#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 -0.48 2.42 -5.12 0.00 -1.26 -5.03 105.19 95.73 2kdn n GLY 2 Ca 0.00 0.17 -0.18 0.00 0.00 0.00 0.00 46.02 46.00 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 0.00 -5.26 -4.54 1.61 7.64 -1.26 -4.95 113.62 106.86 2kdn n SER 3 Ca 0.00 0.18 -0.43 0.00 1.01 0.00 0.00 58.87 59.63 2kdn n SER 3 Cb 0.00 -4.34 -0.06 0.00 -1.01 0.00 0.00 64.21 58.79 2kdn n SER 3 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2kdn s SER 4 N -2.44 6.38 -0.32 6.43 0.15 -1.26 -4.97 113.70 117.66 2kdn s SER 4 Ca 0.00 -0.13 0.01 0.00 0.70 0.00 0.00 55.95 56.53 2kdn s SER 4 Cb 0.00 -2.34 0.14 0.00 -1.71 0.00 0.00 66.02 62.11 2kdn s SER 4 CO 0.00 -0.77 0.32 -2.28 1.20 0.00 0.00 173.24 171.70 2kdn s HIS 5 N 2.94 -0.32 0.02 3.44 5.65 -1.26 -5.14 115.29 120.61 2kdn s HIS 5 Ca 0.25 -0.51 -0.18 0.00 0.25 0.00 0.00 55.06 54.87 2kdn s HIS 5 Cb -0.14 -0.47 -0.06 0.00 -1.18 0.00 0.00 32.58 30.73 2kdn s HIS 5 CO 0.19 -0.93 0.51 -1.01 -0.65 0.00 0.00 174.74 172.84 2kdn s HIS 6 N 1.93 3.74 -1.29 3.88 0.09 -1.26 -4.99 115.29 117.39 2kdn s HIS 6 Ca 0.13 1.13 -0.13 0.00 -0.00 0.00 0.00 55.06 56.18 2kdn s HIS 6 Cb -0.15 -2.44 0.13 0.00 -0.00 0.00 0.00 32.58 30.12 2kdn s HIS 6 CO -0.20 0.54 1.76 -2.39 -0.00 0.00 0.00 174.74 174.45 2kdn n HIS 7 N 2.07 4.07 -2.32 1.40 -0.00 -1.26 -4.97 115.22 114.21 2kdn n HIS 7 Ca -0.11 -3.02 -0.42 0.00 -0.00 0.00 0.00 57.72 54.16 2kdn n HIS 7 Cb 0.51 -2.27 -0.03 0.00 -0.00 0.00 0.00 29.99 28.21 2kdn n HIS 7 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 2kdn s HIS 8 N 2.02 2.79 -0.02 -1.40 5.65 -1.26 -4.96 115.29 118.12 2kdn s HIS 8 Ca 0.45 0.88 -0.06 0.00 0.25 0.00 0.00 55.06 56.58 2kdn s HIS 8 Cb 0.05 -3.59 -0.03 0.00 -1.18 0.00 0.00 32.58 27.83 2kdn s HIS 8 CO 0.00 -2.12 0.47 0.45 -0.65 0.00 0.00 174.74 172.89 2kdn h HIS 9 N 8.15 -0.20 -1.46 3.88 -0.00 -2.00 -3.48 115.15 120.04 2kdn h HIS 9 Ca -0.33 -0.00 0.12 0.00 -0.00 0.00 0.00 60.37 60.16 2kdn h HIS 9 Cb 1.14 0.07 -0.23 0.00 -0.00 0.00 0.00 27.41 28.39 2kdn h HIS 9 CO 0.79 -0.12 0.16 -1.58 -0.00 0.00 0.00 177.93 177.17 2kdn s HIS 10 N -2.37 -0.85 0.13 2.45 5.04 -1.26 -4.95 115.29 113.47 2kdn s HIS 10 Ca -0.03 1.54 -0.25 0.00 -1.54 0.00 0.00 55.06 54.78 2kdn s HIS 10 Cb 0.00 0.51 -0.03 0.00 0.04 0.00 0.00 32.58 33.10 2kdn s HIS 10 CO 0.09 -0.42 1.63 0.77 -2.34 0.00 0.00 174.74 174.48 2kdn h SER 11 N 7.24 -0.77 -5.81 9.88 0.02 -1.98 -3.46 113.55 118.68 2kdn h SER 11 Ca -0.20 0.11 -0.37 0.00 -0.84 0.00 0.00 61.79 60.49 2kdn h SER 11 Cb 1.14 0.32 0.13 0.00 0.14 0.00 0.00 62.40 64.14 2kdn h SER 11 CO 0.12 -0.31 -0.77 -1.20 -1.14 0.00 0.00 176.83 173.53 2kdn n SER 12 N -5.37 -2.59 0.00 3.07 7.64 -1.26 -4.76 113.62 110.35 2kdn n SER 12 Ca -0.04 -0.66 0.00 0.00 1.01 0.00 0.00 58.87 59.18 2kdn n SER 12 Cb 0.29 -4.82 0.00 0.00 -1.01 0.00 0.00 64.21 58.67 2kdn n SER 12 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2kdn n GLY 13 N -1.38 0.00 0.10 0.23 0.00 -1.26 -4.95 105.19 97.93 2kdn n GLY 13 Ca -0.23 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.27 0.67 -0.35 1.61 1.74 -1.26 -4.20 116.66 114.60 2kdn n ARG 14 Ca 0.00 0.09 0.03 0.00 -0.77 0.00 0.00 57.85 57.20 2kdn n ARG 14 Cb 0.00 -1.60 0.16 0.00 -1.02 0.00 0.00 32.46 30.00 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 -2.87 2.50 0.00 5.56 0.00 -1.26 -4.30 120.64 120.28 2kdn n GLU 15 Ca -0.29 -1.22 0.09 0.00 0.00 0.00 0.00 57.16 55.73 2kdn n GLU 15 Cb 