#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kdn n GLY 2 N 0.00 3.68 0.04 3.17 0.00 -1.26 -5.01 105.19 105.82 2kdn n GLY 2 Ca 0.00 -2.16 0.13 0.00 0.00 0.00 0.00 46.02 43.99 2kdn n GLY 2 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2kdn n SER 3 N -1.50 0.34 -4.62 1.61 7.64 -1.26 -4.76 113.62 111.06 2kdn n SER 3 Ca 0.00 -0.13 -0.43 0.00 1.01 0.00 0.00 58.87 59.32 2kdn n SER 3 Cb 0.00 -0.11 -0.02 0.00 -1.01 0.00 0.00 64.21 63.07 2kdn n SER 3 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2kdn s SER 4 N -2.81 6.71 0.40 6.43 0.01 -1.26 -5.02 113.70 118.17 2kdn s SER 4 Ca 0.18 0.98 0.04 0.00 1.31 0.00 0.00 55.95 58.47 2kdn s SER 4 Cb 0.19 -2.54 -0.00 0.00 0.21 0.00 0.00 66.02 63.87 2kdn s SER 4 CO 0.56 -1.08 0.57 -1.00 0.41 0.00 0.00 173.24 172.70 2kdn s HIS 5 N 4.26 3.11 0.42 2.43 0.09 -1.26 -5.11 115.29 119.23 2kdn s HIS 5 Ca 0.52 -0.06 -0.01 0.00 -0.00 0.00 0.00 55.06 55.51 2kdn s HIS 5 Cb -0.13 -2.19 -0.02 0.00 -0.00 0.00 0.00 32.58 30.23 2kdn s HIS 5 CO 0.23 -0.23 0.65 -1.01 -0.00 0.00 0.00 174.74 174.38 2kdn s HIS 6 N -2.37 3.39 -0.37 1.40 3.76 -1.26 -5.08 115.29 114.77 2kdn s HIS 6 Ca 0.48 0.40 0.03 0.00 -0.15 0.00 0.00 55.06 55.82 2kdn s HIS 6 Cb -0.10 -2.17 0.11 0.00 1.11 0.00 0.00 32.58 31.53 2kdn s HIS 6 CO 0.34 -0.18 0.10 -1.01 -0.85 0.00 0.00 174.74 173.14 2kdn s HIS 7 N -2.51 3.39 -0.46 1.40 3.76 -1.26 -5.07 115.29 114.54 2kdn s HIS 7 Ca 0.45 -2.89 -0.24 0.00 -0.15 0.00 0.00 55.06 52.23 2kdn s HIS 7 Cb -0.10 -2.75 0.03 0.00 1.11 0.00 0.00 32.58 30.87 2kdn s HIS 7 CO 0.39 -0.90 0.86 -1.01 -0.85 0.00 0.00 174.74 173.22 2kdn s HIS 8 N 0.74 2.95 0.34 1.40 3.76 -1.26 -5.04 115.29 118.18 2kdn s HIS 8 Ca 0.12 0.25 -0.03 0.00 -0.15 0.00 0.00 55.06 55.25 2kdn s HIS 8 Cb -0.20 -3.83 -0.04 0.00 1.11 0.00 0.00 32.58 29.62 2kdn s HIS 8 CO -0.08 -1.06 0.59 -1.01 -0.85 0.00 0.00 174.74 172.33 2kdn s HIS 9 N 3.53 3.50 -0.54 1.40 3.76 -1.26 -4.57 115.29 121.11 2kdn s HIS 9 Ca 0.33 0.55 -0.04 0.00 -0.15 0.00 0.00 55.06 55.75 2kdn s HIS 9 Cb -0.11 -2.05 0.00 0.00 1.11 0.00 0.00 32.58 31.53 2kdn s HIS 9 CO 0.24 0.08 0.55 1.58 -0.85 0.00 0.00 174.74 176.34 2kdn n HIS 10 N -1.50 -2.57 -3.33 1.40 -0.00 -1.26 -5.06 115.22 102.90 2kdn n HIS 10 Ca -0.03 1.00 -0.05 0.00 -0.00 0.00 0.00 57.72 58.64 2kdn n HIS 10 Cb 0.55 -3.65 -0.06 0.00 -0.00 0.00 0.00 29.99 26.83 2kdn n HIS 10 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 2kdn s SER 11 N -2.69 -0.32 -0.91 0.26 0.15 -1.26 -5.10 113.70 103.83 2kdn s SER 11 Ca 0.06 0.53 -0.16 0.00 0.70 0.00 0.00 55.95 57.07 2kdn s SER 11 Cb -0.02 1.48 0.18 0.00 -1.71 0.00 0.00 66.02 65.95 2kdn s SER 11 CO 0.62 -0.28 1.00 -0.94 1.20 0.00 0.00 173.24 174.84 2kdn s SER 12 N 2.65 6.74 0.00 5.45 1.04 -1.26 -4.45 113.70 123.88 2kdn s SER 12 Ca 0.13 -2.44 0.00 0.00 0.48 0.00 0.00 55.95 54.12 2kdn s SER 12 Cb -0.15 -2.31 0.00 0.00 0.10 0.00 0.00 66.02 63.66 2kdn s SER 12 CO -0.17 -0.81 0.00 0.61 0.98 0.00 0.00 173.24 173.85 2kdn n GLY 13 N 4.66 0.32 0.13 7.32 0.00 -1.26 -4.81 105.19 111.55 2kdn n GLY 13 Ca 0.21 -0.68 -0.22 0.00 0.00 0.00 0.00 46.02 45.33 2kdn n GLY 13 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kdn n ARG 14 N 0.00 0.67 -0.75 1.61 1.74 -1.26 -4.03 116.66 114.64 2kdn n ARG 14 Ca 0.00 0.35 -0.14 0.00 -0.77 0.00 0.00 57.85 57.29 2kdn n ARG 14 Cb 0.00 -1.68 0.05 0.00 -1.02 0.00 0.00 32.46 29.81 2kdn n ARG 14 CO 0.00 0.00 0.00 -0.85 -1.52 0.00 0.00 177.63 175.26 2kdn n GLU 15 N -3.83 1.68 0.00 5.56 0.00 -1.26 -4.53 