#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2klm n LYS 2 N 0.00 0.00 0.00 0.03 5.02 -1.26 -4.47 118.16 117.48 2klm n LYS 2 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2klm n LYS 2 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2klm n LYS 2 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2klm n LYS 3 N -0.78 3.29 -1.63 1.97 5.02 -1.26 -4.74 118.16 120.02 2klm n LYS 3 Ca 0.00 0.00 -0.63 0.00 -2.02 0.00 0.00 58.31 55.66 2klm n LYS 3 Cb 0.00 0.00 -0.09 0.00 -0.02 0.00 0.00 35.03 34.92 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 0.00 0.01 -0.01 -0.18 3.14 -1.26 -4.06 118.33 115.96 2klm n VAL 4 Ca 0.00 -0.00 0.01 0.00 -2.96 0.00 0.00 64.34 61.39 2klm n VAL 4 Cb 0.00 -0.32 -0.05 0.00 -1.06 0.00 0.00 33.84 32.41 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 2.87 0.17 -3.82 1.55 0.24 -1.00 -4.92 118.33 113.43 2klm n VAL 5 Ca 0.26 -0.20 -0.13 0.00 -2.04 0.00 0.00 64.34 62.23 2klm n VAL 5 Cb 0.02 -0.13 -0.15 0.00 -1.47 0.00 0.00 33.84 32.11 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 -2.34 -0.03 -0.12 2.33 0.00 -0.94 -5.06 121.76 115.60 2klm s ALA 6 Ca -0.03 0.19 0.01 0.00 0.00 0.00 0.00 51.96 52.14 2klm s ALA 6 Cb 0.03 -0.14 0.02 0.00 0.00 0.00 0.00 23.12 23.03 2klm s ALA 6 CO 0.27 -0.06 -0.15 0.54 0.00 0.00 0.00 175.76 176.36 2klm s VAL 7 N 0.46 1.56 -0.77 0.00 0.11 -1.26 -0.03 120.40 120.47 2klm s VAL 7 Ca -0.04 -0.66 -0.15 0.00 -2.93 0.00 0.00 61.98 58.21 2klm s VAL 7 Cb -0.05 -1.43 0.20 0.00 -1.53 0.00 0.00 36.38 33.56 2klm s VAL 7 CO -0.01 0.45 0.73 -0.69 -3.33 0.00 0.00 175.10 172.25 2klm s VAL 8 N 1.14 5.51 -0.34 2.04 1.01 -0.64 -4.86 120.40 124.26 2klm s VAL 8 Ca -0.03 -2.25 -0.29 0.00 0.00 0.00 0.00 61.98 59.42 2klm s VAL 8 Cb -0.14 -4.45 0.00 0.00 0.00 0.00 0.00 36.38 31.79 2klm s VAL 8 CO -0.05 -1.01 1.36 -0.75 0.00 0.00 0.00 175.10 174.65 2klm s LYS 9 N 0.53 3.77 0.05 2.72 2.20 -1.26 -1.33 119.74 126.42 2klm s LYS 9 Ca 0.15 1.14 -0.09 0.00 -0.36 0.00 0.00 55.97 56.81 2klm s LYS 9 Cb -0.14 -3.95 0.03 0.00 -1.51 0.00 0.00 37.83 32.26 2klm s LYS 9 CO -0.07 -1.32 0.42 1.47 -0.36 0.00 0.00 175.35 175.50 2klm n LEU 10 N 8.17 0.00 -4.96 5.43 -0.00 -0.68 -5.00 117.00 119.96 2klm n LEU 10 Ca 0.16 -0.48 -0.24 0.00 -0.00 0.00 0.00 56.01 55.45 2klm n LEU 10 Cb 0.47 1.02 -0.02 0.00 -0.00 0.00 0.00 43.42 44.88 2klm n LEU 10 CO 0.66 -0.16 -0.05 -1.10 -0.00 0.00 0.00 177.39 176.75 2klm s GLN 11 N -2.02 3.45 -0.41 1.47 -0.21 -1.26 -1.52 119.66 119.15 2klm s GLN 11 Ca 0.10 -0.64 0.02 0.00 0.02 0.00 0.00 55.36 54.85 2klm s GLN 11 Cb -0.01 -2.90 0.14 0.00 1.00 0.00 0.00 33.01 31.24 2klm s GLN 11 CO 0.02 0.45 0.24 -0.51 -2.12 0.00 0.00 175.29 173.37 2klm s LEU 12 N -3.66 2.04 0.28 2.90 1.43 0.20 -4.87 118.68 117.01 2klm s LEU 12 Ca 0.35 -2.52 -0.30 0.00 -1.03 0.00 0.00 54.13 50.62 2klm s LEU 12 Cb -0.10 -0.78 -0.12 0.00 0.03 0.00 0.00 46.19 45.22 2klm s LEU 12 CO 0.29 -0.27 1.53 -2.65 0.23 0.00 0.00 176.35 175.48 2klm n PRO 13 N 3.64 2.49 -3.44 1.29 -0.02 -1.26 -1.78 135.00 135.91 2klm n PRO 13 Ca 0.11 0.89 -0.35 0.00 -2.02 0.00 0.00 63.50 62.13 2klm n PRO 13 Cb 0.36 -2.63 -0.06 0.00 -0.02 0.00 0.00 33.50 31.16 2klm n PRO 13 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2klm s ALA 14 N -0.04 3.64 -1.61 3.55 0.00 0.27 -3.05 121.76 124.51 2klm s ALA 14 Ca 0.65 -0.22 -0.15 0.00 0.00 0.00 0.00 51.96 52.24 2klm s ALA 14 Cb -0.54 -2.43 0.12 0.00 0.00 0.00 0.00 23.12 20.27 2klm s ALA 14 CO 0.49 0.49 0.85 0.41 0.00 0.00 0.00 175.76 178.00 2klm n GLY 15 N 0.95 -0.45 0.00 0.00 0.00 -1.25 -1.51 105.19 102.93 2klm n GLY 15 Ca -0.07 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.11 2klm n GLY 15 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2klm n LYS 16 N -4.51 0.00 -3.43 1.61 5.02 -1.25 -4.81 118.16 110.78 2klm n LYS 16 Ca 0.04 0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 56.01 2klm n LYS 16 Cb 0.52 0.00 -0.05 0.00 -0.02 0.00 0.00 35.03 35.48 2klm n LYS 16 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2klm s ALA 17 N 0.00 3.58 0.21 7.82 0.00 -1.17 -4.82 121.76 127.38 2klm s ALA 17 Ca 0.00 -0.30 -0.20 0.00 0.00 0.00 0.00 51.96 51.46 2klm s ALA 17 Cb 0.00 -2.41 0.04 0.00 0.00 0.00 0.00 23.12 20.75 2klm s ALA 17 CO 0.00 0.51 0.60 0.95 0.00 0.00 0.00 175.76 177.82 2klm s THR 18 N -1.81 0.01 0.00 0.00 -4.23 -1.26 -5.02 115.64 103.33 2klm s THR 18 Ca 0.47 -0.63 -0.00 0.00 -1.18 0.00 0.00 61.69 60.35 2klm s THR 18 Cb -0.11 -1.54 -0.02 0.00 1.34 0.00 0.00 72.50 72.17 2klm s THR 18 CO 0.22 -0.05 0.59 -0.81 -0.54 0.00 0.00 174.62 174.03 2klm n PRO 19 N -0.39 0.14 -2.68 3.99 -0.04 -1.26 -3.20 135.00 131.56 2klm n PRO 19 Ca -0.10 -0.06 -0.05 0.00 -0.04 0.00 0.00 63.50 63.25 2klm n PRO 19 Cb 0.62 -1.52 0.07 0.00 -0.04 0.00 0.00 33.50 32.63 2klm n PRO 19 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2klm n ALA 20 N 