1.12 -1.79 0.50 0.00 0.00 0.00 0.00 31.44 31.27 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 0.25 0.00 0.15 -1.84 0.23 -1.26 -2.47 115.26 110.32 2kdn n ASN 16 Ca 0.11 -0.36 0.07 0.00 -0.53 0.00 0.00 54.58 53.86 2kdn n ASN 16 Cb 0.61 -0.09 0.06 0.00 -2.08 0.00 0.00 39.78 38.28 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 -9.37 -4.53 4.07 -1.93 -3.45 115.31 100.11 2kdn h LEU 17 Ca 0.00 0.00 -0.59 0.00 0.08 0.00 0.00 57.88 57.37 2kdn h LEU 17 Cb 0.05 0.00 -0.09 0.00 1.08 0.00 0.00 40.66 41.70 2kdn h LEU 17 CO 0.00 0.28 -0.30 -0.31 -1.08 0.00 0.00 178.44 177.03 2kdn s TYR 18 N -3.09 3.50 -1.58 1.13 2.02 -1.03 -4.95 117.35 113.35 2kdn s TYR 18 Ca 0.04 0.67 0.16 0.00 -0.37 0.00 0.00 57.07 57.57 2kdn s TYR 18 Cb 0.07 -2.34 0.55 0.00 -0.40 0.00 0.00 41.96 39.84 2kdn s TYR 18 CO 0.73 0.30 1.45 1.97 -1.57 0.00 0.00 175.55 178.43 2kdn n PHE 19 N 3.30 1.01 0.50 2.71 -1.74 -1.26 -4.50 117.46 117.48 2kdn n PHE 19 Ca -0.12 -0.44 -0.04 0.00 -0.56 0.00 0.00 57.45 56.29 2kdn n PHE 19 Cb 0.52 -0.11 0.02 0.00 1.52 0.00 0.00 39.48 41.43 2kdn n PHE 19 CO 0.00 0.00 0.00 1.04 -0.56 0.00 0.00 176.76 177.24 2kdn n GLN 20 N 1.02 1.19 -0.00 3.97 6.02 -1.26 -3.89 117.38 124.44 2kdn n GLN 20 Ca 0.20 -0.45 0.15 0.00 -0.01 0.00 0.00 57.00 56.89 2kdn n GLN 20 Cb 0.63 -1.18 0.76 0.00 1.02 0.00 0.00 30.24 31.47 2kdn n GLN 20 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2kdn n GLY 21 N 0.37 -0.56 3.72 1.08 0.00 -1.26 -4.78 105.19 103.75 2kdn n GLY 21 Ca 0.09 -0.30 -0.42 0.00 0.00 0.00 0.00 46.02 45.39 2kdn n GLY 21 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2kdn s HIS 22 N -2.00 3.67 0.06 1.61 5.04 -1.25 -4.96 115.29 117.46 2kdn s HIS 22 Ca 0.43 1.68 -0.30 0.00 -1.54 0.00 0.00 55.06 55.33 2kdn s HIS 22 Cb 0.21 -3.14 -0.09 0.00 0.04 0.00 0.00 32.58 29.61 2kdn s HIS 22 CO 0.35 -0.10 1.84 -1.64 -2.34 0.00 0.00 174.74 172.85 2kdn s MET 23 N 0.72 4.15 0.24 2.88 1.00 -1.26 -4.70 119.30 122.33 2kdn s MET 23 Ca 0.51 2.52 -0.22 0.00 0.00 0.00 0.00 55.69 58.50 2kdn s MET 23 Cb -0.23 -3.89 0.04 0.00 0.00 0.00 0.00 34.83 30.74 2kdn s MET 23 CO 0.29 -0.88 0.74 0.00 0.00 0.00 0.00 175.02 175.17 2kdn h ILE 25 N 2.00 0.96 -0.63 0.00 6.09 -2.01 -0.78 117.51 123.15 2kdn h ILE 25 Ca -0.22 -0.23 -0.09 0.00 -1.37 0.00 0.00 64.86 62.95 2kdn h ILE 25 Cb 1.26 0.24 -0.02 0.00 0.47 0.00 0.00 36.82 38.77 2kdn h ILE 25 CO 0.26 0.12 0.03 -0.61 -3.07 0.00 0.00 178.15 174.88 2kdn h GLN 26 N 0.66 1.09 -0.83 2.19 4.15 -1.96 -2.75 115.11 117.66 2kdn h GLN 26 Ca 0.33 -0.33 -0.01 0.00 0.77 0.00 0.00 58.65 59.40 2kdn h GLN 26 Cb 0.40 -0.11 -0.04 0.00 0.21 0.00 0.00 27.48 27.95 2kdn h GLN 26 CO -0.11 1.04 0.46 -0.22 -1.93 0.00 0.00 178.83 178.07 2kdn h LYS 27 N 1.00 1.16 0.45 1.69 3.11 -1.44 -0.74 116.57 121.80 2kdn h LYS 27 Ca 0.18 -0.13 -0.02 0.00 -2.81 0.00 0.00 60.65 57.87 2kdn h LYS 27 Cb 0.53 -0.23 0.00 0.00 -1.00 0.00 0.00 32.23 31.53 2kdn h LYS 27 CO 0.03 0.85 -0.22 0.28 -2.81 0.00 0.00 179.45 177.57 2kdn h VAL 28 N 1.16 0.53 -0.33 2.00 2.07 -1.24 -1.36 116.25 119.08 2kdn h VAL 28 Ca 0.29 -0.28 0.03 0.00 0.82 0.00 0.00 66.70 67.56 2kdn h VAL 28 Cb 0.02 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 30.42 2kdn h VAL 28 CO -0.05 0.05 0.15 0.40 0.02 0.00 0.00 177.57 178.14 2kdn h ILE 29 N -0.78 0.97 -0.09 4.57 5.03 -1.40 -0.91 117.51 124.90 2kdn h ILE 29 Ca -0.06 -0.11 0.03 0.00 -0.12 0.00 0.00 64.86 64.60 2kdn h ILE 29 Cb 0.55 0.62 -0.03 0.00 -3.03 