120.64 118.27 2kdn n GLU 15 Ca -0.36 -1.43 0.02 0.00 0.00 0.00 0.00 57.16 55.39 2kdn n GLU 15 Cb 0.91 -1.56 0.09 0.00 0.00 0.00 0.00 31.44 30.88 2kdn n GLU 15 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.13 177.40 2kdn n ASN 16 N 0.17 0.00 0.23 -1.84 0.23 -1.25 -0.94 115.26 111.86 2kdn n ASN 16 Ca 0.28 0.43 0.11 0.00 -0.53 0.00 0.00 54.58 54.87 2kdn n ASN 16 Cb 0.74 -0.45 0.50 0.00 -2.08 0.00 0.00 39.78 38.49 2kdn n ASN 16 CO 0.00 0.00 0.00 -0.07 -0.93 0.00 0.00 177.26 176.26 2kdn h LEU 17 N 0.00 0.00 -9.51 -4.53 -0.00 -1.83 -3.41 115.31 96.03 2kdn h LEU 17 Ca 0.00 0.00 -0.53 0.00 -0.00 0.00 0.00 57.88 57.35 2kdn h LEU 17 Cb 0.06 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.71 2kdn h LEU 17 CO 0.00 0.18 0.42 -0.31 -0.00 0.00 0.00 178.44 178.73 2kdn s TYR 18 N -3.66 3.65 0.20 1.13 1.51 -0.11 -4.94 117.35 115.14 2kdn s TYR 18 Ca 0.01 1.63 0.14 0.00 -1.01 0.00 0.00 57.07 57.84 2kdn s TYR 18 Cb 0.10 -3.19 0.46 0.00 -0.11 0.00 0.00 41.96 39.22 2kdn s TYR 18 CO 0.62 -0.29 1.64 0.27 -1.11 0.00 0.00 175.55 176.68 2kdn h PHE 19 N 6.17 0.00 -0.17 2.71 -0.00 -1.88 -2.07 116.94 121.71 2kdn h PHE 19 Ca -0.42 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.55 2kdn h PHE 19 Cb 1.21 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.16 2kdn h PHE 19 CO 0.66 0.53 0.00 0.00 -0.00 0.00 0.00 178.31 179.50 2kdn n GLN 20 N -3.65 1.91 -2.70 6.09 -0.00 -1.26 -4.26 117.38 113.52 2kdn n GLN 20 Ca -0.01 -1.35 -0.06 0.00 -0.00 0.00 0.00 57.00 55.58 2kdn n GLN 20 Cb 0.59 -1.43 0.09 0.00 -0.00 0.00 0.00 30.24 29.48 2kdn n GLN 20 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2kdn n GLY 21 N 1.22 1.52 0.23 2.61 0.00 -1.01 -4.89 105.19 104.87 2kdn n GLY 21 Ca 0.17 -0.59 0.10 0.00 0.00 0.00 0.00 46.02 45.70 2kdn n GLY 21 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 2kdn h HIS 22 N 2.26 0.00 -3.95 1.61 2.76 -1.56 -3.33 115.15 112.93 2kdn h HIS 22 Ca -0.23 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.94 2kdn h HIS 22 Cb 1.26 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.22 2kdn h HIS 22 CO 0.26 0.21 -0.03 -0.12 -1.30 0.00 0.00 177.93 176.94 2kdn n MET 23 N -3.47 -0.61 -2.56 5.26 1.56 -1.26 -4.36 117.12 111.68 2kdn n MET 23 Ca -0.00 0.95 -0.41 0.00 -0.27 0.00 0.00 57.70 57.96 2kdn n MET 23 Cb 0.38 -3.22 -0.04 0.00 2.15 0.00 0.00 33.22 32.48 2kdn n MET 23 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 2kdn h ILE 25 N 3.77 1.04 -0.55 0.00 6.09 -1.95 0.10 117.51 126.01 2kdn h ILE 25 Ca -0.44 -0.35 -0.01 0.00 -1.37 0.00 0.00 64.86 62.69 2kdn h ILE 25 Cb 1.21 -0.05 -0.03 0.00 0.47 0.00 0.00 36.82 38.42 2kdn h ILE 25 CO 0.72 0.18 0.30 -0.61 -3.07 0.00 0.00 178.15 175.68 2kdn h GLN 26 N 1.01 0.78 0.00 2.19 4.15 -1.97 -2.48 115.11 118.78 2kdn h GLN 26 Ca 0.40 -0.09 -0.07 0.00 0.77 0.00 0.00 58.65 59.65 2kdn h GLN 26 Cb 0.24 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 27.77 2kdn h GLN 26 CO -0.16 0.60 -0.35 0.87 -1.93 0.00 0.00 178.83 177.86 2kdn h LYS 27 N 0.75 0.00 0.36 1.69 1.57 -1.51 -1.49 116.57 117.93 2kdn h LYS 27 Ca 0.19 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.96 2kdn h LYS 27 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.37 2kdn h LYS 27 CO -0.03 0.35 -0.17 0.28 -0.57 0.00 0.00 179.45 179.31 2kdn h VAL 28 N 0.00 0.66 -0.58 0.50 2.07 -0.60 -0.62 116.25 117.67 2kdn h VAL 28 Ca -0.00 -0.16 -0.01 0.00 0.82 0.00 0.00 66.70 67.35 2kdn h VAL 28 Cb 0.84 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 31.32 