2.67 -1.38 -1.42 0.55 0.00 -1.26 -5.07 120.51 114.59 2klm n ALA 20 Ca 0.03 -0.82 -0.29 0.00 0.00 0.00 0.00 53.44 52.36 2klm n ALA 20 Cb 0.07 -1.54 0.17 0.00 0.00 0.00 0.00 19.45 18.14 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 0.12 0.50 0.65 0.00 0.04 -1.20 -4.89 135.00 130.21 2klm s PRO 21 Ca 0.15 0.19 0.37 0.00 0.04 0.00 0.00 61.00 61.75 2klm s PRO 21 Cb 0.24 -1.77 2.03 0.00 0.04 0.00 0.00 34.50 35.03 2klm s PRO 21 CO -0.08 -2.61 2.19 -1.35 0.04 0.00 0.00 177.00 175.18 2klm h PRO 22 N -1.80 0.00 0.00 0.56 0.11 -1.95 -2.92 132.00 126.00 2klm h PRO 22 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2klm h PRO 22 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 2klm h PRO 22 CO 0.54 0.00 -0.09 0.28 -0.21 0.00 0.00 178.00 178.52 2klm h VAL 23 N 0.00 0.00 0.00 3.15 2.07 -1.98 -3.47 116.25 116.02 2klm h VAL 23 Ca 0.02 -0.59 0.00 0.00 0.82 0.00 0.00 66.70 66.95 2klm h VAL 23 Cb 0.28 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.05 2klm h VAL 23 CO -0.00 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.20 2klm n GLY 24 N 1.81 0.60 0.42 2.17 0.00 -1.11 -1.14 105.19 107.96 2klm n GLY 24 Ca -0.01 0.79 -0.14 0.00 0.00 0.00 0.00 46.02 46.66 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 -0.56 0.00 1.61 0.11 -1.89 2.30 132.00 133.57 2klm h PRO 25 Ca 0.00 0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.15 2klm h PRO 25 Cb 0.00 0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.24 2klm h PRO 25 CO 0.00 -0.37 0.67 0.00 -0.21 0.00 0.00 178.00 178.09 2klm h ALA 26 N -0.09 1.56 0.00 -0.75 0.00 -1.48 0.17 119.26 118.67 2klm h ALA 26 Ca 0.05 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.84 2klm h ALA 26 Cb 0.67 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 2klm h ALA 26 CO -0.35 -0.56 -1.45 -0.11 0.00 0.00 0.00 179.25 176.78 2klm n LEU 27 N -2.21 2.87 -2.59 0.00 0.00 0.82 -4.70 117.00 111.20 2klm n LEU 27 Ca -0.00 -0.04 -0.28 0.00 0.00 0.00 0.00 56.01 55.68 2klm n LEU 27 Cb 0.68 -0.26 -0.05 0.00 0.00 0.00 0.00 43.42 43.79 2klm n LEU 27 CO 0.03 0.61 1.66 0.61 0.00 0.00 0.00 177.39 180.31 2klm n GLY 28 N 3.11 4.43 0.00 -3.96 0.00 0.74 -3.66 105.19 105.85 2klm n GLY 28 Ca -0.14 -1.90 0.00 0.00 0.00 0.00 0.00 46.02 43.98 2klm n GLY 28 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2klm n GLN 29 N 0.96 1.72 0.15 1.61 -0.06 -0.86 -4.74 117.38 116.17 2klm n GLN 29 Ca 0.50 0.00 0.13 0.00 -2.00 0.00 0.00 57.00 55.63 2klm n GLN 29 Cb 0.52 -0.14 0.51 0.00 -4.06 0.00 0.00 30.24 27.07 2klm n GLN 29 CO 0.00 0.00 0.00 1.12 -0.20 0.00 0.00 177.06 177.98 2klm h HIS 30 N 0.00 0.00 0.00 3.69 2.07 -1.82 -3.46 115.15 115.63 2klm h HIS 30 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 2klm h HIS 30 Cb 0.00 0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.98 2klm h HIS 30 CO 0.00 0.00 0.00 0.41 -3.07 0.00 0.00 177.93 175.27 2klm n GLY 31 N 0.09 2.96 0.00 6.13 0.00 -1.26 -5.03 105.19 108.08 2klm n GLY 31 Ca 0.02 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.82 4.61 0.00 -1.26 -5.00 120.51 116.05 2klm n ALA 32 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.30 2klm n ALA 32 Cb 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.32 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 -2.68 0.70 0.00 0.00 0.02 -1.26 -5.05 114.94 106.67 2klm s ASN 33 Ca 0.00 -0.32 0.00 0.00 -1.02 0.00 0.00 52.86 51.52 2klm s ASN 33 Cb 0.00 -0.01 0.00 0.00 0.02 0.00 0.00 41.25 41.26 2klm s ASN 33 CO 0.00 -0.07 0.00 -0.38 0.02 0.00 0.00 177.10 176.67 2klm n ILE 34 N 2.22 0.00 -0.47 0.60 2.08 -1.26 -3.78 119.36 118.75 2klm n ILE 34 Ca -0.18 0.30 0.39 0.00 0.56 0.00 0.00 62.75 63.83 2klm n ILE 34 Cb 0.56 -1.19 0.67 0.00 -0.75 0.00 0.00 39.64 38.94 2klm n ILE 34 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2klm h MET 35 N 0.00 0.04 0.25 0.38 -0.00 -1.98 1.31 114.93 114.94 2klm h MET 35 Ca 0.00 -0.00 -0.01 0.00 -0.00 0.00 0.00 59.70 59.69 2klm h MET 35 Cb 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 31.60 31.59 2klm h MET 35 CO 0.00 0.03 -0.13 1.49 -0.00 0.00 0.00 176.91 178.30 2klm h GLU 36 N 0.05 -0.34 -0.25 -0.10 4.57 -1.98 2.92 114.58 119.44 2klm h GLU 36 Ca 0.85 0.02 0.04 0.00 -1.18 0.00 0.00 59.36 59.10 2klm h GLU 36 Cb 2.74 0.08 -0.07 0.00 -0.16 0.00 0.00 28.75 31.33 2klm h GLU 36 CO -0.43 -0.23 -0.51 0.35 -1.18 0.00 0.00 179.01 177.01 2klm h PHE 37 N -0.36 -1.51 -0.51 0.92 3.57 0.16 -1.27 116.94 117.94 2klm h PHE 37 Ca -0.03 0.07 -0.00 0.00 3.53 0.00 0.00 57.97 61.53 2klm h PHE 37 Cb 0.28 0.69 -0.02 0.00 2.79 0.00 0.00 35.95 39.69 2klm h PHE 37 CO -0.07 -0.51 0.31 0.28 -2.23 0.00 0.00 178.31 176.10 2klm h VAL 38 N -0.48 1.15 -0.25 1.41 2.07 -0.97 -1.81 116.25 117.37 2klm h VAL 38 Ca 0.07 -0.34 0.03 0.00 0.82 0.00 0.00 66.70 67.28 2klm h VAL 38 Cb 0.64 0.45 -0.05 0.00 -1.52 0.00 0.00 31.29 30.81 2klm h VAL 38 CO -0.50 