0.00 0.00 36.82 34.93 2kdn h ILE 29 CO 0.10 0.06 -0.11 -0.08 -0.68 0.00 0.00 178.15 177.45 2kdn h GLU 30 N 0.32 -0.13 -0.26 2.37 4.22 -1.11 -2.45 114.58 117.53 2kdn h GLU 30 Ca 0.14 0.01 -0.09 0.00 0.08 0.00 0.00 59.36 59.50 2kdn h GLU 30 Cb 0.06 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 2kdn h GLU 30 CO -0.10 -0.09 -0.22 0.22 -2.18 0.00 0.00 179.01 176.63 2kdn h ASP 31 N -0.14 0.48 0.46 1.04 3.58 -0.99 -1.11 116.42 119.74 2kdn h ASP 31 Ca 0.07 -0.15 -0.02 0.00 0.42 0.00 0.00 57.03 57.35 2kdn h ASP 31 Cb 0.24 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 41.16 2kdn h ASP 31 CO -0.17 0.71 -0.22 0.11 -2.88 0.00 0.00 179.24 176.78 2kdn h LYS 32 N 0.43 -0.60 0.00 0.28 1.57 -0.78 -0.52 116.57 116.95 2kdn h LYS 32 Ca 0.07 0.04 -0.09 0.00 -1.87 0.00 0.00 60.65 58.80 2kdn h LYS 32 Cb 0.63 0.14 -0.01 0.00 0.08 0.00 0.00 32.23 33.06 2kdn h LYS 32 CO 0.04 -0.32 -0.44 1.37 -0.57 0.00 0.00 179.45 179.54 2kdn h LEU 33 N -0.79 0.00 -0.71 2.94 8.10 -1.46 -2.93 115.31 120.45 2kdn h LEU 33 Ca -0.06 0.00 -0.08 0.00 0.11 0.00 0.00 57.88 57.84 2kdn h LEU 33 Cb 0.55 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 40.75 2kdn h LEU 33 CO 0.10 0.44 0.07 -1.28 -4.11 0.00 0.00 178.44 173.67 2kdn h SER 34 N 0.00 1.02 0.47 0.17 0.87 -1.04 -1.01 113.55 114.03 2kdn h SER 34 Ca -0.00 -0.26 -0.07 0.00 -1.23 0.00 0.00 61.79 60.23 2kdn h SER 34 Cb 0.86 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 62.54 2kdn h SER 34 CO 0.06 1.04 -0.32 0.28 -0.53 0.00 0.00 176.83 177.36 2kdn h SER 35 N 0.99 0.00 0.00 6.23 0.02 -0.91 -0.09 113.55 119.79 2kdn h SER 35 Ca 0.19 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 61.04 2kdn h SER 35 Cb 0.47 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.99 2kdn h SER 35 CO 0.02 0.32 -0.72 0.00 -1.14 0.00 0.00 176.83 175.30 2kdn h ALA 36 N 1.68 0.11 0.00 3.77 0.00 -1.39 -3.39 119.26 120.05 2kdn h ALA 36 Ca -0.00 -0.75 0.00 0.00 0.00 0.00 0.00 54.91 54.16 2kdn h ALA 36 Cb 0.63 0.51 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2kdn h ALA 36 CO 0.04 0.49 -0.66 -0.07 0.00 0.00 0.00 179.25 179.05 2kdn h LEU 37 N -1.00 0.00 -3.01 0.00 3.38 -1.30 -3.49 115.31 109.89 2kdn h LEU 37 Ca -0.14 -0.13 -0.23 0.00 0.09 0.00 0.00 57.88 57.47 2kdn h LEU 37 Cb 0.83 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.59 2kdn h LEU 37 CO -0.09 0.07 -0.77 0.29 0.09 0.00 0.00 178.44 178.02 2kdn n LYS 38 N -2.35 -1.89 -3.15 1.13 5.02 -0.05 -4.60 118.16 112.26 2kdn n LYS 38 Ca 0.02 1.52 -0.39 0.00 -2.02 0.00 0.00 58.31 57.44 2kdn n LYS 38 Cb 0.48 -3.81 -0.06 0.00 -0.02 0.00 0.00 35.03 31.62 2kdn n LYS 38 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2kdn s PRO 39 N -3.07 4.30 0.54 1.97 0.04 -1.26 -4.60 135.00 132.92 2kdn s PRO 39 Ca 0.21 0.63 0.27 0.00 0.04 0.00 0.00 61.00 62.15 2kdn s PRO 39 Cb -0.03 -3.51 1.52 0.00 0.04 0.00 0.00 34.50 32.51 2kdn s PRO 39 CO 0.83 -0.06 2.12 1.79 0.04 0.00 0.00 177.00 181.71 2kdn h THR 40 N 4.96 0.62 -3.61 1.26 1.35 -0.75 -3.42 112.91 113.32 2kdn h THR 40 Ca -0.36 -0.37 -0.20 0.00 -0.55 0.00 0.00 66.41 64.92 2kdn h THR 40 Cb 1.17 1.23 -0.26 0.00 -1.73 0.00 0.00 68.15 68.55 2kdn h THR 40 CO 0.76 0.09 -0.64 0.12 -0.25 0.00 0.00 175.52 175.60 2kdn s PHE 41 N -4.39 -0.03 -0.10 4.73 5.36 -0.99 -4.87 117.98 117.69 2kdn s PHE 41 Ca -0.04 0.08 -0.03 0.00 -0.96 0.00 0.00 56.93 55.98 2kdn s PHE 41 Cb 0.14 -0.00 0.05 0.00 -0.34 0.00 0.00 43.02 42.87 2kdn s PHE 41 CO 0.59 -0.06 