2kdn h VAL 28 CO 0.05 0.03 0.34 0.40 0.02 0.00 0.00 177.57 178.41 2kdn h ILE 29 N -0.57 1.18 -0.25 4.57 5.03 -1.33 -0.71 117.51 125.44 2kdn h ILE 29 Ca -0.05 -0.43 0.06 0.00 -0.12 0.00 0.00 64.86 64.32 2kdn h ILE 29 Cb 0.42 0.41 -0.06 0.00 -3.03 0.00 0.00 36.82 34.56 2kdn h ILE 29 CO 0.08 0.19 -0.17 -0.33 -0.68 0.00 0.00 178.15 177.24 2kdn h GLU 30 N 0.79 -0.15 -0.04 2.37 4.39 -1.16 -0.43 114.58 120.34 2kdn h GLU 30 Ca 0.21 0.01 -0.11 0.00 0.34 0.00 0.00 59.36 59.81 2kdn h GLU 30 Cb 0.01 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.68 2kdn h GLU 30 CO -0.04 -0.10 -0.47 0.22 -1.16 0.00 0.00 179.01 177.46 2kdn h ASP 31 N -0.16 0.09 0.26 1.42 3.58 -0.88 -0.35 116.42 120.38 2kdn h ASP 31 Ca 0.14 -0.04 -0.01 0.00 0.42 0.00 0.00 57.03 57.53 2kdn h ASP 31 Cb 0.37 -0.03 0.00 0.00 1.72 0.00 0.00 39.33 41.39 2kdn h ASP 31 CO -0.35 0.56 -0.13 0.50 -2.88 0.00 0.00 179.24 176.95 2kdn h LYS 32 N 0.07 -0.34 0.00 0.28 3.64 -0.31 -0.40 116.57 119.52 2kdn h LYS 32 Ca 0.00 0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.32 2kdn h LYS 32 Cb 0.87 0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.75 2kdn h LYS 32 CO 0.07 0.01 -0.42 1.37 -2.27 0.00 0.00 179.45 178.21 2kdn h LEU 33 N -0.78 0.00 -0.53 5.20 8.10 -1.14 -2.98 115.31 123.18 2kdn h LEU 33 Ca -0.04 0.00 -0.01 0.00 0.11 0.00 0.00 57.88 57.94 2kdn h LEU 33 Cb 0.51 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 40.70 2kdn h LEU 33 CO 0.06 0.42 0.28 -1.28 -4.11 0.00 0.00 178.44 173.80 2kdn h SER 34 N 0.00 0.67 0.27 0.17 0.87 -0.96 -1.08 113.55 113.50 2kdn h SER 34 Ca -0.00 -0.11 -0.03 0.00 -1.23 0.00 0.00 61.79 60.42 2kdn h SER 34 Cb 0.92 -0.17 -0.00 0.00 -0.44 0.00 0.00 62.40 62.70 2kdn h SER 34 CO 0.05 0.59 -0.16 0.28 -0.53 0.00 0.00 176.83 177.07 2kdn h SER 35 N 0.71 0.00 0.00 6.23 0.02 -0.92 0.33 113.55 119.93 2kdn h SER 35 Ca 0.18 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.12 2kdn h SER 35 Cb 0.08 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.62 2kdn h SER 35 CO -0.03 0.16 -0.08 0.00 -1.14 0.00 0.00 176.83 175.74 2kdn h ALA 36 N 1.84 0.01 0.02 3.77 0.00 -1.32 -3.41 119.26 120.18 2kdn h ALA 36 Ca -0.00 -0.33 -0.37 0.00 0.00 0.00 0.00 54.91 54.21 2kdn h ALA 36 Cb 0.33 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.12 2kdn h ALA 36 CO 0.02 0.05 -2.27 1.28 0.00 0.00 0.00 179.25 178.33 2kdn n LEU 37 N -4.67 1.72 -2.80 0.00 4.77 -0.46 -5.07 117.00 110.49 2kdn n LEU 37 Ca -0.07 0.04 -0.03 0.00 -0.03 0.00 0.00 56.01 55.92 2kdn n LEU 37 Cb 0.29 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 2kdn n LEU 37 CO 0.19 0.72 -0.36 0.29 -1.33 0.00 0.00 177.39 176.89 2kdn n LYS 38 N -3.11 -2.99 -2.90 3.23 4.76 0.12 -4.57 118.16 112.69 2kdn n LYS 38 Ca -0.36 2.48 -0.40 0.00 -2.87 0.00 0.00 58.31 57.16 2kdn n LYS 38 Cb 1.06 -5.10 -0.05 0.00 -1.84 0.00 0.00 35.03 29.10 2kdn n LYS 38 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 2kdn s PRO 39 N -1.86 4.62 0.35 1.97 0.04 -1.26 -4.45 135.00 134.41 2kdn s PRO 39 Ca 0.07 1.24 0.19 0.00 0.04 0.00 0.00 61.00 62.54 2kdn s PRO 39 Cb -0.02 -3.31 0.36 0.00 0.04 0.00 0.00 34.50 31.57 2kdn s PRO 39 CO 0.73 0.43 1.58 1.79 0.04 0.00 0.00 177.00 181.57 2kdn h THR 40 N 3.63 0.63 -3.35 1.26 1.35 -0.88 -3.42 112.91 112.13 2kdn h THR 40 Ca -0.45 -1.71 -0.40 0.00 -0.55 0.00 0.00 66.41 63.30 2kdn h THR 40 Cb 1.21 2.17 -0.36 0.00 -1.73 0.00 0.00 68.15 69.43 2kdn h THR 40 CO 0.69 0.33 -0.76 0.12 -0.25 0.00 0.00 175.52 175.65 2kdn s PHE 41 N -3.20 0.54 -0.15 4.73 