#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 0.74 3.37 -5.12 0.00 -1.26 -5.01 105.19 97.91 2kdn n GLY 2 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.56 2kdn n GLY 2 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2kdn s SER 3 N -2.21 6.88 0.18 1.61 0.01 -1.26 -5.03 113.70 113.88 2kdn s SER 3 Ca 0.00 -2.77 -0.30 0.00 1.31 0.00 0.00 55.95 54.19 2kdn s SER 3 Cb 0.00 -2.27 -0.08 0.00 0.21 0.00 0.00 66.02 63.88 2kdn s SER 3 CO 0.00 -0.64 1.11 -0.44 0.41 0.00 0.00 173.24 173.69 2kdn s SER 4 N 2.38 7.24 -0.24 2.44 0.01 -1.26 -5.03 113.70 119.24 2kdn s SER 4 Ca 0.26 2.11 -0.03 0.00 1.31 0.00 0.00 55.95 59.60 2kdn s SER 4 Cb -0.08 -2.60 0.01 0.00 0.21 0.00 0.00 66.02 63.55 2kdn s SER 4 CO -0.08 -0.25 -0.04 -1.00 0.41 0.00 0.00 173.24 172.28 2kdn s HIS 5 N -0.19 3.00 -0.34 2.43 3.76 -1.26 -5.07 115.29 117.61 2kdn s HIS 5 Ca 0.50 -1.17 0.03 0.00 -0.15 0.00 0.00 55.06 54.27 2kdn s HIS 5 Cb -0.30 -2.10 0.10 0.00 1.11 0.00 0.00 32.58 31.40 2kdn s HIS 5 CO 0.35 -0.62 0.07 -1.01 -0.85 0.00 0.00 174.74 172.68 2kdn s HIS 6 N 1.42 3.30 0.16 1.40 4.02 -1.26 -5.09 115.29 119.25 2kdn s HIS 6 Ca 0.04 -2.75 -0.30 0.00 1.02 0.00 0.00 55.06 53.07 2kdn s HIS 6 Cb -0.15 -2.66 -0.07 0.00 -1.02 0.00 0.00 32.58 28.67 2kdn s HIS 6 CO -0.04 -0.92 1.01 -1.01 1.02 0.00 0.00 174.74 174.80 2kdn s HIS 7 N 0.98 3.77 -0.31 1.40 0.09 -1.26 -5.00 115.29 114.95 2kdn s HIS 7 Ca 0.11 1.76 -0.29 0.00 -0.00 0.00 0.00 55.06 56.64 2kdn s HIS 7 Cb -0.19 -3.12 0.01 0.00 -0.00 0.00 0.00 32.58 29.28 2kdn s HIS 7 CO -0.11 -0.03 1.23 -1.01 -0.00 0.00 0.00 174.74 174.82 2kdn s HIS 8 N -0.36 2.82 -0.04 1.40 0.09 -1.26 -5.01 115.29 112.94 2kdn s HIS 8 Ca 0.46 0.95 -0.14 0.00 -0.00 0.00 0.00 55.06 56.34 2kdn s HIS 8 Cb -0.26 -3.87 -0.05 0.00 -0.00 0.00 0.00 32.58 28.39 2kdn s HIS 8 CO 0.32 -1.42 0.36 -3.38 -0.00 0.00 0.00 174.74 170.62 2kdn s HIS 9 N 4.16 3.67 -0.66 1.40 0.00 -1.26 -5.04 115.29 117.57 2kdn s HIS 9 Ca 0.53 0.88 -0.19 0.00 -3.00 0.00 0.00 55.06 53.28 2kdn s HIS 9 Cb -0.15 -2.26 0.11 0.00 -4.00 0.00 0.00 32.58 26.28 2kdn s HIS 9 CO 0.21 0.59 0.80 -1.58 -1.00 0.00 0.00 174.74 173.77 2kdn s HIS 10 N -0.83 2.99 0.08 0.38 5.65 -1.26 -5.02 115.29 117.29 2kdn s HIS 10 Ca 0.22 -0.99 -0.31 0.00 0.25 0.00 0.00 55.06 54.23 2kdn s HIS 10 Cb -0.16 -4.09 -0.08 0.00 -1.18 0.00 0.00 32.58 27.08 2kdn s HIS 10 CO 0.11 -1.37 1.45 0.45 -0.65 0.00 0.00 174.74 174.73 2kdn s SER 11 N 3.56 6.77 0.16 9.88 0.15 -1.26 -5.01 113.70 127.96 2kdn s SER 11 Ca 0.16 2.32 0.09 0.00 0.70 0.00 0.00 55.95 59.22 2kdn s SER 11 Cb -0.20 -2.58 -0.04 0.00 -1.71 0.00 0.00 66.02 61.49 2kdn s SER 11 CO 0.04 -0.73 -0.10 -0.55 1.20 0.00 0.00 173.24 173.10 2kdn s SER 12 N 1.53 4.24 0.00 5.45 0.15 -1.26 -5.02 113.70 118.79 2kdn s SER 12 Ca 0.66 -0.55 0.00 0.00 0.70 0.00 0.00 55.95 56.77 2kdn s SER 12 Cb -0.37 -0.72 0.00 0.00 -1.71 0.00 0.00 66.02 63.22 2kdn s SER 12 CO 0.30 0.12 0.00 0.61 1.20 0.00 0.00 173.24 175.47 2kdn n GLY 13 N 0.20 -1.66 0.11 9.45 0.00 -1.26 -5.05 105.19 106.98 2kdn n GLY 13 Ca -0.12 0.58 -0.22 0.00 0.00 0.00 0.00 46.02 46.26 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 0.56 -0.57 1.61 5.12 -1.26 -4.24 116.66 117.88 2kdn n ARG 14 Ca 0.00 0.41 -0.00 0.00 -1.93 0.00 0.00 57.85 56.33 2kdn n ARG 14 Cb 0.00 -1.61 0.20 0.00 -1.16 0.00 0.00 32.46 29.89 2kdn n ARG 14 CO 0.00 0.00 0.00 -0.85 -1.93 0.00 0.00 177.63 174.85 2kdn n GLU 15 N -4.38 2.90 0.00 5.56 0.28 -1.26 -4.44 120.64 119.30 2kdn n GLU 15 Ca -0.38 -1.80 0.05 0.00 -0.16 0.00 0.00 57.16 54.88 2kdn n GLU 15 Cb 0.71 -1.88 0.32 0.00 1.43 0.00 0.00 31.44 32.02 2kdn n GLU 15 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 177.13 177.24 2kdn n ASN 16 N 0.17 0.00 -0.00 -1.84 2.04 -1.26 -0.99 115.26 113.37 2kdn n ASN 16 Ca 0.20 -0.53 0.03 0.00 -0.44 0.00 0.00 54.58 53.84 2kdn n ASN 16 Cb 0.89 0.00 -0.03 0.00 -2.53 0.00 0.00 39.78 38.11 2kdn n ASN 16 CO 0.00 0.00 0.00 0.18 -0.44 0.00 0.00 177.26 177.00 2kdn n LEU 17 N -0.89 0.23 -4.08 -4.53 4.77 -1.26 -4.98 117.00 106.26 2kdn n LEU 17 Ca 0.08 -0.45 -0.33 0.00 -0.03 0.00 0.00 56.01 55.28 2kdn n LEU 17 Cb 0.04 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 40.98 2kdn n LEU 17 CO 0.06 0.06 -0.37 -0.31 -1.33 0.00 0.00 177.39 175.50 2kdn s TYR 18 N -1.59 3.45 -0.90 -1.77 2.02 -0.17 -4.90 117.35 113.50 2kdn s TYR 18 Ca 0.02 -2.45 0.21 0.00 -0.37 0.00 0.00 57.07 54.47 2kdn s TYR 18 Cb 0.04 -2.41 -0.23 0.00 -0.40 0.00 0.00 41.96 38.95 2kdn s TYR 18 CO 0.22 -0.90 0.85 1.97 -1.57 0.00 0.00 175.55 176.12 2kdn n PHE 19 N 4.43 0.00 -3.69 2.71 -1.74 -1.26 -4.95 117.46 112.96 2kdn n PHE 19 Ca -0.07 0.00 -0.25 0.00 -0.56 0.00 0.00 57.45 56.57 2kdn n PHE 19 Cb 0.42 -0.04 0.06 0.00 1.52 0.00 0.00 39.48 41.44 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 -1.55 -6.81 -0.17 3.97 3.00 -1.26 -4.86 117.38 109.69 2kdn n GLN 20 Ca 0.03 0.74 -0.02 0.00 -0.01 0.00 0.00 57.00 57.75 2kdn n GLN 20 Cb 0.34 -5.70 0.01 0.00 0.00 0.00 0.00 30.24 24.89 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 -1.78 2.27 1.37 1.08 0.00 -1.26 -3.58 105.19 103.29 2kdn n GLY 21 Ca -0.04 -0.09 0.12 0.00 0.00 0.00 0.00 46.02 