0.13 -1.17 -1.46 0.00 0.00 175.22 173.24 2kdn s LEU 42 N -0.20 0.05 -0.17 6.12 2.96 -1.26 -0.83 118.68 125.34 2kdn s LEU 42 Ca -0.03 0.02 -0.06 0.00 -0.22 0.00 0.00 54.13 53.85 2kdn s LEU 42 Cb -0.02 0.09 -0.04 0.00 0.50 0.00 0.00 46.19 46.73 2kdn s LEU 42 CO 0.00 -0.28 0.03 -0.70 -1.32 0.00 0.00 176.35 174.08 2kdn s GLU 43 N 2.24 3.87 -0.22 1.98 2.56 -0.18 -4.96 118.70 124.00 2kdn s GLU 43 Ca 0.04 -0.40 0.01 0.00 0.00 0.00 0.00 54.97 54.62 2kdn s GLU 43 Cb -0.13 -3.11 0.03 0.00 2.00 0.00 0.00 34.13 32.92 2kdn s GLU 43 CO -0.06 0.27 -0.13 -0.51 -0.56 0.00 0.00 175.26 174.26 2kdn s LEU 44 N 0.35 2.82 0.04 2.70 1.02 -1.26 -0.39 118.68 123.96 2kdn s LEU 44 Ca 0.01 -0.92 0.08 0.00 0.02 0.00 0.00 54.13 53.32 2kdn s LEU 44 Cb -0.13 -1.56 -0.03 0.00 0.02 0.00 0.00 46.19 44.50 2kdn s LEU 44 CO 0.01 -0.09 -0.24 -0.69 0.02 0.00 0.00 176.35 175.36 2kdn s VAL 45 N 1.25 1.91 -0.26 -1.59 1.01 -0.43 -4.98 120.40 117.32 2kdn s VAL 45 Ca -0.00 -1.27 -0.29 0.00 0.00 0.00 0.00 61.98 60.42 2kdn s VAL 45 Cb -0.16 -1.64 -0.01 0.00 0.00 0.00 0.00 36.38 34.57 2kdn s VAL 45 CO -0.08 0.32 1.46 -0.62 0.00 0.00 0.00 175.10 176.18 2kdn s ASP 46 N -1.13 6.52 -0.53 3.32 2.15 -1.26 -0.41 116.67 125.33 2kdn s ASP 46 Ca 0.10 1.42 0.05 0.00 0.43 0.00 0.00 52.55 54.55 2kdn s ASP 46 Cb -0.09 -2.54 0.18 0.00 -0.30 0.00 0.00 42.92 40.17 2kdn s ASP 46 CO 0.02 -1.17 0.43 1.17 -0.17 0.00 0.00 175.17 175.45 2kdn n LYS 47 N 7.48 0.94 -2.03 4.34 0.00 -0.39 -4.89 118.16 123.62 2kdn n LYS 47 Ca 0.17 -3.74 -0.42 0.00 0.00 0.00 0.00 58.31 54.32 2kdn n LYS 47 Cb 0.46 -1.90 -0.03 0.00 0.00 0.00 0.00 35.03 33.56 2kdn n LYS 47 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 2kdn s SER 48 N -0.72 6.69 0.53 3.14 0.01 -1.25 -4.37 113.70 117.73 2kdn s SER 48 Ca 0.30 2.49 0.31 0.00 1.31 0.00 0.00 55.95 60.36 2kdn s SER 48 Cb 0.02 -2.59 1.40 0.00 0.21 0.00 0.00 66.02 65.07 2kdn s SER 48 CO -0.17 -0.76 2.02 0.00 0.41 0.00 0.00 173.24 174.73 2kdn n GLY 50 N -0.28 3.91 3.18 0.00 0.00 -1.26 -5.06 105.19 105.67 2kdn n GLY 50 Ca -0.01 -0.59 -0.39 0.00 0.00 0.00 0.00 46.02 45.03 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 4.61 -1.41 3.76 0.00 0.00 -1.26 -4.86 105.19 106.03 2kdn n GLY 52 Ca -0.03 -1.51 -0.41 0.00 0.00 0.00 0.00 46.02 44.07 2kdn n GLY 52 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kdn s THR 53 N -1.23 2.81 0.02 2.61 2.01 -1.26 -4.36 115.64 116.25 2kdn s THR 53 Ca 0.00 0.79 0.02 0.00 0.31 0.00 0.00 61.69 62.81 2kdn s THR 53 Cb 0.00 -3.50 -0.02 0.00 0.01 0.00 0.00 72.50 68.99 2kdn s THR 53 CO 0.00 0.18 -0.06 -0.44 -0.69 0.00 0.00 174.62 173.60 2kdn s SER 54 N -0.39 0.72 -0.12 3.53 0.01 -1.26 -4.26 113.70 111.93 2kdn s SER 54 Ca 0.50 -0.38 -0.01 0.00 1.31 0.00 0.00 55.95 57.36 2kdn s SER 54 Cb -0.39 0.00 -0.02 0.00 0.21 0.00 0.00 66.02 65.82 2kdn s SER 54 CO 0.50 -0.12 -0.08 -0.36 0.41 0.00 0.00 173.24 173.59 2kdn s PHE 55 N -0.94 2.91 -0.29 2.43 0.08 -1.10 -1.26 117.98 119.81 2kdn s PHE 55 Ca -0.06 -0.34 0.01 0.00 0.12 0.00 0.00 56.93 56.66 2kdn s PHE 55 Cb -0.07 -1.84 0.06 0.00 -0.57 0.00 0.00 43.02 40.60 2kdn s PHE 55 CO 0.00 -0.00 -0.04 0.34 -0.10 0.00 0.00 175.22 175.42 2kdn s ASP 56 N 0.03 4.70 -0.19 1.36 -1.08 0.45 -0.57 116.67 121.37 2kdn s ASP 56 Ca -0.02 -1.44 -0.03 0.00 -0.52 0.00 0.00 52.55 50.54 2kdn s ASP 56 Cb -0.14 -1.64 -0.02 0.00 -1.46 0.00 0.00 42.92 39.67 2kdn s ASP 56 CO 0.03 -0.25 -0.05 0.00 0.52 0.00 0.00 175.17 175.42 2kdn s ALA 