5.36 -0.77 -5.04 117.98 119.44 2kdn s PHE 41 Ca 0.03 -0.09 -0.02 0.00 -0.96 0.00 0.00 56.93 55.89 2kdn s PHE 41 Cb 0.08 -0.65 0.05 0.00 -0.34 0.00 0.00 43.02 42.15 2kdn s PHE 41 CO 0.70 -0.24 0.02 -1.17 -1.46 0.00 0.00 175.22 173.07 2kdn s LEU 42 N 1.58 0.95 -0.14 6.12 2.96 -1.26 -0.71 118.68 128.18 2kdn s LEU 42 Ca -0.01 -0.54 0.02 0.00 -0.22 0.00 0.00 54.13 53.38 2kdn s LEU 42 Cb -0.13 -0.54 0.01 0.00 0.50 0.00 0.00 46.19 46.03 2kdn s LEU 42 CO -0.03 -0.26 -0.21 -0.70 -1.32 0.00 0.00 176.35 173.82 2kdn s GLU 43 N 1.90 2.96 -0.21 1.98 2.12 -0.73 -4.97 118.70 121.76 2kdn s GLU 43 Ca 0.01 -0.83 -0.23 0.00 0.36 0.00 0.00 54.97 54.28 2kdn s GLU 43 Cb -0.15 -2.40 -0.02 0.00 0.26 0.00 0.00 34.13 31.82 2kdn s GLU 43 CO -0.07 -0.03 0.76 -0.51 -0.54 0.00 0.00 175.26 174.87 2kdn s LEU 44 N 0.84 4.13 -0.35 2.70 1.43 -1.26 -0.40 118.68 125.78 2kdn s LEU 44 Ca -0.07 0.99 -0.09 0.00 -1.03 0.00 0.00 54.13 53.94 2kdn s LEU 44 Cb -0.15 -3.09 0.03 0.00 0.03 0.00 0.00 46.19 43.01 2kdn s LEU 44 CO -0.02 -0.40 0.15 -0.69 0.23 0.00 0.00 176.35 175.62 2kdn s VAL 45 N 2.32 4.18 -0.55 -1.59 1.01 0.56 -4.99 120.40 121.34 2kdn s VAL 45 Ca 0.33 -0.92 -0.27 0.00 0.00 0.00 0.00 61.98 61.13 2kdn s VAL 45 Cb -0.16 -3.31 -0.02 0.00 0.00 0.00 0.00 36.38 32.89 2kdn s VAL 45 CO 0.10 -0.15 1.86 -0.62 0.00 0.00 0.00 175.10 176.28 2kdn s ASP 46 N 1.49 5.38 0.81 3.32 -1.08 -1.26 -2.13 116.67 123.20 2kdn s ASP 46 Ca 0.01 0.55 -0.12 0.00 -0.52 0.00 0.00 52.55 52.47 2kdn s ASP 46 Cb -0.19 -2.53 0.08 0.00 -1.46 0.00 0.00 42.92 38.82 2kdn s ASP 46 CO 0.05 -2.25 1.12 -0.54 0.52 0.00 0.00 175.17 174.07 2kdn s LYS 47 N 6.77 1.94 0.18 4.34 -0.14 -1.13 -4.98 119.74 126.72 2kdn s LYS 47 Ca 0.70 0.43 -0.32 0.00 -1.36 0.00 0.00 55.97 55.42 2kdn s LYS 47 Cb -0.15 -1.92 -0.11 0.00 -1.68 0.00 0.00 37.83 33.98 2kdn s LYS 47 CO 0.24 -1.67 1.61 -1.54 -0.76 0.00 0.00 175.35 173.22 2kdn s SER 48 N -4.13 6.52 0.01 2.83 1.04 -1.26 -4.67 113.70 114.04 2kdn s SER 48 Ca 0.61 2.70 -0.08 0.00 0.48 0.00 0.00 55.95 59.66 2kdn s SER 48 Cb -0.13 -2.60 -0.05 0.00 0.10 0.00 0.00 66.02 63.34 2kdn s SER 48 CO 0.53 -0.87 1.01 0.00 0.98 0.00 0.00 173.24 174.89 2kdn n GLY 50 N -0.82 1.16 0.06 0.00 0.00 -1.26 -2.34 105.19 101.99 2kdn n GLY 50 Ca -0.04 0.46 0.11 0.00 0.00 0.00 0.00 46.02 46.56 2kdn n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kdn n GLY 52 N 1.24 -1.85 3.62 0.00 0.00 -0.99 -5.10 105.19 102.12 2kdn n GLY 52 Ca -0.01 -1.14 -0.44 0.00 0.00 0.00 0.00 46.02 44.43 2kdn n GLY 52 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2kdn n THR 53 N 1.70 0.54 -4.02 2.61 -1.04 -1.26 -4.32 114.28 108.49 2kdn n THR 53 Ca 0.00 -0.27 -0.28 0.00 -2.04 0.00 0.00 64.05 61.45 2kdn n THR 53 Cb 0.00 -2.32 -0.17 0.00 -1.82 0.00 0.00 70.33 66.03 2kdn n THR 53 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 2kdn s SER 54 N 6.17 2.39 -0.07 8.00 0.01 -1.26 -2.78 113.70 126.16 2kdn s SER 54 Ca 0.96 -0.39 0.01 0.00 1.31 0.00 0.00 55.95 57.84 2kdn s SER 54 Cb -0.46 -1.00 -0.03 0.00 0.21 0.00 0.00 66.02 64.75 2kdn s SER 54 CO 0.41 -0.08 -0.09 -0.36 0.41 0.00 0.00 173.24 173.54 2kdn s PHE 55 N 1.52 2.88 -0.17 2.43 0.08 -0.83 -2.83 117.98 121.06 2kdn s PHE 55 Ca 0.03 -0.08 -0.00 0.00 0.12 0.00 0.00 56.93 57.00 2kdn s PHE 55 Cb -0.13 -1.72 0.00 0.00 -0.57 0.00 0.00 43.02 40.61 2kdn s PHE 55 CO -0.08 0.24 -0.15 0.34 -0.10 0.00 0.00 175.22 175.47 2kdn s ASP 56 N -0.64 3.63 -0.30 1.36 2.15 -0.91 -0.34 116.67 121.63 2kdn s ASP 56 Ca 0.10 -0.50 -0.08 