0.16 -0.30 0.50 0.02 0.00 0.00 177.57 177.45 2klm h LYS 39 N 0.69 -0.18 -0.85 1.57 3.64 0.63 2.68 116.57 124.74 2klm h LYS 39 Ca 0.19 0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.67 2klm h LYS 39 Cb -0.02 0.04 -0.07 0.00 -0.41 0.00 0.00 32.23 31.77 2klm h LYS 39 CO -0.04 -0.12 0.50 0.00 -2.27 0.00 0.00 179.45 177.52 2klm h ALA 40 N -0.58 1.21 -1.91 5.00 0.00 -1.16 1.08 119.26 122.89 2klm h ALA 40 Ca 0.04 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2klm h ALA 40 Cb 0.31 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2klm h ALA 40 CO -0.34 0.15 0.00 0.34 0.00 0.00 0.00 179.25 179.40 2klm n PHE 41 N -4.71 0.00 -0.33 0.00 7.35 0.17 -1.63 117.46 118.31 2klm n PHE 41 Ca 0.14 0.00 0.23 0.00 -0.76 0.00 0.00 57.45 57.06 2klm n PHE 41 Cb 0.26 -0.18 0.43 0.00 0.35 0.00 0.00 39.48 40.34 2klm n PHE 41 CO 0.00 0.00 0.00 -0.97 -0.76 0.00 0.00 176.76 175.03 2klm h ASN 42 N 0.00 -0.09 -0.53 -2.13 -0.73 0.47 1.05 115.58 113.62 2klm h ASN 42 Ca 0.00 0.27 0.05 0.00 1.87 0.00 0.00 56.30 58.49 2klm h ASN 42 Cb 0.00 0.38 -0.03 0.00 0.27 0.00 0.00 38.32 38.94 2klm h ASN 42 CO 0.00 -0.39 0.36 0.00 -0.37 0.00 0.00 177.43 177.03 2klm h ALA 43 N 1.99 1.84 0.06 1.57 0.00 0.13 2.60 119.26 127.45 2klm h ALA 43 Ca 0.72 -0.02 -0.19 0.00 0.00 0.00 0.00 54.91 55.42 2klm h ALA 43 Cb 1.71 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 19.36 2klm h ALA 43 CO -0.85 0.07 -0.98 0.00 0.00 0.00 0.00 179.25 177.50 2klm h ALA 44 N 1.71 0.14 -0.20 0.00 0.00 0.20 -1.52 119.26 119.59 2klm h ALA 44 Ca 0.23 -0.95 -0.03 0.00 0.00 0.00 0.00 54.91 54.16 2klm h ALA 44 Cb 0.25 0.41 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 2klm h ALA 44 CO -0.06 0.55 -0.01 1.79 0.00 0.00 0.00 179.25 181.53 2klm h THR 45 N -0.68 1.13 -0.38 0.00 1.35 -0.85 0.77 112.91 114.25 2klm h THR 45 Ca -0.23 -0.51 -0.14 0.00 -0.55 0.00 0.00 66.41 64.98 2klm h THR 45 Cb 1.43 0.99 -0.01 0.00 -1.73 0.00 0.00 68.15 68.84 2klm h THR 45 CO -0.03 0.17 -0.29 0.00 -0.25 0.00 0.00 175.52 175.13 2klm h ALA 46 N 1.72 0.55 0.00 6.62 0.00 0.45 1.33 119.26 129.92 2klm h ALA 46 Ca 0.07 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.56 2klm h ALA 46 Cb 0.21 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2klm h ALA 46 CO 0.00 0.58 0.00 -0.97 0.00 0.00 0.00 179.25 178.87 2klm h ASN 47 N 0.68 0.00 0.00 0.00 -0.73 0.06 -3.37 115.58 112.22 2klm h ASN 47 Ca 0.07 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.24 2klm h ASN 47 Cb 0.87 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.46 2klm h ASN 47 CO 0.08 0.00 0.00 0.23 -0.37 0.00 0.00 177.43 177.37 2klm n MET 48 N -2.84 0.00 -0.99 6.67 2.81 0.07 -5.07 117.12 117.77 2klm n MET 48 Ca -0.01 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.88 2klm n MET 48 Cb 0.14 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.65 2klm n MET 48 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2klm n GLY 49 N 3.49 1.03 3.73 3.03 0.00 0.45 -5.06 105.19 111.86 2klm n GLY 49 Ca 0.00 -0.76 -0.37 0.00 0.00 0.00 0.00 46.02 44.89 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 0.28 6.59 0.00 1.61 -4.77 -1.26 -3.90 116.67 115.22 2klm s ASP 50 Ca 0.00 0.70 0.00 0.00 -3.30 0.00 0.00 52.55 49.95 2klm s ASP 50 Cb 0.00 -2.25 0.00 0.00 -1.09 0.00 0.00 42.92 39.58 2klm s ASP 50 CO 0.00 0.04 0.00 0.00 0.70 0.00 0.00 175.17 175.91 2klm n ALA 51 N 3.61 0.00 -3.59 2.11 0.00 -0.57 -4.87 120.51 117.21 2klm n ALA 51 Ca -0.09 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.21 2klm n ALA 51 Cb 0.52 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.82 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 -1.46 -0.04 -0.26 0.00 1.01 -1.26 0.98 121.20 120.17 2klm s ILE 52 Ca 0.00 0.16 0.01 0.00 0.00 0.00 0.00 60.65 60.82 2klm s ILE 52 Cb 0.00 -0.16 0.07 0.00 0.01 0.00 0.00 42.46 42.38 2klm s ILE 52 CO 0.00 0.06 -0.04 -0.69 0.00 0.00 0.00 174.94 174.28 2klm s VAL 53 N 0.90 1.66 -0.35 2.92 1.01 -0.74 -4.89 120.40 120.92 2klm s VAL 53 Ca -0.07 -1.42 -0.29 0.00 0.00 0.00 0.00 61.98 60.20 2klm s VAL 53 Cb -0.10 -1.96 0.00 0.00 0.00 0.00 0.00 36.38 34.33 2klm s VAL 53 CO -0.04 -0.19 1.44 -2.16 0.00 0.00 0.00 175.10 174.15 2klm s PRO 54 N 1.31 3.68 0.14 2.72 0.04 -1.26 -0.63 135.00 141.00 2klm s PRO 54 Ca -0.03 1.15 -0.06 0.00 0.04 0.00 0.00 61.00 62.11 2klm s PRO 54 Cb -0.19 -4.00 -0.02 0.00 0.04 0.00 0.00 34.50 30.33 2klm s PRO 54 CO -0.08 -1.43 0.18 0.54 0.04 0.00 0.00 177.00 176.25 2klm s VAL 55 N 5.21 0.09 -0.19 -0.36 0.11 -0.58 -4.89 120.40 119.79 2klm s VAL 55 Ca 0.63 -1.59 0.01 0.00 -2.93 0.00 0.00 61.98 58.10 2klm s VAL 55 Cb -0.17 -1.86 0.04 0.00 -1.53 0.00 0.00 36.38 32.86 2klm s VAL 55 CO 0.30 -0.42 -0.13 -1.61 -3.33 0.00 0.00 175.10 169.91 2klm s GLU 56 N -3.99 2.25 -0.83 1.54 2.02 -1.26 -1.68 118.70 116.75 2klm s GLU 56 Ca 0.18 -0.84 -0.25 0.00 0.02 0.00 0.00 54.97 54.08 