57 N 1.15 2.85 -0.32 3.66 0.00 0.40 -1.31 121.76 128.20 2kdn s ALA 57 Ca -0.05 -1.01 -0.21 0.00 0.00 0.00 0.00 51.96 50.70 2kdn s ALA 57 Cb -0.20 -1.59 -0.01 0.00 0.00 0.00 0.00 23.12 21.33 2kdn s ALA 57 CO -0.04 -0.11 0.65 0.08 0.00 0.00 0.00 175.76 176.34 2kdn s VAL 58 N 0.93 4.91 0.02 0.00 1.01 0.48 -0.38 120.40 127.37 2kdn s VAL 58 Ca -0.00 0.83 -0.06 0.00 0.00 0.00 0.00 61.98 62.75 2kdn s VAL 58 Cb -0.15 -4.03 -0.05 0.00 0.00 0.00 0.00 36.38 32.15 2kdn s VAL 58 CO 0.01 -0.19 0.28 0.27 0.00 0.00 0.00 175.10 175.46 2kdn s ILE 59 N 2.67 5.29 -0.34 2.22 -4.36 0.47 -1.01 121.20 126.15 2kdn s ILE 59 Ca 0.26 0.13 -0.00 0.00 -0.26 0.00 0.00 60.65 60.78 2kdn s ILE 59 Cb -0.15 -3.58 0.11 0.00 1.25 0.00 0.00 42.46 40.10 2kdn s ILE 59 CO 0.13 0.33 0.13 -0.69 0.24 0.00 0.00 174.94 175.07 2kdn s VAL 60 N -1.34 0.97 -0.06 8.37 1.01 -0.01 -1.59 120.40 127.75 2kdn s VAL 60 Ca 0.29 -1.65 -0.05 0.00 0.00 0.00 0.00 61.98 60.57 2kdn s VAL 60 Cb -0.13 -1.72 0.02 0.00 0.00 0.00 0.00 36.38 34.54 2kdn s VAL 60 CO 0.17 -0.73 0.15 -0.55 0.00 0.00 0.00 175.10 174.14 2kdn s SER 61 N 1.34 -0.15 0.53 3.32 0.15 -0.82 0.06 113.70 118.13 2kdn s SER 61 Ca 0.12 0.30 0.34 0.00 0.70 0.00 0.00 55.95 57.42 2kdn s SER 61 Cb -0.19 0.29 1.54 0.00 -1.71 0.00 0.00 66.02 65.96 2kdn s SER 61 CO -0.19 -0.07 2.02 0.78 1.20 0.00 0.00 173.24 176.99 2kdn h ASN 62 N 6.09 0.00 0.15 5.45 2.35 -1.88 -2.98 115.58 124.76 2kdn h ASN 62 Ca -0.27 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.47 2kdn h ASN 62 Cb 1.19 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.56 2kdn h ASN 62 CO 0.42 0.00 -0.02 -1.13 -1.65 0.00 0.00 177.43 175.05 2kdn h ASN 63 N 0.00 0.00 -0.01 5.81 -1.24 -1.85 -2.09 115.58 116.20 2kdn h ASN 63 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 2kdn h ASN 63 Cb 0.37 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.42 2kdn h ASN 63 CO 0.00 0.02 -0.52 0.49 -1.29 0.00 0.00 177.43 176.13 2kdn n PHE 64 N -3.40 0.00 0.99 0.67 3.01 -1.13 -4.25 117.46 113.36 2kdn n PHE 64 Ca -0.02 0.00 0.14 0.00 1.01 0.00 0.00 57.45 58.57 2kdn n PHE 64 Cb 0.12 0.00 0.58 0.00 -0.01 0.00 0.00 39.48 40.17 2kdn n PHE 64 CO 0.00 0.00 0.00 -0.85 1.01 0.00 0.00 176.76 176.92 2kdn n GLU 65 N -0.37 0.01 0.00 -1.08 -0.00 -0.79 -2.66 120.64 115.76 2kdn n GLU 65 Ca 0.07 0.00 0.11 0.00 -0.00 0.00 0.00 57.16 57.35 2kdn n GLU 65 Cb 0.39 -1.51 0.51 0.00 -0.00 0.00 0.00 31.44 30.83 2kdn n GLU 65 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 2kdn n ASP 66 N -1.51 0.00 -0.79 -1.84 2.03 -1.26 -4.88 116.55 108.30 2kdn n ASP 66 Ca 0.07 0.41 -0.10 0.00 0.52 0.00 0.00 54.79 55.68 2kdn n ASP 66 Cb 0.34 -0.46 -0.04 0.00 -0.72 0.00 0.00 41.12 40.23 2kdn n ASP 66 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2kdn n LYS 67 N -1.46 -0.88 -2.04 -0.67 4.76 -1.09 -4.92 118.16 111.86 2kdn n LYS 67 Ca 0.06 0.83 -0.26 0.00 -2.87 0.00 0.00 58.31 56.08 2kdn n LYS 67 Cb 0.26 -4.82 -0.05 0.00 -1.84 0.00 0.00 35.03 28.57 2kdn n LYS 67 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 2kdn s LYS 68 N -2.76 2.53 0.03 1.97 -0.14 -1.26 -4.82 119.74 115.29 2kdn s LYS 68 Ca 0.00 -0.29 -0.31 0.00 -1.36 0.00 0.00 55.97 54.02 2kdn s LYS 68 Cb 0.00 -5.06 -0.17 0.00 -1.68 0.00 0.00 37.83 30.92 2kdn s LYS 68 CO 0.00 -3.42 1.28 1.25 -0.76 0.00 0.00 175.35 173.70 2kdn h LEU 69 N 18.00 -0.91 -1.19 3.17 7.12 -1.95 -0.48 115.31 139.06 2kdn h LEU 69 Ca 0.10 0.03 -0.08 0.00 0.13 0.00 0.00 57.88 58.05 