0.00 0.43 0.00 0.00 52.55 52.49 2kdn s ASP 56 Cb -0.11 -1.57 -0.00 0.00 -0.30 0.00 0.00 42.92 40.93 2kdn s ASP 56 CO 0.02 0.04 0.12 0.00 -0.17 0.00 0.00 175.17 175.18 2kdn s ALA 57 N 1.06 3.19 -0.45 3.66 0.00 0.45 -0.33 121.76 129.34 2kdn s ALA 57 Ca -0.01 -1.39 -0.28 0.00 0.00 0.00 0.00 51.96 50.28 2kdn s ALA 57 Cb -0.15 -2.27 0.03 0.00 0.00 0.00 0.00 23.12 20.74 2kdn s ALA 57 CO -0.04 -0.87 1.09 0.08 0.00 0.00 0.00 175.76 176.02 2kdn s VAL 58 N 1.57 4.30 -0.35 0.00 1.01 0.47 -0.46 120.40 126.94 2kdn s VAL 58 Ca 0.04 1.20 -0.05 0.00 0.00 0.00 0.00 61.98 63.17 2kdn s VAL 58 Cb -0.17 -4.54 0.06 0.00 0.00 0.00 0.00 36.38 31.73 2kdn s VAL 58 CO 0.05 -0.90 0.10 -0.51 0.00 0.00 0.00 175.10 173.84 2kdn s ILE 59 N 4.21 3.49 -0.42 2.22 -1.16 0.52 -1.77 121.20 128.29 2kdn s ILE 59 Ca 0.45 -1.40 -0.11 0.00 -0.51 0.00 0.00 60.65 59.08 2kdn s ILE 59 Cb -0.08 -3.07 0.06 0.00 0.61 0.00 0.00 42.46 39.97 2kdn s ILE 59 CO 0.29 -0.28 0.27 -0.69 -2.81 0.00 0.00 174.94 171.72 2kdn s VAL 60 N 1.31 4.55 -0.00 4.00 1.01 0.12 -0.60 120.40 130.78 2kdn s VAL 60 Ca -0.01 -1.16 -0.04 0.00 0.00 0.00 0.00 61.98 60.78 2kdn s VAL 60 Cb -0.21 -3.69 -0.00 0.00 0.00 0.00 0.00 36.38 32.48 2kdn s VAL 60 CO 0.00 -0.43 0.08 -0.55 0.00 0.00 0.00 175.10 174.20 2kdn s SER 61 N 2.03 0.06 0.58 3.32 0.15 -0.93 -0.10 113.70 118.81 2kdn s SER 61 Ca 0.03 -0.19 0.35 0.00 0.70 0.00 0.00 55.95 56.84 2kdn s SER 61 Cb -0.22 0.17 1.79 0.00 -1.71 0.00 0.00 66.02 66.05 2kdn s SER 61 CO 0.05 -0.26 2.17 -1.13 1.20 0.00 0.00 173.24 175.26 2kdn h ASN 62 N 4.82 0.00 -0.38 5.45 -0.00 -1.90 -2.87 115.58 120.71 2kdn h ASN 62 Ca -0.30 0.00 -0.04 0.00 -0.00 0.00 0.00 56.30 55.96 2kdn h ASN 62 Cb 1.20 0.00 -0.02 0.00 -0.00 0.00 0.00 38.32 39.50 2kdn h ASN 62 CO 0.42 0.04 0.10 -1.13 -0.00 0.00 0.00 177.43 176.86 2kdn h ASN 63 N 0.00 0.62 -0.70 1.15 -1.24 -1.83 -1.03 115.58 112.56 2kdn h ASN 63 Ca -0.00 -0.10 0.00 0.00 0.71 0.00 0.00 56.30 56.91 2kdn h ASN 63 Cb 0.24 -0.16 0.00 0.00 0.73 0.00 0.00 38.32 39.13 2kdn h ASN 63 CO 0.01 0.63 0.00 0.33 -1.29 0.00 0.00 177.43 177.10 2kdn n PHE 64 N -4.30 1.20 0.07 0.67 7.35 -1.09 -3.91 117.46 117.44 2kdn n PHE 64 Ca 0.03 -0.55 -0.04 0.00 -0.76 0.00 0.00 57.45 56.13 2kdn n PHE 64 Cb 0.21 -0.11 -0.08 0.00 0.35 0.00 0.00 39.48 39.85 2kdn n PHE 64 CO 0.00 0.00 0.00 1.49 -0.76 0.00 0.00 176.76 177.49 2kdn h GLU 65 N 4.19 0.00 -0.91 -4.13 4.57 -1.12 -2.34 114.58 114.85 2kdn h GLU 65 Ca 0.00 0.00 0.06 0.00 -1.18 0.00 0.00 59.36 58.24 2kdn h GLU 65 Cb 1.19 0.00 -0.06 0.00 -0.16 0.00 0.00 28.75 29.72 2kdn h GLU 65 CO 0.10 0.80 0.57 0.22 -1.18 0.00 0.00 179.01 179.52 2kdn h ASP 66 N 0.00 0.91 -0.44 1.04 3.58 -1.67 -3.46 116.42 116.38 2kdn h ASP 66 Ca -0.04 0.01 -0.09 0.00 0.42 0.00 0.00 57.03 57.33 2kdn h ASP 66 Cb 1.69 -0.18 -0.02 0.00 1.72 0.00 0.00 39.33 42.53 2kdn h ASP 66 CO 0.11 0.59 -0.10 1.17 -2.88 0.00 0.00 179.24 178.12 2kdn n LYS 67 N -4.57 -0.35 -2.41 0.28 4.81 -0.88 -4.99 118.16 110.04 2kdn n LYS 67 Ca 0.13 0.44 -0.43 0.00 -0.87 0.00 0.00 58.31 57.59 2kdn n LYS 67 Cb 0.17 -4.17 -0.02 0.00 0.02 0.00 0.00 35.03 31.03 2kdn n LYS 67 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 2kdn s LYS 68 N -3.32 4.28 0.21 1.64 1.02 -1.26 -4.92 119.74 117.39 2kdn s LYS 68 Ca 0.00 1.70 0.05 0.00 0.02 0.00 0.00 55.97 57.74 2kdn s LYS 68 Cb 0.00 -3.67 0.15 0.00 -0.52 0.00 0.00 37.83 33.78 2kdn s LYS 68 CO 0.00 -0.59 1.48 1.37 -0.92 0.00 0.00 175.35 176.69 2kdn h LEU 69 N 9.01 0.21 -1.17 3.17 8.10 -1.98 -2.20 