2klm s GLU 56 Cb 0.05 -2.44 0.00 0.00 0.10 0.00 0.00 34.13 31.85 2klm s GLU 56 CO -0.01 -0.37 1.64 0.42 0.02 0.00 0.00 175.26 176.96 2klm s ILE 57 N 1.36 3.62 -0.55 -1.63 1.01 -0.44 -4.74 121.20 119.83 2klm s ILE 57 Ca 0.00 -0.18 -0.27 0.00 0.00 0.00 0.00 60.65 60.20 2klm s ILE 57 Cb -0.15 -4.49 -0.02 0.00 0.01 0.00 0.00 42.46 37.80 2klm s ILE 57 CO -0.09 -1.42 1.85 -0.89 0.00 0.00 0.00 174.94 174.38 2klm s THR 58 N 7.46 3.39 -0.25 2.92 2.01 -0.71 -1.62 115.64 128.85 2klm s THR 58 Ca 0.55 0.28 -0.10 0.00 0.31 0.00 0.00 61.69 62.72 2klm s THR 58 Cb -0.06 -3.87 -0.05 0.00 0.01 0.00 0.00 72.50 68.53 2klm s THR 58 CO 0.05 -0.79 0.15 -0.63 -0.69 0.00 0.00 174.62 172.71 2klm s ILE 59 N 8.62 5.23 -0.05 1.82 1.01 0.96 -0.94 121.20 137.85 2klm s ILE 59 Ca 0.70 0.14 -0.06 0.00 0.00 0.00 0.00 60.65 61.43 2klm s ILE 59 Cb -0.15 -3.45 -0.04 0.00 0.01 0.00 0.00 42.46 38.84 2klm s ILE 59 CO 0.24 0.33 0.19 -0.31 0.00 0.00 0.00 174.94 175.38 2klm s TYR 60 N 1.24 3.58 0.61 3.97 1.51 0.08 -2.22 117.35 126.12 2klm s TYR 60 Ca 0.07 0.49 0.29 0.00 -1.01 0.00 0.00 57.07 56.91 2klm s TYR 60 Cb -0.14 -1.92 1.57 0.00 -0.11 0.00 0.00 41.96 41.35 2klm s TYR 60 CO 0.06 0.68 1.96 0.00 -1.11 0.00 0.00 175.55 177.13 2klm h ALA 61 N 4.34 1.88 0.00 3.71 0.00 -1.78 1.06 119.26 128.47 2klm h ALA 61 Ca -0.52 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.38 2klm h ALA 61 Cb 1.21 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2klm h ALA 61 CO 0.64 -0.52 0.00 -3.47 0.00 0.00 0.00 179.25 175.90 2klm n ASP 62 N -3.54 0.00 -2.86 0.00 -0.08 -1.26 -4.79 116.55 104.02 2klm n ASP 62 Ca 0.04 -0.68 -0.00 0.00 -1.51 0.00 0.00 54.79 52.64 2klm n ASP 62 Cb 0.51 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.97 2klm n ASP 62 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2klm n ARG 63 N -0.62 -1.19 -3.76 -0.67 1.74 0.36 -5.06 116.66 107.45 2klm n ARG 63 Ca 0.02 1.40 -0.13 0.00 -0.77 0.00 0.00 57.85 58.37 2klm n ARG 63 Cb 0.01 -5.23 -0.13 0.00 -1.02 0.00 0.00 32.46 26.09 2klm n ARG 63 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2klm s SER 64 N -2.86 -0.20 -0.39 0.55 1.04 -0.88 -4.96 113.70 106.01 2klm s SER 64 Ca 0.01 0.41 -0.05 0.00 0.48 0.00 0.00 55.95 56.81 2klm s SER 64 Cb -0.00 0.35 0.09 0.00 0.10 0.00 0.00 66.02 66.55 2klm s SER 64 CO 0.66 -0.12 0.17 -0.36 0.98 0.00 0.00 173.24 174.57 2klm s PHE 65 N 0.77 3.44 -0.24 5.02 0.40 -1.26 -0.74 117.98 125.37 2klm s PHE 65 Ca -0.05 -2.02 -0.14 0.00 -0.60 0.00 0.00 56.93 54.12 2klm s PHE 65 Cb -0.07 -2.88 -0.04 0.00 0.51 0.00 0.00 43.02 40.53 2klm s PHE 65 CO -0.04 -0.90 0.31 0.95 0.70 0.00 0.00 175.22 176.24 2klm s THR 66 N 1.25 5.25 -0.50 0.64 -4.23 -0.12 -4.91 115.64 113.02 2klm s THR 66 Ca 0.04 0.47 0.00 0.00 -1.18 0.00 0.00 61.69 61.02 2klm s THR 66 Cb -0.22 -3.64 0.00 0.00 1.34 0.00 0.00 72.50 69.98 2klm s THR 66 CO -0.02 0.25 0.00 2.22 -0.54 0.00 0.00 174.62 176.53 2klm n PHE 67 N 4.72 0.00 -1.24 3.99 -1.74 -1.26 -1.73 117.46 120.20 2klm n PHE 67 Ca -0.11 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.78 2klm n PHE 67 Cb 0.51 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.51 2klm n PHE 67 CO 0.00 0.00 0.00 0.28 -0.56 0.00 0.00 176.76 176.48 2klm n VAL 68 N 0.91 -2.47 -4.02 1.97 0.31 -1.26 -5.06 118.33 108.70 2klm n VAL 68 Ca 0.00 0.00 -0.31 0.00 -0.01 0.00 0.00 64.34 64.02 2klm n VAL 68 Cb 0.00 -3.18 -0.16 0.00 -0.91 0.00 0.00 33.84 29.60 2klm n VAL 68 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 2klm s THR 69 N 0.00 1.85 0.00 2.52 -4.23 -1.26 -5.07 115.64 109.45 2klm s THR 69 Ca 0.00 -1.26 0.00 0.00 -1.18 0.00 0.00 61.69 59.25 2klm s THR 69 Cb 0.00 -1.94 0.00 0.00 1.34 0.00 0.00 72.50 71.90 2klm s THR 69 CO 0.00 0.09 0.00 0.29 -0.54 0.00 0.00 174.62 174.46 2klm n LYS 70 N 4.59 0.00 -3.94 3.99 4.76 -1.26 -4.84 118.16 121.46 2klm n LYS 70 Ca -0.15 0.00 -0.30 0.00 -2.87 0.00 0.00 58.31 55.00 2klm n LYS 70 Cb 0.45 0.00 -0.01 0.00 -1.84 0.00 0.00 35.03 33.63 2klm n LYS 70 CO 0.00 0.00 0.00 -2.37 -1.37 0.00 0.00 177.40 173.66 2klm n THR 71 N 0.00 -3.50 -1.87 -0.18 5.66 -1.26 -4.95 114.28 108.17 2klm n THR 71 Ca 0.00 -0.62 -0.30 0.00 -3.05 0.00 0.00 64.05 60.08 2klm n THR 71 Cb 0.00 -2.86 0.16 0.00 -1.55 0.00 0.00 70.33 66.08 2klm n THR 71 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 2klm s PRO 72 N -6.59 0.89 0.31 1.09 0.05 -1.26 -4.98 135.00 124.50 2klm s PRO 72 Ca 0.17 -0.25 -0.05 0.00 0.05 0.00 0.00 61.00 60.92 2klm s PRO 72 Cb -0.07 -1.86 0.08 0.00 0.05 0.00 0.00 34.50 32.70 2klm s PRO 72 CO 0.90 -2.27 0.22 -0.35 0.05 0.00 0.00 177.00 175.55 2klm n PRO 73 N -3.71 -2.11 -0.05 0.56 -0.04 -1.26 -4.19 135.00 124.21 2klm n PRO 73 Ca 0.13 -0.36 0.01 0.00 -0.04 0.00 0.00 63.50 63.24 2klm n PRO 73 Cb 0.60 -0.40 -0.00 0.00 -0.04 0.00 0.00 33.50 33.66 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 -3.54 -0.13 