2kdn h LEU 69 Cb 1.00 0.24 -0.01 0.00 -0.53 0.00 0.00 40.66 41.36 2kdn h LEU 69 CO 1.20 -0.55 -0.33 0.17 -0.13 0.00 0.00 178.44 178.80 2kdn h LEU 70 N -1.26 0.12 -0.08 2.25 -0.00 -1.99 -1.63 115.31 112.73 2kdn h LEU 70 Ca -0.11 -0.04 -0.14 0.00 -0.00 0.00 0.00 57.88 57.59 2kdn h LEU 70 Cb 0.83 -0.03 0.01 0.00 -0.00 0.00 0.00 40.66 41.46 2kdn h LEU 70 CO 0.18 0.45 -0.50 -0.78 -0.00 0.00 0.00 178.44 177.79 2kdn h ASP 71 N 0.11 0.58 0.29 0.17 3.58 -1.94 0.01 116.42 119.22 2kdn h ASP 71 Ca 0.01 -0.67 -0.11 0.00 0.42 0.00 0.00 57.03 56.69 2kdn h ASP 71 Cb 0.64 -0.17 -0.01 0.00 1.72 0.00 0.00 39.33 41.51 2kdn h ASP 71 CO 0.05 1.15 -0.43 0.08 -2.88 0.00 0.00 179.24 177.21 2kdn h ARG 72 N 0.04 0.19 -0.02 0.28 0.11 -1.03 -1.55 114.38 112.41 2kdn h ARG 72 Ca -0.04 -0.09 -0.00 0.00 0.10 0.00 0.00 59.98 59.95 2kdn h ARG 72 Cb 1.16 -0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.24 2kdn h ARG 72 CO 0.10 0.59 0.00 1.25 0.10 0.00 0.00 179.97 182.02 2kdn h HIS 73 N 0.16 0.03 -0.71 4.08 2.76 -1.17 -0.39 115.15 119.91 2kdn h HIS 73 Ca 0.01 -0.00 -0.05 0.00 -2.20 0.00 0.00 60.37 58.13 2kdn h HIS 73 Cb 0.83 -0.01 -0.03 0.00 1.55 0.00 0.00 27.41 29.75 2kdn h HIS 73 CO 0.01 0.27 0.26 0.07 -1.30 0.00 0.00 177.93 177.24 2kdn h ARG 74 N -0.21 1.08 0.03 5.26 0.11 -0.88 -1.11 114.38 118.66 2kdn h ARG 74 Ca 0.01 -0.21 -0.00 0.00 0.10 0.00 0.00 59.98 59.87 2kdn h ARG 74 Cb 0.26 -0.17 0.00 0.00 1.11 0.00 0.00 29.97 31.17 2kdn h ARG 74 CO 0.00 0.91 -0.01 -0.07 0.10 0.00 0.00 179.97 180.89 2kdn h LEU 75 N 1.03 -0.03 -0.42 0.08 -0.00 -1.23 -1.50 115.31 113.24 2kdn h LEU 75 Ca 0.23 -0.20 0.05 0.00 -0.00 0.00 0.00 57.88 57.96 2kdn h LEU 75 Cb 0.25 0.01 -0.04 0.00 -0.00 0.00 0.00 40.66 40.88 2kdn h LEU 75 CO -0.01 0.19 0.16 0.58 -0.00 0.00 0.00 178.44 179.36 2kdn h VAL 76 N -0.25 0.89 0.00 1.22 2.07 -0.93 -2.14 116.25 117.11 2kdn h VAL 76 Ca -0.00 -0.12 -0.07 0.00 0.82 0.00 0.00 66.70 67.33 2kdn h VAL 76 Cb 0.23 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 30.52 2kdn h VAL 76 CO 0.01 0.06 -0.33 0.78 0.02 0.00 0.00 177.57 178.11 2kdn h ASN 77 N 0.34 0.00 -0.32 0.57 -0.26 -1.12 0.14 115.58 114.93 2kdn h ASN 77 Ca 0.19 0.00 -0.08 0.00 -0.56 0.00 0.00 56.30 55.86 2kdn h ASN 77 Cb 0.16 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.41 2kdn h ASN 77 CO -0.18 0.33 -0.09 0.74 -1.06 0.00 0.00 177.43 177.16 2kdn h THR 78 N 0.00 1.28 0.17 2.81 2.02 -0.62 0.36 112.91 118.93 2kdn h THR 78 Ca -0.00 -1.15 -0.25 0.00 0.77 0.00 0.00 66.41 65.77 2kdn h THR 78 Cb 0.58 1.37 0.02 0.00 -1.74 0.00 0.00 68.15 68.38 2kdn h THR 78 CO 0.04 0.37 -1.15 0.40 0.37 0.00 0.00 175.52 175.55 2kdn h ILE 79 N 0.40 1.34 0.00 3.11 5.03 -1.29 -3.24 117.51 122.86 2kdn h ILE 79 Ca 0.08 -2.56 0.00 0.00 -0.12 0.00 0.00 64.86 62.26 2kdn h ILE 79 Cb 0.59 3.06 0.00 0.00 -3.03 0.00 0.00 36.82 37.44 2kdn h ILE 79 CO 0.03 0.75 0.00 0.18 -0.68 0.00 0.00 178.15 178.43 2kdn n LEU 80 N -3.95 0.00 0.10 1.44 4.32 0.48 -2.43 117.00 116.96 2kdn n LEU 80 Ca -0.17 0.18 -0.11 0.00 -0.02 0.00 0.00 56.01 55.89 2kdn n LEU 80 Cb 0.93 -0.18 -0.07 0.00 -1.62 0.00 0.00 43.42 42.48 2kdn n LEU 80 CO 0.51 -0.06 0.51 0.50 -1.22 0.00 0.00 177.39 177.63 2kdn h LYS 81 N 0.00 -0.52 -0.02 3.23 1.63 -0.94 -0.52 116.57 119.43 2kdn h LYS 81 Ca 0.00 0.04 -0.19 0.00 -0.85 0.00 0.00 60.65 59.64 2kdn h LYS 81 Cb 0.12 0.12 -0.01 0.00 -0.60 0.00 0.00 32.23 31.86 2kdn h LYS 81 CO 0.00 -0.35 -0.83 0.93 -3.45 0.00 0.00 179.45 