46.01 2kdn n GLY 21 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2kdn n HIS 22 N 0.58 1.00 -4.00 1.61 1.44 -1.26 -4.92 115.22 109.67 2kdn n HIS 22 Ca 0.04 -0.50 -0.23 0.00 -2.01 0.00 0.00 57.72 55.03 2kdn n HIS 22 Cb 0.56 -0.01 -0.06 0.00 0.12 0.00 0.00 29.99 30.61 2kdn n HIS 22 CO 0.00 0.00 0.00 -1.64 -2.81 0.00 0.00 176.34 171.89 2kdn s MET 23 N -1.04 2.41 0.55 -1.40 -1.94 -1.23 -5.11 119.30 111.53 2kdn s MET 23 Ca 0.49 -1.57 -0.21 0.00 -1.71 0.00 0.00 55.69 52.69 2kdn s MET 23 Cb 0.26 -2.20 -0.05 0.00 2.01 0.00 0.00 34.83 34.85 2kdn s MET 23 CO 0.33 0.03 1.29 0.00 -0.01 0.00 0.00 175.02 176.66 2kdn h ILE 25 N 1.32 0.50 -0.46 0.00 6.09 -1.99 0.18 117.51 123.15 2kdn h ILE 25 Ca -0.51 -0.05 -0.03 0.00 -1.37 0.00 0.00 64.86 62.90 2kdn h ILE 25 Cb 1.29 0.34 -0.02 0.00 0.47 0.00 0.00 36.82 38.91 2kdn h ILE 25 CO 0.57 0.03 0.16 -0.61 -3.07 0.00 0.00 178.15 175.23 2kdn h GLN 26 N 0.15 0.70 -0.43 2.19 4.15 -2.00 -2.71 115.11 117.16 2kdn h GLN 26 Ca 0.34 -0.14 -0.06 0.00 0.77 0.00 0.00 58.65 59.55 2kdn h GLN 26 Cb 0.55 -0.11 -0.02 0.00 0.21 0.00 0.00 27.48 28.11 2kdn h GLN 26 CO -0.52 0.66 0.00 0.87 -1.93 0.00 0.00 178.83 177.91 2kdn h LYS 27 N 0.60 0.69 0.48 1.69 1.79 -1.45 0.98 116.57 121.34 2kdn h LYS 27 Ca 0.15 -0.17 -0.02 0.00 -2.18 0.00 0.00 60.65 58.43 2kdn h LYS 27 Cb 0.24 -0.09 -0.00 0.00 -1.58 0.00 0.00 32.23 30.80 2kdn h LYS 27 CO -0.01 0.70 -0.28 0.28 -1.08 0.00 0.00 179.45 179.07 2kdn h VAL 28 N 0.65 0.42 -0.48 0.50 2.07 -0.43 0.94 116.25 119.92 2kdn h VAL 28 Ca 0.13 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.58 2kdn h VAL 28 Cb 0.40 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 30.58 2kdn h VAL 28 CO 0.02 0.00 0.00 0.40 0.02 0.00 0.00 177.57 178.01 2kdn h ILE 29 N -0.72 1.26 0.14 4.57 5.03 -1.35 -2.24 117.51 124.21 2kdn h ILE 29 Ca -0.06 -1.06 0.00 0.00 -0.12 0.00 0.00 64.86 63.62 2kdn h ILE 29 Cb 0.58 0.99 -0.01 0.00 -3.03 0.00 0.00 36.82 35.35 2kdn h ILE 29 CO 0.06 0.37 -0.12 -0.08 -0.68 0.00 0.00 178.15 177.70 2kdn h GLU 30 N 0.71 -0.27 -0.02 2.37 4.81 -0.67 -2.68 114.58 118.82 2kdn h GLU 30 Ca 0.14 0.02 -0.16 0.00 -0.13 0.00 0.00 59.36 59.23 2kdn h GLU 30 Cb 0.51 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.93 2kdn h GLU 30 CO 0.02 -0.18 -0.70 0.22 -0.73 0.00 0.00 179.01 177.64 2kdn h ASP 31 N -0.28 0.12 0.55 1.04 3.58 -0.81 -1.98 116.42 118.63 2kdn h ASP 31 Ca -0.00 -0.08 -0.03 0.00 0.42 0.00 0.00 57.03 57.34 2kdn h ASP 31 Cb 0.26 -0.04 0.01 0.00 1.72 0.00 0.00 39.33 41.28 2kdn h ASP 31 CO -0.02 0.78 -0.26 0.11 -2.88 0.00 0.00 179.24 176.97 