0.26 0.55 0.00 -1.26 -3.84 120.51 112.55 2klm n ALA 74 Ca -0.05 0.02 0.05 0.00 0.00 0.00 0.00 53.44 53.46 2klm n ALA 74 Cb 0.13 -0.04 0.11 0.00 0.00 0.00 0.00 19.45 19.65 2klm n ALA 74 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2klm h SER 75 N -0.05 0.00 -0.93 0.00 4.64 -1.92 -0.26 113.55 115.03 2klm h SER 75 Ca 0.00 0.00 0.27 0.00 -0.47 0.00 0.00 61.79 61.59 2klm h SER 75 Cb 0.05 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 61.98 2klm h SER 75 CO 0.00 0.00 0.23 1.88 -0.87 0.00 0.00 176.83 178.07 2klm h TYR 76 N 0.00 0.33 0.00 4.77 0.05 -1.79 -1.98 116.97 118.35 2klm h TYR 76 Ca 0.07 0.05 0.00 0.00 0.05 0.00 0.00 58.73 58.90 2klm h TYR 76 Cb 2.04 0.01 0.00 0.00 1.01 0.00 0.00 36.73 39.78 2klm h TYR 76 CO 0.00 -0.31 -0.67 1.47 -1.05 0.00 0.00 178.16 177.60 2klm n LEU 77 N -5.30 0.00 -0.14 3.88 -0.00 -0.23 -4.67 117.00 110.54 2klm n LEU 77 Ca 0.25 0.00 0.17 0.00 -0.00 0.00 0.00 56.01 56.43 2klm n LEU 77 Cb 0.80 0.00 0.55 0.00 -0.00 0.00 0.00 43.42 44.77 2klm n LEU 77 CO 0.02 0.00 1.21 0.40 -0.00 0.00 0.00 177.39 179.02 2klm h ILE 78 N 0.00 0.76 -0.52 1.47 2.04 -1.20 0.17 117.51 120.23 2klm h ILE 78 Ca 0.00 -0.11 0.10 0.00 1.00 0.00 0.00 64.86 65.85 2klm h ILE 78 Cb 0.36 0.41 -0.08 0.00 -0.74 0.00 0.00 36.82 36.77 2klm h ILE 78 CO 0.00 0.06 0.01 0.03 0.00 0.00 0.00 178.15 178.25 2klm h ARG 79 N 0.32 0.13 0.64 2.37 2.47 -1.58 2.53 114.38 121.26 2klm h ARG 79 Ca 0.36 -0.01 -0.03 0.00 -1.26 0.00 0.00 59.98 59.04 2klm h ARG 79 Cb 0.94 -0.03 0.01 0.00 -1.65 0.00 0.00 29.97 29.24 2klm h ARG 79 CO -0.10 0.08 -0.31 -0.22 0.56 0.00 0.00 179.97 179.99 2klm h LYS 80 N 0.13 -0.82 -0.13 0.04 3.11 -1.24 1.47 116.57 119.13 2klm h LYS 80 Ca 0.26 0.06 0.04 0.00 -2.81 0.00 0.00 60.65 58.20 2klm h LYS 80 Cb 0.40 0.19 -0.01 0.00 -1.00 0.00 0.00 32.23 31.81 2klm h LYS 80 CO -0.43 -0.55 0.40 0.00 -2.81 0.00 0.00 179.45 176.07 2klm h ALA 81 N -1.41 1.61 -2.12 5.00 0.00 -0.96 -3.18 119.26 118.21 2klm h ALA 81 Ca -0.09 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2klm h ALA 81 Cb 0.65 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.45 2klm h ALA 81 CO 0.14 -0.47 0.00 0.00 0.00 0.00 0.00 179.25 178.92 2klm n ALA 82 N -2.01 0.00 0.00 0.00 0.00 0.85 -4.46 120.51 114.88 2klm n ALA 82 Ca 0.01 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.41 2klm n ALA 82 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.94 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 2.27 0.69 1.27 0.00 0.00 0.50 -4.55 105.19 105.37 2klm n GLY 83 Ca 0.00 -0.40 0.07 0.00 0.00 0.00 0.00 46.02 45.69 2klm n GLY 83 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2klm n LEU 84 N 0.00 3.71 -4.12 0.99 4.77 -1.25 -4.92 117.00 116.18 2klm n LEU 84 Ca 0.00 -1.87 -0.36 0.00 -0.03 0.00 0.00 56.01 53.75 2klm n LEU 84 Cb 0.00 -0.50 0.07 0.00 -2.33 0.00 0.00 43.42 40.66 2klm n LEU 84 CO 0.00 0.63 -1.21 1.21 -1.33 0.00 0.00 177.39 176.69 2klm n GLU 85 N 0.77 -0.31 -0.30 3.23 2.13 -1.26 -4.75 120.64 120.15 2klm n GLU 85 Ca 0.19 -0.08 0.12 0.00 0.66 0.00 0.00 57.16 58.06 2klm n GLU 85 Cb 0.71 -1.27 0.29 0.00 0.27 0.00 0.00 31.44 31.44 2klm n GLU 85 CO 0.00 0.00 0.00 1.57 -0.41 0.00 0.00 177.13 178.29 2klm h LYS 86 N -1.28 0.41 0.00 5.31 2.10 -2.04 -3.47 116.57 117.60 2klm h LYS 86 Ca -0.44 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.19 2klm h LYS 86 Cb 1.33 -0.09 0.00 0.00 -0.90 0.00 0.00 32.23 32.57 2klm h LYS 86 CO 0.27 0.27 0.00 0.41 -2.00 0.00 0.00 179.45 178.40 2klm n GLY 87 N -1.34 2.98 3.30 0.07 0.00 -1.26 -4.92 105.19 104.02 2klm n GLY 87 Ca 0.21 -1.60 -0.39 0.00 0.00 0.00 0.00 46.02 44.24 2klm n GLY 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2klm s ALA 88 N -2.00 3.12 0.00 4.61 0.00 -1.26 -4.82 121.76 121.41 2klm s ALA 88 Ca 0.00 -1.76 0.00 0.00 0.00 0.00 0.00 51.96 50.20 2klm s ALA 88 Cb 0.00 -2.38 0.00 0.00 0.00 0.00 0.00 23.12 20.74 2klm s ALA 88 CO 0.00 -1.37 0.00 1.58 0.00 0.00 0.00 175.76 175.97 2klm n HIS 89 N 4.87 0.00 -3.78 0.00 -0.00 -1.26 -4.60 115.22 110.45 2klm n HIS 89 Ca -0.12 0.00 -0.12 0.00 0.46 0.00 0.00 57.72 57.94 2klm n HIS 89 Cb 0.45 0.00 -0.08 0.00 -0.12 0.00 0.00 29.99 30.24 2klm n HIS 89 CO 0.00 0.00 0.00 -1.59 0.46 0.00 0.00 176.34 175.21 2klm s LYS 90 N 0.00 0.71 0.31 1.57 -2.85 -1.26 -5.14 119.74 113.08 2klm s LYS 90 Ca 0.00 -0.38 -0.28 0.00 -1.00 0.00 0.00 55.97 54.31 2klm s LYS 90 Cb 0.00 0.31 -0.13 0.00 -2.06 0.00 0.00 37.83 35.94 2klm s LYS 90 CO 0.00 -0.21 1.12 -2.30 0.10 0.00 0.00 175.35 174.07 2klm n PRO 91 N 0.97 1.67 0.00 1.78 -0.02 -1.26 -4.97 135.00 133.17 2klm n PRO 91 Ca -0.20 0.59 0.00 0.00 -2.02 0.00 0.00 63.50 61.86 2klm n PRO 91 Cb 0.57 -2.05 0.00 0.00 -0.02 0.00 0.00 33.50 32.01 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 1.03 0.25 3.00 -1.23 0.00 -1.26 -5.06 105.19 101.92 2klm n GLY 92 Ca 0.08 