22 117.51 123.35 2klm h ILE 127 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 2klm h ILE 127 Cb 0.00 0.54 0.00 0.00 -0.74 0.00 0.00 36.82 36.62 2klm h ILE 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.15 2klm n ALA 128 N -2.76 -0.32 -0.32 1.87 0.00 -0.26 0.02 120.51 118.74 2klm n ALA 128 Ca 0.02 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.62 2klm n ALA 128 Cb 0.24 0.00 0.32 0.00 0.00 0.00 0.00 19.45 20.01 2klm n ALA 128 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2klm h GLY 129 N 0.00 1.37 1.01 0.00 0.00 0.48 2.24 103.07 108.17 2klm h GLY 129 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.40 2klm h GLY 129 CO 0.00 -0.49 0.57 1.76 0.00 0.00 0.00 176.54 178.38 2klm h SER 130 N 0.07 1.03 -0.47 0.19 0.02 0.38 -0.50 113.55 114.27 2klm h SER 130 Ca 0.60 -0.04 0.07 0.00 -0.84 0.00 0.00 61.79 61.58 2klm h SER 130 Cb 1.28 -0.26 -0.06 0.00 0.14 0.00 0.00 62.40 63.50 2klm h SER 130 CO -0.81 0.76 0.13 0.00 -1.14 0.00 0.00 176.83 175.77 2klm h ALA 131 N 1.31 0.55 -0.88 3.77 0.00 0.75 0.51 119.26 125.27 2klm h ALA 131 Ca 0.32 0.08 0.11 0.00 0.00 0.00 0.00 54.91 55.42 2klm h ALA 131 Cb -0.11 0.08 -0.08 0.00 0.00 0.00 0.00 17.79 17.67 2klm h ALA 131 CO -0.07 -0.27 0.51 -0.09 0.00 0.00 0.00 179.25 179.34 2klm h ARG 132 N 0.29 0.79 0.00 0.00 1.12 0.21 2.44 114.38 119.22 2klm h ARG 132 Ca 0.23 -0.05 0.00 0.00 -1.11 0.00 0.00 59.98 59.05 2klm h ARG 132 Cb 0.26 -0.18 0.00 0.00 -0.01 0.00 0.00 29.97 30.04 2klm h ARG 132 CO -0.26 0.53 0.00 0.45 -3.11 0.00 0.00 179.97 177.57 2klm n SER 133 N -4.73 0.00 0.12 -3.80 2.88 0.14 -0.84 113.62 107.39 2klm n SER 133 Ca 0.16 0.91 0.02 0.00 -1.33 0.00 0.00 58.87 58.62 2klm n SER 133 Cb 0.33 -0.41 0.08 0.00 -0.75 0.00 0.00 64.21 63.46 2klm n SER 133 CO 0.00 0.00 0.00 0.23 -1.23 0.00 0.00 175.04 174.04 2klm n MET 134 N -1.85 0.03 -1.02 -1.46 2.81 0.12 -4.63 117.12 111.10 2klm n MET 134 Ca 0.00 0.39 0.00 0.00 -1.81 0.00 0.00 57.70 56.28 2klm n MET 134 Cb 0.00 -2.14 0.00 0.00 -0.71 0.00 0.00 33.22 30.37 2klm n MET 134 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2klm n GLY 135 N -1.21 0.67 2.95 3.03 0.00 0.26 -5.05 105.19 105.84 2klm n GLY 135 Ca -0.00 -0.26 -0.14 0.00 0.00 0.00 0.00 46.02 45.62 2klm n GLY 135 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2klm s VAL 136 N -2.14 0.28 0.38 1.61 1.01 0.75 -4.90 120.40 117.40 2klm s VAL 136 Ca 0.00 -0.37 0.08 0.00 0.00 0.00 0.00 61.98 61.69 2klm s VAL 136 Cb 0.00 -0.28 -0.05 0.00 0.00 0.00 0.00 36.38 36.04 2klm s VAL 136 CO 0.00 -0.06 0.12 -1.61 0.00 0.00 0.00 175.10 173.55 2klm s GLU 137 N -0.46 2.20 0.15 2.72 2.02 -0.44 0.53 118.70 