115.31 130.44 2kdn h LEU 69 Ca -0.31 -0.14 -0.08 0.00 0.11 0.00 0.00 57.88 57.46 2kdn h LEU 69 Cb 1.13 -0.06 -0.01 0.00 -0.44 0.00 0.00 40.66 41.28 2kdn h LEU 69 CO 0.93 0.86 -0.37 0.17 -4.11 0.00 0.00 178.44 175.92 2kdn h LEU 70 N 0.11 0.08 -0.37 0.17 -0.00 -1.99 -1.41 115.31 111.91 2kdn h LEU 70 Ca -0.02 -0.03 -0.19 0.00 -0.00 0.00 0.00 57.88 57.64 2kdn h LEU 70 Cb 1.29 -0.02 -0.00 0.00 -0.00 0.00 0.00 40.66 41.93 2kdn h LEU 70 CO 0.11 0.45 -0.67 -0.78 -0.00 0.00 0.00 178.44 177.54 2kdn h ASP 71 N 0.07 0.67 -0.36 0.17 3.58 -1.89 -1.26 116.42 117.40 2kdn h ASP 71 Ca 0.01 -0.41 0.03 0.00 0.42 0.00 0.00 57.03 57.08 2kdn h ASP 71 Cb 0.69 -0.20 -0.03 0.00 1.72 0.00 0.00 39.33 41.51 2kdn h ASP 71 CO 0.05 1.16 0.16 -0.09 -2.88 0.00 0.00 179.24 177.64 2kdn h ARG 72 N 0.41 0.33 0.25 0.28 2.43 -1.08 -1.00 114.38 116.00 2kdn h ARG 72 Ca -0.02 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 2kdn h ARG 72 Cb 1.26 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.71 2kdn h ARG 72 CO 0.13 0.22 -0.24 1.25 -1.51 0.00 0.00 179.97 179.81 2kdn h HIS 73 N 0.34 -0.65 -0.12 2.20 2.76 -0.96 -2.43 115.15 116.30 2kdn h HIS 73 Ca 0.16 0.00 -0.06 0.00 -2.20 0.00 0.00 60.37 58.27 2kdn h HIS 73 Cb 0.09 0.25 -0.00 0.00 1.55 0.00 0.00 27.41 29.30 2kdn h HIS 73 CO -0.11 -0.36 -0.17 0.07 -1.30 0.00 0.00 177.93 176.05 2kdn h ARG 74 N -0.53 0.33 -0.33 5.26 0.11 -1.15 -2.74 114.38 115.33 2kdn h ARG 74 Ca -0.01 -0.19 -0.02 0.00 0.10 0.00 0.00 59.98 59.86 2kdn h ARG 74 Cb 0.49 0.02 -0.01 0.00 1.11 0.00 0.00 29.97 31.57 2kdn h ARG 74 CO -0.05 0.77 0.14 -0.07 0.10 0.00 0.00 179.97 180.85 2kdn h LEU 75 N -0.09 0.45 -0.26 0.08 3.38 -1.23 0.63 115.31 118.28 2kdn h LEU 75 Ca 0.01 -0.16 0.02 0.00 0.09 0.00 0.00 57.88 57.85 2kdn h LEU 75 Cb 0.73 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.34 2kdn h LEU 75 CO 0.04 0.49 0.10 0.58 0.09 0.00 0.00 178.44 179.73 2kdn h VAL 76 N 0.38 0.94 -0.10 1.22 2.07 -1.50 -2.11 116.25 117.16 2kdn h VAL 76 Ca 0.11 -0.07 -0.08 0.00 0.82 0.00 0.00 66.70 67.48 2kdn h VAL 76 Cb 0.17 0.71 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 2kdn h VAL 76 CO -0.01 0.04 -0.28 0.78 0.02 0.00 0.00 177.57 178.12 2kdn h ASN 77 N 0.22 0.18 0.80 0.57 2.35 -1.24 -0.98 115.58 117.47 2kdn h ASN 77 Ca 0.11 -0.05 -0.04 0.00 -0.55 0.00 0.00 56.30 55.77 2kdn h ASN 77 Cb 0.07 -0.05 0.01 0.00 0.05 0.00 0.00 38.32 38.40 2kdn h ASN 77 CO -0.11 0.46 -0.38 0.74 -1.65 0.00 0.00 177.43 176.49 2kdn h THR 78 N 0.16 0.00 0.00 2.81 2.02 -0.21 -1.51 112.91 116.19 2kdn h THR 78 Ca 0.02 -0.07 -0.17 0.00 0.77 0.00 0.00 66.41 66.96 2kdn h THR 78 Cb 0.59 0.00 0.01 0.00 -1.74 0.00 0.00 68.15 67.01 2kdn h THR 78 CO 0.04 0.00 -0.65 0.40 0.37 0.00 0.00 175.52 175.68 2kdn h ILE 79 N -1.15 1.41 0.00 3.11 5.03 -1.51 -3.28 117.51 121.12 2kdn h ILE 79 Ca -0.11 -2.11 0.00 0.00 -0.12 0.00 0.00 64.86 62.52 2kdn h ILE 79 Cb 0.82 2.59 0.00 0.00 -3.03 0.00 0.00 36.82 37.20 2kdn h ILE 79 CO 0.18 0.62 0.00 0.18 -0.68 0.00 0.00 178.15 178.45 2kdn n LEU 80 N -4.18 0.00 0.05 1.44 4.32 -0.38 -2.30 117.00 115.95 2kdn n LEU 80 Ca -0.10 0.38 -0.12 0.00 -0.02 0.00 0.00 56.01 56.14 2kdn n LEU 80 Cb 0.70 -0.38 -0.07 0.00 -1.62 0.00 0.00 43.42 42.05 2kdn n LEU 80 CO 0.48 -0.04 0.51 0.50 -1.22 0.00 0.00 177.39 177.61 2kdn h LYS 81 N 0.00 -0.50 -0.02 3.23 1.63 -1.33 0.62 116.57 120.21 2kdn h LYS 81 Ca 0.00 0.03 -0.19 0.00 -0.85 0.00 0.00 60.65 59.64 2kdn h LYS 81 Cb 0.33 0.11 -0.01 0.00 -0.60 0.00 0.00 32.23 32.07 2kdn h LYS 