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.26 0.35 0.00 1.61 0.52 -1.26 -5.16 118.95 114.76 2klm s ARG 93 Ca 0.00 -0.67 0.00 0.00 -0.52 0.00 0.00 55.73 54.54 2klm s ARG 93 Cb 0.00 0.13 0.00 0.00 0.52 0.00 0.00 34.95 35.60 2klm s ARG 93 CO 0.00 -0.06 0.00 0.39 0.02 0.00 0.00 175.30 175.65 2klm n GLU 94 N 1.42 -0.60 -2.49 3.54 1.02 -1.26 -4.75 120.64 117.52 2klm n GLU 94 Ca -0.23 0.00 -0.02 0.00 -0.02 0.00 0.00 57.16 56.89 2klm n GLU 94 Cb 0.56 0.00 -0.02 0.00 -0.02 0.00 0.00 31.44 31.96 2klm n GLU 94 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2klm n LYS 95 N -1.07 -3.46 -4.14 3.49 5.02 -1.26 -5.04 118.16 111.71 2klm n LYS 95 Ca 0.00 2.59 -0.11 0.00 -2.02 0.00 0.00 58.31 58.78 2klm n LYS 95 Cb 0.00 -3.44 -0.10 0.00 -0.02 0.00 0.00 35.03 31.47 2klm n LYS 95 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2klm s VAL 96 N -0.41 0.59 0.00 -0.18 0.11 -1.26 -5.05 120.40 114.20 2klm s VAL 96 Ca -0.09 -1.73 0.00 0.00 -2.93 0.00 0.00 61.98 57.23 2klm s VAL 96 Cb 0.01 -1.43 0.00 0.00 -1.53 0.00 0.00 36.38 33.43 2klm s VAL 96 CO 0.25 -0.79 0.00 0.61 -3.33 0.00 0.00 175.10 171.84 2klm n GLY 97 N 0.30 0.92 2.82 6.54 0.00 -1.26 -4.59 105.19 109.92 2klm n GLY 97 Ca -0.15 -0.57 -0.30 0.00 0.00 0.00 0.00 46.02 45.00 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 -0.08 1.32 0.06 1.61 0.52 -1.26 -1.48 118.95 119.64 2klm s ARG 98 Ca 0.00 -1.87 0.00 0.00 -0.52 0.00 0.00 55.73 53.34 2klm s ARG 98 Cb 0.00 -2.61 -0.04 0.00 0.52 0.00 0.00 34.95 32.82 2klm s ARG 98 CO 0.00 -1.06 0.19 0.96 0.02 0.00 0.00 175.30 175.40 2klm s ILE 99 N 0.65 5.25 0.35 1.52 -4.36 -1.20 -4.63 121.20 118.78 2klm s ILE 99 Ca 0.14 -0.44 -0.05 0.00 -0.26 0.00 0.00 60.65 60.04 2klm s ILE 99 Cb -0.22 -3.55 -0.05 0.00 1.25 0.00 0.00 42.46 39.89 2klm s ILE 99 CO -0.07 0.15 0.63 0.42 0.24 0.00 0.00 174.94 176.30 2klm s THR 100 N -1.48 4.98 0.00 8.37 -4.23 -1.26 -0.82 115.64 121.20 2klm s THR 100 Ca 0.34 0.08 0.00 0.00 -1.18 0.00 0.00 61.69 60.93 2klm s THR 100 Cb -0.13 -3.78 0.00 0.00 1.34 0.00 0.00 72.50 69.93 2klm s THR 100 CO 0.26 -0.49 0.85 1.87 -0.54 0.00 0.00 174.62 176.57 2klm n TRP 101 N -1.37 0.00 -0.34 3.99 -0.00 -1.26 -1.90 117.44 116.55 2klm n TRP 101 Ca -0.01 0.00 0.23 0.00 -0.00 0.00 0.00 57.50 57.71 2klm n TRP 101 Cb 0.54 -0.42 0.46 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 0.39 -0.27 5.87 4.57 -1.96 0.46 114.58 123.64 2klm h GLU 102 Ca 0.00 -0.02 -0.00 0.00 -1.18 0.00 0.00 59.36 58.16 2klm h GLU 102 Cb 0.00 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.49 2klm h GLU 102 CO 0.00 0.26 0.16 1.96 -1.18 0.00 0.00 179.01 180.21 2klm h GLN 103 N 0.40 0.36 0.00 1.92 4.20 -1.96 -0.74 115.11 119.30 2klm h GLN 103 Ca 0.69 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 59.33 2klm h GLN 103 Cb 1.57 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 29.27 2klm h GLN 103 CO -0.50 0.28 -0.16 -0.39 -0.67 0.00 0.00 178.83 177.39 2klm h VAL 104 N 0.34 1.02 0.00 -0.54 -1.51 -0.22 -1.02 116.25 114.32 2klm h VAL 104 Ca 0.10 -0.58 0.00 0.00 -1.23 0.00 0.00 66.70 64.99 2klm h VAL 104 Cb 0.01 1.32 0.00 0.00 -2.13 0.00 0.00 31.29 30.49 2klm h VAL 104 CO -0.02 0.16 0.00 0.18 -1.23 0.00 0.00 177.57 176.66 2klm n LEU 105 N -4.20 0.13 -0.30 4.19 4.77 -0.39 -0.25 117.00 120.94 2klm n LEU 105 Ca -0.02 0.79 0.13 0.00 -0.03 0.00 0.00 56.01 56.87 2klm n LEU 105 Cb 0.23 -0.37 0.28 0.00 -2.33 0.00 0.00 43.42 41.23 2klm n LEU 105 CO 0.35 -0.37 0.91 -0.33 -1.33 0.00 0.00 177.39 176.62 2klm h GLU 106 N 0.00 0.16 0.00 3.23 5.08 -1.25 2.65 114.58 124.45 2klm h GLU 106 Ca 0.00 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 2klm h GLU 106 Cb 0.00 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.21 2klm h GLU 106 CO 0.00 0.11 -0.04 0.82 -1.00 0.00 0.00 179.01 178.89 2klm h ILE 107 N 0.17 0.55 -0.02 3.13 2.04 -1.14 -0.77 117.51 121.47 2klm h ILE 107 Ca 0.55 -0.19 0.00 0.00 1.00 0.00 0.00 64.86 66.22 2klm h ILE 107 Cb 1.10 1.12 0.00 0.00 -0.74 0.00 0.00 36.82 38.30 2klm h ILE 107 CO -0.69 0.04 -0.07 0.00 0.00 0.00 0.00 178.15 177.43 2klm n ALA 108 N -2.31 2.62 -0.47 1.87 0.00 0.76 -4.14 120.51 118.83 2klm n ALA 108 Ca -0.03 -0.61 0.00 0.00 0.00 0.00 0.00 53.44 52.81 2klm n ALA 108 Cb 0.13 -0.55 0.00 0.00 0.00 0.00 0.00 19.45 19.03 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 0.70 0.00 -0.19 0.00 4.81 0.57 -4.54 118.16 119.51 2klm n LYS 109 Ca 0.09 0.20 -0.07 0.00 -0.87 0.00 0.00 58.31 57.65 2klm n LYS 109 Cb 0.39 -0.64 0.02 0.00 0.02 0.00 0.00 35.03 34.83 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 0.79 -5.13 1.64 4.20 -1.78 -3.32 115.11 111.51 2klm h GLN 110 Ca 0.00 -0.12 -0.61 0.00 0.06 0.00 0.00 58.65 57.98 2klm h GLN 110 Cb 0.00 -0.14 -0.04 0.00 0.30 0.00 0.00 27.48 27.60 2klm h GLN 110 CO 0.00 0.65 2.21 1.63 -0.67 0.00 0.00 178.83 182.65 2klm n LYS 111 N -4.56 2.53 -2.87 1.46 4.01 -1.26 -4.65 118.16 112.81 2klm n LYS 111 Ca 0.03 -2.74 -0.16 0.00 -0.51 0.00 0.00 58.31 54.93 2klm n LYS 111 Cb 0.12 -3.42 -0.00 0.00 -0.51 0.00 0.00 35.03 31.22 2klm n LYS 111 CO 0.00 0.00 0.00 -1.33 -1.11 0.00 0.00 177.40 174.96 2klm n MET 112 N 7.62 1.52 0.19 1.97 2.81 -1.25 -4.67 117.12 125.30 2klm n MET 112 Ca 0.49 -3.59 0.07 0.00 -1.81 0.00 0.00 57.70 52.86 2klm n MET 112 Cb 0.44 -1.62 0.59 0.00 -0.71 0.00 0.00 33.22 31.91 2klm n MET 112 CO 0.00 0.00 0.00 -1.00 1.51 0.00 0.00 175.97 176.48 2klm h PRO 113 N 2.95 0.13 0.00 0.03 0.13 -1.94 -3.44 132.00 129.86 2klm h PRO 113 Ca 0.04 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.16 2klm h PRO 113 Cb 1.01 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.11 2klm h PRO 113 CO 0.57 0.09 0.00 -3.47 -0.23 0.00 0.00 178.00 174.95 2klm n ASP 114 N -4.52 0.00 0.00 1.44 2.03 -1.26 -4.98 116.55 109.26 2klm n ASP 114 Ca -0.01 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.30 2klm n ASP 114 Cb 0.10 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.50 2klm n ASP 114 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2klm n LEU 115 N -0.39 0.58 -2.13 -2.67 4.77 -1.26 -2.31 117.00 113.60 2klm n LEU 115 Ca 0.00 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.83 2klm n LEU 115 Cb 0.00 -0.93 -0.02 0.00 -2.33 0.00 0.00 43.42 40.13 2klm n LEU 115 CO 0.00 -0.31 -0.18 -3.20 -1.33 0.00 0.00 177.39 172.37 2klm n ASN 116 N 0.05 -4.39 -3.99 -1.43 5.15 -1.26 -4.92 115.26 104.47 2klm n ASN 116 Ca 0.00 0.20 -0.08 0.00 -0.60 0.00 0.00 54.58 54.10 2klm n ASN 116 Cb 0.02 -3.79 -0.08 0.00 -0.53 0.00 0.00 39.78 35.40 2klm n ASN 116 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 2klm s THR 117 N -2.61 0.15 0.00 -0.44 -4.23 -0.98 -5.05 115.64 102.48 2klm s THR 117 Ca 0.00 -1.52 0.00 0.00 -1.18 0.00 0.00 61.69 58.99 2klm s THR 117 Cb 0.00 -1.58 0.00 0.00 1.34 0.00 0.00 72.50 72.26 2klm s THR 117 CO 0.00 -0.68 0.00 1.07 -0.54 0.00 0.00 174.62 174.47 2klm n THR 118 N -0.04 0.00 -2.53 3.99 5.66 -1.26 -4.91 114.28 115.19 2klm n THR 118 Ca -0.12 0.00 -0.36 0.00 -3.05 0.00 0.00 64.05 60.51 2klm n THR 118 Cb 0.62 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.36 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 -1.46 6.73 0.15 1.09 1.01 -1.26 -4.93 116.67 118.00 2klm s ASP 119 Ca 0.00 2.05 -0.16 0.00 0.71 0.00 0.00 52.55 55.15 2klm s ASP 119 Cb 0.00 -2.59 0.01 0.00 1.01 0.00 0.00 42.92 41.36 2klm s ASP 119 CO 0.00 -0.51 1.79 -0.07 0.21 0.00 0.00 175.17 176.59 2klm h LEU 120 N 2.47 0.49 -1.12 1.23 3.38 -1.98 -1.68 115.31 118.10 2klm h LEU 120 Ca -0.48 -0.05 0.03 0.00 0.09 0.00 0.00 57.88 57.47 2klm h LEU 120 Cb 1.22 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 41.79 2klm h LEU 120 CO 0.62 0.40 0.59 1.05 0.09 0.00 0.00 178.44 181.19 2klm h GLU 121 N 0.55 1.13 0.07 1.13 4.11 -1.97 0.93 114.58 120.52 2klm h GLU 121 Ca 0.15 -0.07 -0.00 0.00 0.07 0.00 0.00 59.36 59.51 2klm h GLU 121 Cb -0.01 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 28.99 2klm h GLU 121 CO -0.03 0.75 -0.03 0.00 0.07 0.00 0.00 179.01 179.77 2klm h ALA 122 N 1.46 -0.68 -1.02 1.06 0.00 -1.81 -1.47 119.26 116.80 2klm h ALA 122 Ca 0.35 -0.02 0.25 0.00 0.00 0.00 0.00 54.91 55.49 2klm h ALA 122 Cb -0.04 0.04 -0.10 0.00 0.00 0.00 0.00 17.79 17.69 2klm h ALA 122 CO -0.10 -0.67 0.64 0.00 0.00 0.00 0.00 179.25 179.13 2klm h ALA 123 N -1.92 2.08 0.11 0.00 0.00 -1.28 -0.67 119.26 117.57 2klm h ALA 123 Ca -0.01 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2klm h ALA 123 Cb 0.07 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2klm h ALA 123 CO 0.02 -0.49 -0.20 0.00 0.00 0.00 0.00 179.25 178.57 2klm h ALA 124 N 1.65 -0.81 -1.16 0.00 0.00 0.96 0.26 119.26 120.16 2klm h ALA 124 Ca 0.60 -0.06 0.34 0.00 0.00 0.00 0.00 54.91 55.79 2klm h ALA 124 Cb 1.38 0.54 -0.11 0.00 0.00 0.00 0.00 17.79 19.60 2klm h ALA 124 CO -0.34 -0.84 0.75 0.00 0.00 0.00 0.00 179.25 178.82 2klm h ARG 125 N -0.33 0.25 0.00 0.00 3.08 -0.06 0.33 114.38 117.64 2klm h ARG 125 Ca -0.01 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.02 2klm h ARG 125 Cb 0.31 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.30 2klm h ARG 125 CO -0.07 0.16 0.00 -0.12 -1.07 0.00 0.00 179.97 178.87 2klm n MET 126 N -4.64 0.00 -0.13 0.04 1.56 -0.07 0.38 117.12 114.26 2klm n MET 126 Ca 0.30 0.44 -0.04 0.00 -0.27 0.00 0.00 57.70 58.12 2klm n MET 126 Cb 1.11 -1.33 0.02 0.00 2.15 0.00 0.00 33.22 35.18 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 1.08 0.08 2.51 117.51 122.84 2klm h ILE 127 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.47 2klm h ILE 127 Cb 0.00 0.54 0.00 0.00 -3.07 0.00 0.00 36.82 34.29 2klm h ILE 127 CO 0.00 0.00 0.00 0.00 -0.69 0.00 0.00 178.15 177.46 2klm n ALA 128 N -2.78 -0.32 -0.32 1.87 0.00 0.10 0.62 120.51 119.69 2klm n ALA 128 Ca 0.03 