125.42 2klm s GLU 137 Ca -0.02 -1.78 -0.15 0.00 0.02 0.00 0.00 54.97 53.03 2klm s GLU 137 Cb -0.04 -1.98 -0.07 0.00 0.10 0.00 0.00 34.13 32.14 2klm s GLU 137 CO -0.00 -0.01 0.56 0.08 0.02 0.00 0.00 175.26 175.91 2klm s VAL 138 N -2.56 4.83 -1.90 2.63 1.01 -1.26 -3.38 120.40 119.77 2klm s VAL 138 Ca 0.38 0.89 0.00 0.00 0.00 0.00 0.00 61.98 63.25 2klm s VAL 138 Cb 0.02 -3.75 0.00 0.00 0.00 0.00 0.00 36.38 32.65 2klm s VAL 138 CO 0.21 0.26 0.45 0.55 0.00 0.00 0.00 175.10 176.58 2klm n VAL 139 N 0.87 0.00 0.00 2.92 3.14 -0.52 -4.81 118.33 119.92 2klm n VAL 139 Ca -0.06 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.32 2klm n VAL 139 Cb 0.52 -0.97 0.00 0.00 -1.06 0.00 0.00 33.84 32.32 2klm n VAL 139 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2klm n GLY 140 N -0.95 2.02 2.33 7.55 0.00 -1.26 -4.97 105.19 109.91 2klm n GLY 140 Ca 0.00 -1.83 -0.26 0.00 0.00 0.00 0.00 46.02 43.93 2klm n GLY 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2klm n ALA 141 N 1.84 2.97 -1.74 4.61 0.00 -1.26 -4.53 120.51 122.39 2klm n ALA 141 Ca 0.00 -3.76 -0.37 0.00 0.00 0.00 0.00 53.44 49.31 2klm n ALA 141 Cb 0.00 -0.84 0.05 0.00 0.00 0.00 0.00 19.45 18.66 2klm n ALA 141 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2klm s PRO 142 N -1.30 2.82 -0.15 0.00 0.02 -1.26 -4.95 135.00 130.18 2klm s PRO 142 Ca 0.35 2.03 0.06 0.00 0.02 0.00 0.00 61.00 63.46 2klm s PRO 142 Cb 0.13 -1.97 0.18 0.00 0.02 0.00 0.00 34.50 32.86 2klm s PRO 142 CO -0.11 -1.38 0.98 -1.91 -0.33 0.00 0.00 177.00 174.25 2klm n GLU 143 N -1.60 0.60 -4.14 5.54 0.00 -1.26 -5.15 120.64 114.63 2klm n GLU 143 Ca 0.14 -0.66 -0.10 0.00 0.00 0.00 0.00 57.16 56.54 2klm n GLU 143 Cb 0.48 0.30 -0.10 0.00 0.00 0.00 0.00 31.44 32.12 2klm n GLU 143 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 2klm s VAL 144 N 0.06 0.55 -0.30 6.31 1.01 -1.26 -5.14 120.40 121.64 2klm s VAL 144 Ca 0.04 -1.82 -0.03 0.00 0.00 0.00 0.00 61.98 60.16 2klm s VAL 144 Cb 0.20 -1.54 0.10 0.00 0.00 0.00 0.00 36.38 35.14 2klm s VAL 144 CO -0.06 -0.86 0.14 -0.54 0.00 0.00 0.00 175.10 173.78 2klm s LYS 145 N -3.65 0.25 -0.29 2.72 1.02 -1.26 -5.11 119.74 113.42 2klm s LYS 145 Ca 0.09 -0.63 -0.20 0.00 0.02 0.00 0.00 55.97 55.24 2klm s LYS 145 Cb 0.05 -1.20 0.16 0.00 -0.52 0.00 0.00 37.83 36.31 2klm s LYS 145 CO -0.06 -1.04 1.12 0.16 -0.92 0.00 0.00 175.35 174.61 2klm s ASP 146 N 1.97 -0.34 0.00 2.83 -4.77 -1.26 -5.38 116.67 109.73 2klm s ASP 146 Ca 0.10 0.58 0.30 0.00 -3.30 0.00 0.00 52.55 50.23 2klm s ASP 146 Cb -0.17 0.90 1.53 0.00 -1.09 0.00 0.00 42.92 44.09 2klm s ASP 146 CO -0.33 -0.10 2.01 0.00 0.70 0.00 0.00 175.17 177.46