81 CO 0.00 -0.33 -0.83 1.49 -3.45 0.00 0.00 179.45 176.33 2kdn h GLU 82 N -0.52 0.26 0.11 1.90 4.81 -1.78 -3.34 114.58 116.02 2kdn h GLU 82 Ca 0.01 -0.26 0.02 0.00 -0.13 0.00 0.00 59.36 58.99 2kdn h GLU 82 Cb 0.55 0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.97 2kdn h GLU 82 CO -0.26 0.95 -0.21 1.49 -0.73 0.00 0.00 179.01 180.25 2kdn h GLU 83 N 0.16 -0.38 -0.93 1.92 4.57 -1.24 -1.95 114.58 116.73 2kdn h GLU 83 Ca -0.04 0.03 0.27 0.00 -1.18 0.00 0.00 59.36 58.43 2kdn h GLU 83 Cb 1.44 0.09 -0.04 0.00 -0.16 0.00 0.00 28.75 30.07 2kdn h GLU 83 CO 0.13 -0.25 0.67 -0.07 -1.18 0.00 0.00 179.01 178.30 2kdn h LEU 84 N -0.39 0.03 -2.01 1.64 3.38 -1.00 -1.02 115.31 115.95 2kdn h LEU 84 Ca 0.03 0.00 0.14 0.00 0.09 0.00 0.00 57.88 58.14 2kdn h LEU 84 Cb 0.42 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 2kdn h LEU 84 CO -0.12 0.01 0.43 1.56 0.09 0.00 0.00 178.44 180.41 2kdn h GLN 85 N 0.03 0.00 -0.00 1.13 1.08 -1.50 0.19 115.11 116.04 2kdn h GLN 85 Ca 0.45 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.65 2kdn h GLN 85 Cb 1.74 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 29.17 2kdn h GLN 85 CO -0.02 0.00 -0.24 0.09 -0.95 0.00 0.00 178.83 177.71 2kdn n ASN 86 N -3.96 0.58 -4.37 1.46 3.02 -0.39 -4.88 115.26 106.72 2kdn n ASN 86 Ca 0.09 -0.45 -0.19 0.00 -0.03 0.00 0.00 54.58 53.99 2kdn n ASN 86 Cb 0.63 0.02 -0.10 0.00 -0.61 0.00 0.00 39.78 39.72 2kdn n ASN 86 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2kdn s ILE 87 N -2.68 1.84 -0.11 2.41 1.01 0.68 -5.07 121.20 119.28 2kdn s ILE 87 Ca 0.21 -2.24 -0.15 0.00 0.00 0.00 0.00 60.65 58.47 2kdn s ILE 87 Cb 0.19 -2.11 -0.14 0.00 0.01 0.00 0.00 42.46 40.41 2kdn s ILE 87 CO 0.55 -0.54 0.44 -0.74 0.00 0.00 0.00 174.94 174.64 2kdn h HIS 88 N 2.49 -0.02 -2.77 3.97 -0.00 -1.79 -3.46 115.15 113.58 2kdn h HIS 88 Ca -0.38 -0.00 -0.28 0.00 -0.00 0.00 0.00 60.37 59.71 2kdn h HIS 88 Cb 1.23 0.01 -0.35 0.00 -0.00 0.00 0.00 27.41 28.30 2kdn h HIS 88 CO 0.73 0.49 -0.60 0.00 -0.00 0.00 0.00 177.93 178.55 2kdn s ALA 89 N -2.50 -0.33 -0.16 5.26 0.00 -1.12 -5.04 121.76 117.87 2kdn s ALA 89 Ca -0.10 0.54 -0.04 0.00 0.00 0.00 0.00 51.96 52.36 2kdn s ALA 89 Cb -0.01 -1.10 -0.03 0.00 0.00 0.00 0.00 23.12 21.97 2kdn s ALA 89 CO 0.37 -0.87 -0.02 0.12 0.00 0.00 0.00 175.76 175.35 2kdn s PHE 90 N 2.35 3.05 0.06 0.00 5.36 -1.26 -1.97 117.98 125.56 2kdn s PHE 90 Ca 0.04 -0.28 0.07 0.00 -0.96 0.00 0.00 56.93 55.80 2kdn s PHE 90 Cb -0.14 -1.99 -0.04 0.00 -0.34 0.00 0.00 43.02 40.52 2kdn s PHE 90 CO -0.09 -0.04 -0.15 0.45 -1.46 0.00 0.00 175.22 173.92 2kdn s SER 91 N 0.45 4.01 -0.06 6.13 0.15 0.54 -4.99 113.70 119.94 2kdn s SER 91 Ca -0.03 -0.41 0.02 0.00 0.70 0.00 0.00 55.95 56.24 2kdn s SER 91 Cb -0.14 -0.69 0.01 0.00 -1.71 0.00 0.00 66.02 63.49 2kdn s SER 91 CO 0.02 0.23 -0.12 0.00 1.20 0.00 0.00 173.24 174.58 2kdn s MET 92 N -1.70 1.58 -0.32 5.44 0.23 -1.26 -0.41 119.30 122.86 2kdn s MET 92 Ca 0.17 -0.39 -0.03 0.00 -1.03 0.00 0.00 55.69 54.41 2kdn s MET 92 Cb -0.11 -1.33 0.05 0.00 -1.53 0.00 0.00 34.83 31.92 2kdn s MET 92 CO 0.08 0.04 0.04 0.21 -2.03 0.00 0.00 175.02 173.35 2kdn s LYS 93 N 0.61 2.42 0.04 3.16 2.20 0.39 -4.92 119.74 123.65 2kdn s LYS 93 Ca -0.13 -1.30 -0.15 0.00 -0.36 0.00 0.00 55.97 54.02 2kdn s LYS 93 Cb -0.15 -3.26 -0.06 0.00 -1.51 0.00 0.00 37.83 32.85 2kdn s LYS 93 CO 0.03 -0.67 0.46 0.00 -0.36 0.00 0.00 175.35 174.81 2kdn s HIS 95 N -1.15 -0.29 0.10 0.00 5.04 0.23 -4.92 115.29 114.29 2kdn s HIS 95 Ca 0.27 