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.57 2klm n ALA 128 Cb 0.24 0.00 0.23 0.00 0.00 0.00 0.00 19.45 19.92 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 1.04 0.69 0.00 0.00 0.71 2.41 103.07 107.92 2klm h GLY 129 Ca 0.00 0.17 0.06 0.00 0.00 0.00 0.00 47.33 47.56 2klm h GLY 129 CO 0.00 -0.42 0.44 1.76 0.00 0.00 0.00 176.54 178.32 2klm h SER 130 N 0.04 0.67 -0.57 0.19 0.02 0.44 0.14 113.55 114.48 2klm h SER 130 Ca 0.52 0.03 0.10 0.00 -0.84 0.00 0.00 61.79 61.60 2klm h SER 130 Cb 1.00 -0.11 -0.08 0.00 0.14 0.00 0.00 62.40 63.35 2klm h SER 130 CO -0.86 0.43 0.13 0.00 -1.14 0.00 0.00 176.83 175.39 2klm h ALA 131 N 1.38 0.68 -0.68 3.77 0.00 0.97 1.84 119.26 127.21 2klm h ALA 131 Ca 0.34 0.12 0.12 0.00 0.00 0.00 0.00 54.91 55.48 2klm h ALA 131 Cb 0.19 0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 2klm h ALA 131 CO -0.18 -0.29 0.46 -0.09 0.00 0.00 0.00 179.25 179.14 2klm h ARG 132 N 0.27 0.44 0.00 0.00 1.12 0.14 1.90 114.38 118.25 2klm h ARG 132 Ca 0.30 -0.03 0.00 0.00 -1.11 0.00 0.00 59.98 59.14 2klm h ARG 132 Cb 0.42 -0.10 0.00 0.00 -0.01 0.00 0.00 29.97 30.28 2klm h ARG 132 CO -0.37 0.29 0.00 0.45 -3.11 0.00 0.00 179.97 177.23 2klm n SER 133 N -4.48 0.00 -0.27 -3.80 2.88 0.59 -2.72 113.62 105.83 2klm n SER 133 Ca 0.12 0.54 0.31 0.00 -1.33 0.00 0.00 58.87 58.51 2klm n SER 133 Cb 0.43 -0.18 0.48 0.00 -0.75 0.00 0.00 64.21 64.19 2klm n SER 133 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2klm h MET 134 N 0.00 0.00 0.00 -1.46 -0.00 -0.29 -3.42 114.93 109.76 2klm h MET 134 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 2klm h MET 134 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.60 2klm h MET 134 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.91 177.32 2klm n GLY 135 N -1.74 0.79 3.24 -3.00 0.00 0.22 -5.08 105.19 99.62 2klm n GLY 135 Ca 0.25 -0.82 -0.09 0.00 0.00 0.00 0.00 46.02 45.36 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 -1.56 0.11 0.14 1.61 1.01 0.58 -4.74 120.40 117.55 2klm s VAL 136 Ca 0.00 -1.45 0.06 0.00 0.00 0.00 0.00 61.98 60.59 2klm s VAL 136 Cb 0.00 -1.68 -0.04 0.00 0.00 0.00 0.00 36.38 34.66 2klm s VAL 136 CO 0.00 -0.52 -0.14 -1.61 0.00 0.00 0.00 175.10 172.84 2klm s GLU 137 N -3.94 1.09 0.33 2.72 2.02 -0.55 -2.03 118.70 118.34 2klm s GLU 137 Ca 0.13 -1.33 -0.11 0.00 0.02 0.00 0.00 54.97 53.68 2klm s GLU 137 Cb 0.05 -0.93 -0.07 0.00 0.10 0.00 0.00 34.13 33.28 2klm s GLU 137 CO -0.04 0.17 0.69 0.08 0.02 0.00 0.00 175.26 176.17 2klm s VAL 138 N -2.42 4.81 -0.84 2.63 1.01 -1.26 -3.24 120.40 121.09 2klm s VAL 138 Ca 0.12 0.64 0.22 0.00 0.00 0.00 0.00 61.98 62.96 2klm s VAL 138 Cb -0.03 -3.67 -0.17 0.00 0.00 0.00 0.00 36.38 32.52 2klm s VAL 138 CO 0.03 -0.29 1.00 0.52 0.00 0.00 0.00 175.10 176.36 2klm n VAL 139 N -0.69 0.04 -3.27 2.92 0.31 -0.00 -4.55 118.33 113.08 2klm n VAL 139 Ca 0.02 -0.09 -0.25 0.00 -0.01 0.00 0.00 64.34 64.01 2klm n VAL 139 Cb 0.53 0.60 -0.07 0.00 -0.91 0.00 0.00 33.84 33.99 2klm n VAL 139 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2klm n GLY 140 N 1.45 3.75 2.28 2.92 0.00 -1.26 -4.93 105.19 109.40 2klm n GLY 140 Ca 0.03 -2.09 -0.21 0.00 0.00 0.00 0.00 46.02 43.75 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 1.08 1.82 -1.75 4.61 0.00 -1.26 -4.79 120.51 120.22 2klm n ALA 141 Ca 0.25 -3.09 -0.37 0.00 0.00 0.00 0.00 53.44 50.23 2klm n ALA 141 Cb 0.48 -0.90 0.05 0.00 0.00 0.00 0.00 19.45 19.08 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 -0.94 2.95 0.61 0.00 0.02 -1.26 -4.97 135.00 131.42 2klm s PRO 142 Ca 0.35 2.09 -0.18 0.00 0.02 0.00 0.00 61.00 63.27 2klm s PRO 142 Cb 0.19 -2.08 -0.03 0.00 0.02 0.00 0.00 34.50 32.60 2klm s PRO 142 CO -0.13 -1.29 1.18 -2.00 -0.33 0.00 0.00 177.00 174.43 2klm s GLU 143 N -3.12 2.93 -0.26 5.54 2.12 -1.26 -4.90 118.70 119.75 2klm s GLU 143 Ca 0.76 1.71 0.02 0.00 0.36 0.00 0.00 54.97 57.81 2klm s GLU 143 Cb -0.37 -1.94 0.33 0.00 0.26 0.00 0.00 34.13 32.42 2klm s GLU 143 CO 0.42 -1.21 1.58 1.33 -0.54 0.00 0.00 175.26 176.83 2klm n VAL 144 N -1.79 2.29 -1.48 3.70 0.24 -1.26 -5.02 118.33 115.01 2klm n VAL 144 Ca 0.13 -1.14 0.03 0.00 -2.04 0.00 0.00 64.34 61.32 2klm n VAL 144 Cb 0.50 -0.82 -0.01 0.00 -1.47 0.00 0.00 33.84 32.04 2klm n VAL 144 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 2klm n LYS 145 N -0.27 -0.51 0.00 7.34 5.02 -1.26 -4.99 118.16 123.48 2klm n LYS 145 Ca 0.32 0.34 0.00 0.00 -2.02 0.00 0.00 58.31 56.95 2klm n LYS 145 Cb 1.03 -0.62 0.00 0.00 -0.02 0.00 0.00 35.03 35.42 2klm n LYS 145 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2klm n ASP 146 N -3.93 0.00 0.00 4.39 -0.08 -1.26 -5.30 116.55 110.38 2klm n ASP 146 Ca 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.28 2klm n ASP 146 Cb 0.12 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.58 2klm n ASP 146 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32