175.76 2kdn h GLU 82 N -0.54 0.24 0.15 1.90 5.08 -1.74 -3.34 114.58 116.33 2kdn h GLU 82 Ca -0.01 -0.24 0.02 0.00 -1.00 0.00 0.00 59.36 58.13 2kdn h GLU 82 Cb 0.53 0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.80 2kdn h GLU 82 CO -0.17 0.94 -0.35 1.49 -1.00 0.00 0.00 179.01 179.92 2kdn h GLU 83 N 0.15 -0.58 -0.98 2.33 4.57 -1.37 -1.20 114.58 117.50 2kdn h GLU 83 Ca -0.04 0.04 0.28 0.00 -1.18 0.00 0.00 59.36 58.45 2kdn h GLU 83 Cb 1.43 0.13 -0.05 0.00 -0.16 0.00 0.00 28.75 30.11 2kdn h GLU 83 CO 0.13 -0.38 0.69 -0.07 -1.18 0.00 0.00 179.01 178.20 2kdn h LEU 84 N -0.60 0.07 -2.12 1.64 3.38 -1.21 -1.27 115.31 115.21 2kdn h LEU 84 Ca 0.02 0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.07 2kdn h LEU 84 Cb 0.62 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 2kdn h LEU 84 CO -0.19 0.02 0.31 1.56 0.09 0.00 0.00 178.44 180.23 2kdn h GLN 85 N 0.07 0.00 -0.03 1.13 1.08 -1.34 0.33 115.11 116.36 2kdn h GLN 85 Ca 0.48 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.68 2kdn h GLN 85 Cb 1.78 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 29.21 2kdn h GLN 85 CO -0.04 0.00 -0.00 0.09 -0.95 0.00 0.00 178.83 177.92 2kdn n ASN 86 N -3.57 2.74 -4.17 1.46 3.02 -0.48 -4.94 115.26 109.32 2kdn n ASN 86 Ca 0.03 -1.87 -0.25 0.00 -0.03 0.00 0.00 54.58 52.46 2kdn n ASN 86 Cb 0.44 0.00 -0.15 0.00 -0.61 0.00 0.00 39.78 39.46 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 -1.74 1.42 0.10 2.41 1.01 0.11 -5.03 121.20 119.48 2kdn s ILE 87 Ca 0.24 -0.77 -0.14 0.00 0.00 0.00 0.00 60.65 59.98 2kdn s ILE 87 Cb 0.17 -1.18 -0.09 0.00 0.01 0.00 0.00 42.46 41.37 2kdn s ILE 87 CO 0.26 0.40 1.40 -0.74 0.00 0.00 0.00 174.94 176.27 2kdn h HIS 88 N 5.71 0.88 -1.40 3.97 -0.00 -1.80 -3.44 115.15 119.07 2kdn h HIS 88 Ca -0.37 -0.28 0.02 0.00 -0.00 0.00 0.00 60.37 59.74 2kdn h HIS 88 Cb 1.15 -0.18 -0.23 0.00 -0.00 0.00 0.00 27.41 28.15 2kdn h HIS 88 CO 0.40 1.05 -0.31 0.00 -0.00 0.00 0.00 177.93 179.07 2kdn s ALA 89 N -4.26 -1.90 -0.25 5.26 0.00 -1.26 -5.08 121.76 114.26 2kdn s ALA 89 Ca -0.12 1.67 -0.09 0.00 0.00 0.00 0.00 51.96 53.42 2kdn s ALA 89 Cb 0.09 -1.97 -0.04 0.00 0.00 0.00 0.00 23.12 21.20 2kdn s ALA 89 CO 0.84 -1.24 0.12 0.12 0.00 0.00 0.00 175.76 175.60 2kdn s PHE 90 N 2.78 3.18 0.06 0.00 5.36 -1.26 -2.72 117.98 125.37 2kdn s PHE 90 Ca 0.15 -0.10 0.05 0.00 -0.96 0.00 0.00 56.93 56.06 2kdn s PHE 90 Cb -0.15 -2.27 -0.04 0.00 -0.34 0.00 0.00 43.02 40.23 2kdn s PHE 90 CO -0.19 -0.18 -0.07 -1.12 -1.46 0.00 0.00 175.22 172.20 2kdn s SER 91 N 1.44 4.60 0.01 6.13 0.01 0.27 -5.01 113.70 121.14 2kdn s SER 91 Ca 0.06 -0.24 0.02 0.00 1.31 0.00 0.00 55.95 57.10 2kdn s SER 91 Cb -0.15 -1.01 -0.01 0.00 0.21 0.00 0.00 66.02 65.07 2kdn s SER 91 CO 0.06 0.22 -0.06 0.00 0.41 0.00 0.00 173.24 173.87 2kdn s MET 92 N -1.86 0.46 -0.31 12.44 0.23 -1.26 -0.45 119.30 128.55 2kdn s MET 92 Ca 0.20 -0.32 -0.06 0.00 -1.03 0.00 0.00 55.69 54.48 2kdn s MET 92 Cb -0.11 -0.40 0.02 0.00 -1.53 0.00 0.00 34.83 32.81 2kdn s MET 92 CO 0.12 0.10 0.08 0.15 -2.03 0.00 0.00 175.02 173.44 2kdn s LYS 93 N -0.44 2.88 -0.33 3.16 3.01 0.49 -4.93 119.74 123.58 2kdn s LYS 93 Ca -0.00 -0.99 -0.26 0.00 -1.01 0.00 0.00 55.97 53.70 2kdn s LYS 93 Cb -0.04 -3.37 0.01 0.00 -1.01 0.00 0.00 37.83 33.42 2kdn s LYS 93 CO -0.00 -0.52 0.93 0.00 0.51 0.00 0.00 175.35 176.26 2kdn s HIS 95 N 3.33 0.74 0.32 0.00 3.76 -0.62 -4.96 115.29 117.85 2kdn s HIS 95 Ca 0.39 -1.07 0.09 0.00 -0.15 