0.28 -0.04 0.00 -1.54 0.00 0.00 55.06 54.03 2kdn s HIS 95 Cb -0.17 0.24 -0.05 0.00 0.04 0.00 0.00 32.58 32.64 2kdn s HIS 95 CO 0.16 -0.58 0.33 0.95 -2.34 0.00 0.00 174.74 173.26 2kdn s THR 96 N -2.40 5.23 0.26 0.89 -4.23 -1.26 -2.18 115.64 111.94 2kdn s THR 96 Ca -0.06 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.46 2kdn s THR 96 Cb -0.01 -3.62 0.05 0.00 1.34 0.00 0.00 72.50 70.26 2kdn s THR 96 CO -0.02 0.13 1.68 1.55 -0.54 0.00 0.00 174.62 177.42 2kdn h PRO 97 N 3.12 0.55 -0.20 3.99 0.13 -1.86 -1.74 132.00 135.97 2kdn h PRO 97 Ca -0.47 -0.22 0.01 0.00 -0.87 0.00 0.00 66.00 64.45 2kdn h PRO 97 Cb 1.17 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.26 2kdn h PRO 97 CO 0.72 0.77 0.11 -0.07 -0.23 0.00 0.00 178.00 179.30 2kdn h LEU 98 N 0.48 0.18 -1.09 1.56 -0.00 -1.95 0.26 115.31 114.75 2kdn h LEU 98 Ca 0.06 0.00 -0.08 0.00 -0.00 0.00 0.00 57.88 57.87 2kdn h LEU 98 Cb 0.73 -0.03 -0.01 0.00 -0.00 0.00 0.00 40.66 41.34 2kdn h LEU 98 CO 0.06 0.13 -0.20 -0.33 -0.00 0.00 0.00 178.44 178.11 2kdn h GLU 99 N 0.24 0.41 -0.15 1.13 3.07 -1.96 -2.82 114.58 114.49 2kdn h GLU 99 Ca 0.08 -0.13 -0.13 0.00 -0.50 0.00 0.00 59.36 58.68 2kdn h GLU 99 Cb 0.00 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 27.86 2kdn h GLU 99 CO -0.04 0.59 -0.45 -0.92 -1.40 0.00 0.00 179.01 176.79 2kdn h TYR 100 N 0.37 0.45 -0.61 4.33 3.20 -0.51 -3.07 116.97 121.13 2kdn h TYR 100 Ca 0.06 -0.14 0.05 0.00 3.14 0.00 0.00 58.73 61.85 2kdn h TYR 100 Cb 0.56 -0.10 -0.04 0.00 1.54 0.00 0.00 36.73 38.70 2kdn h TYR 100 CO 0.02 0.77 0.41 0.22 -1.64 0.00 0.00 178.16 177.93 2kdn h ASP 101 N 0.31 0.56 0.79 -2.11 3.58 -0.24 0.72 116.42 120.02 2kdn h ASP 101 Ca 0.02 -0.00 -0.15 0.00 0.42 0.00 0.00 57.03 57.32 2kdn h ASP 101 Cb 0.92 -0.12 -0.02 0.00 1.72 0.00 0.00 39.33 41.83 2kdn h ASP 101 CO 0.08 0.37 -0.70 0.11 -2.88 0.00 0.00 179.24 176.22 2kdn h LYS 102 N 0.64 0.00 -0.15 0.28 6.56 -1.59 -2.38 116.57 119.93 2kdn h LYS 102 Ca 0.26 0.00 -0.04 0.00 -1.06 0.00 0.00 60.65 59.81 2kdn h LYS 102 Cb 0.22 0.00 -0.00 0.00 -0.57 0.00 0.00 32.23 31.87 2kdn h LYS 102 CO -0.08 0.70 -0.05 -0.07 -2.06 0.00 0.00 179.45 177.89 2kdn h LEU 103 N 0.00 0.30 -0.62 2.94 3.38 -0.88 0.23 115.31 120.67 2kdn h LEU 103 Ca -0.01 -0.39 0.00 0.00 0.09 0.00 0.00 57.88 57.57 2kdn h LEU 103 Cb 1.28 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.95 2kdn h LEU 103 CO 0.09 0.62 0.00 0.07 0.09 0.00 0.00 178.44 179.31 2kdn h LYS 104 N -0.02 0.00 0.24 1.13 2.10 -1.18 -2.62 116.57 116.22 2kdn h LYS 104 Ca 0.04 0.00 -0.34 0.00 -2.00 0.00 0.00 60.65 58.35 2kdn h LYS 104 Cb 0.50 0.00 0.03 0.00 -0.90 0.00 0.00 32.23 31.86 2kdn h LYS 104 CO 0.02 0.00 -1.52 1.03 -2.00 0.00 0.00 179.45 176.98 2kdn h SER 105 N 0.00 0.79 0.00 7.07 0.87 -1.16 -3.47 113.55 117.65 2kdn h SER 105 Ca 0.00 -0.89 0.00 0.00 -1.23 0.00 0.00 61.79 59.67 2kdn h SER 105 Cb 0.51 -0.26 0.00 0.00 -0.44 0.00 0.00 62.40 62.21 2kdn h SER 105 CO 0.00 1.71 0.00 2.29 -0.53 0.00 0.00 176.83 180.30 2kdn n LYS 106 N -3.68 0.00 0.00 2.24 0.00 -0.43 -5.03 118.16 111.26 2kdn n LYS 106 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.13 2kdn n LYS 106 Cb 1.10 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 36.13 2kdn n LYS 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2kdn n GLY 107 N -1.13 1.96 0.00 2.58 0.00 0.67 -4.90 105.19 104.37 2kdn n GLY 107 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2kdn n GLY 107 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06