0.00 0.00 55.06 54.32 2kdn s HIS 95 Cb -0.13 -0.30 -0.05 0.00 1.11 0.00 0.00 32.58 33.22 2kdn s HIS 95 CO 0.15 -0.66 0.04 0.95 -0.85 0.00 0.00 174.74 174.37 2kdn s THR 96 N -4.05 2.99 0.57 1.30 -4.23 -1.26 -1.94 115.64 109.02 2kdn s THR 96 Ca 0.25 -1.88 0.33 0.00 -1.18 0.00 0.00 61.69 59.21 2kdn s THR 96 Cb 0.05 -2.85 0.37 0.00 1.34 0.00 0.00 72.50 71.41 2kdn s THR 96 CO 0.05 -0.25 2.25 -0.65 -0.54 0.00 0.00 174.62 175.47 2kdn h PRO 97 N 1.76 0.00 -0.04 3.99 0.11 -1.84 0.13 132.00 136.12 2kdn h PRO 97 Ca -0.43 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.67 2kdn h PRO 97 Cb 1.25 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.36 2kdn h PRO 97 CO 0.64 0.02 -0.00 -0.07 -0.21 0.00 0.00 178.00 178.37 2kdn h LEU 98 N 0.00 0.07 -0.29 2.35 -0.00 -1.96 0.50 115.31 115.98 2kdn h LEU 98 Ca -0.00 -0.32 -0.18 0.00 -0.00 0.00 0.00 57.88 57.38 2kdn h LEU 98 Cb 0.06 -0.02 -0.02 0.00 -0.00 0.00 0.00 40.66 40.68 2kdn h LEU 98 CO 0.00 0.37 -0.86 -0.33 -0.00 0.00 0.00 178.44 177.62 2kdn h GLU 99 N -0.24 0.03 -0.49 1.13 5.08 -1.82 -3.15 114.58 115.12 2kdn h GLU 99 Ca 0.01 -0.04 -0.09 0.00 -1.00 0.00 0.00 59.36 58.24 2kdn h GLU 99 Cb 0.34 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 2kdn h GLU 99 CO 0.00 0.87 -0.06 -0.92 -1.00 0.00 0.00 179.01 177.90 2kdn h TYR 100 N 0.01 1.01 -0.87 4.33 3.20 -0.73 -2.85 116.97 121.06 2kdn h TYR 100 Ca -0.02 -0.20 0.07 0.00 3.14 0.00 0.00 58.73 61.73 2kdn h TYR 100 Cb 1.52 -0.25 -0.06 0.00 1.54 0.00 0.00 36.73 39.47 2kdn h TYR 100 CO 0.00 0.96 0.57 0.22 -1.64 0.00 0.00 178.16 178.27 2kdn h ASP 101 N 0.76 0.85 -0.27 -2.11 3.58 -0.88 -1.43 116.42 116.91 2kdn h ASP 101 Ca 0.13 0.01 0.03 0.00 0.42 0.00 0.00 57.03 57.62 2kdn h ASP 101 Cb 0.60 -0.17 -0.03 0.00 1.72 0.00 0.00 39.33 41.45 2kdn h ASP 101 CO 0.04 0.53 0.11 0.11 -2.88 0.00 0.00 179.24 177.15 2kdn h LYS 102 N 0.95 0.23 -0.46 0.28 1.57 -1.47 0.91 116.57 118.59 2kdn h LYS 102 Ca 0.38 -0.01 -0.09 0.00 -1.87 0.00 0.00 60.65 59.06 2kdn h LYS 102 Cb 0.25 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.50 2kdn h LYS 102 CO -0.15 0.16 -0.06 -0.07 -0.57 0.00 0.00 179.45 178.76 2kdn h LEU 103 N 0.24 0.85 0.21 2.94 3.38 -1.19 0.81 115.31 122.55 2kdn h LEU 103 Ca 0.12 -0.34 -0.33 0.00 0.09 0.00 0.00 57.88 57.42 2kdn h LEU 103 Cb 0.07 -0.23 0.02 0.00 0.09 0.00 0.00 40.66 40.61 2kdn h LEU 103 CO -0.11 0.99 -1.57 0.07 0.09 0.00 0.00 178.44 177.91 2kdn h LYS 104 N 0.70 0.44 0.00 1.13 2.10 -1.15 -3.34 116.57 116.44 2kdn h LYS 104 Ca 0.12 -0.75 -0.07 0.00 -2.00 0.00 0.00 60.65 57.95 2kdn h LYS 104 Cb 0.59 0.28 -0.01 0.00 -0.90 0.00 0.00 32.23 32.19 2kdn h LYS 104 CO 0.04 1.36 -0.38 0.77 -2.00 0.00 0.00 179.45 179.23 2kdn h SER 105 N 0.06 0.00 0.00 7.07 0.02 -0.90 -3.45 113.55 116.35 2kdn h SER 105 Ca -0.30 -0.83 -0.04 0.00 -0.84 0.00 0.00 61.79 59.78 2kdn h SER 105 Cb 2.08 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 64.61 2kdn h SER 105 CO 0.21 1.14 -0.84 2.29 -1.14 0.00 0.00 176.83 178.49 2kdn n LYS 106 N -4.56 0.06 0.00 3.45 0.00 -1.04 -5.07 118.16 111.01 2kdn n LYS 106 Ca -0.17 0.03 0.00 0.00 -0.00 0.00 0.00 58.31 58.17 2kdn n LYS 106 Cb 0.53 -0.61 0.00 0.00 -0.00 0.00 0.00 35.03 34.96 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 2.95 4.39 0.00 2.58 0.00 0.28 -5.00 105.19 110.39 2kdn n GLY 107 Ca -0.05 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.15 2kdn n GLY 107 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76