2kdn h LYS 32 N 0.07 -0.71 0.00 0.28 1.79 -1.27 0.16 116.57 116.89 2kdn h LYS 32 Ca -0.01 0.05 -0.07 0.00 -2.18 0.00 0.00 60.65 58.43 2kdn h LYS 32 Cb 1.24 0.16 -0.01 0.00 -1.58 0.00 0.00 32.23 32.04 2kdn h LYS 32 CO 0.10 -0.45 -0.34 1.37 -1.08 0.00 0.00 179.45 179.05 2kdn h LEU 33 N -0.77 0.00 -0.81 2.94 8.10 -1.50 -1.40 115.31 121.87 2kdn h LEU 33 Ca -0.07 0.00 -0.12 0.00 0.11 0.00 0.00 57.88 57.80 2kdn h LEU 33 Cb 0.58 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.79 2kdn h LEU 33 CO 0.12 0.34 -0.41 0.28 -4.11 0.00 0.00 178.44 174.67 2kdn h SER 34 N 0.00 0.43 0.22 0.17 0.02 -1.13 -0.09 113.55 113.17 2kdn h SER 34 Ca -0.00 -0.18 -0.15 0.00 -0.84 0.00 0.00 61.79 60.61 2kdn h SER 34 Cb 0.78 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 63.19 2kdn h SER 34 CO 0.04 0.79 -0.59 0.28 -1.14 0.00 0.00 176.83 176.22 2kdn h SER 35 N 0.34 0.43 0.17 3.07 0.02 -0.09 0.83 113.55 118.31 2kdn h SER 35 Ca 0.03 -0.24 -0.01 0.00 -0.84 0.00 0.00 61.79 60.74 2kdn h SER 35 Cb 0.86 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.28 2kdn h SER 35 CO 0.07 0.92 -0.08 0.00 -1.14 0.00 0.00 176.83 176.60 2kdn h ALA 36 N 1.09 -0.22 0.00 3.77 0.00 -0.94 -3.36 119.26 119.60 2kdn h ALA 36 Ca -0.00 -0.22 -0.27 0.00 0.00 0.00 0.00 54.91 54.42 2kdn h ALA 36 Cb 1.11 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.94 2kdn h ALA 36 CO 0.10 -0.29 -1.60 -0.07 0.00 0.00 0.00 179.25 177.39 2kdn h LEU 37 N -0.89 0.00 -2.33 0.00 3.38 -1.15 -3.50 115.31 110.83 2kdn h LEU 37 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2kdn h LEU 37 Cb 0.51 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.26 2kdn h LEU 37 CO 0.04 0.93 -0.42 1.17 0.09 0.00 0.00 178.44 180.25 2kdn n LYS 38 N -3.05 -2.15 -3.35 1.13 4.81 0.29 -4.44 118.16 111.40 2kdn n LYS 38 Ca -0.14 1.98 -0.23 0.00 -0.87 0.00 0.00 58.31 59.04 2kdn n LYS 38 Cb 1.01 -5.49 -0.01 0.00 0.02 0.00 0.00 35.03 30.56 2kdn n LYS 38 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 2kdn s PRO 39 N -2.59 3.40 -0.06 1.64 0.04 -1.26 -4.43 135.00 131.75 2kdn s PRO 39 Ca 0.21 -0.41 -0.10 0.00 0.04 0.00 0.00 61.00 60.73 2kdn s PRO 39 Cb -0.06 -2.67 -0.30 0.00 0.04 0.00 0.00 34.50 31.52 2kdn s PRO 39 CO 0.73 0.09 0.63 1.79 0.04 0.00 0.00 177.00 180.28 2kdn h THR 40 N 0.72 0.89 -3.33 1.26 1.35 -0.59 -3.45 112.91 109.76 2kdn h THR 40 Ca -0.49 -2.50 -0.60 0.00 -0.55 0.00 0.00 66.41 62.27 2kdn h THR 40 Cb 1.23 2.73 -0.34 0.00 -1.73 0.00 0.00 68.15 70.04 2kdn h THR 40 CO 0.60 0.86 -0.85 0.12 -0.25 0.00 0.00 175.52 176.01 2kdn s PHE 41 N -2.58 2.08 -0.10 4.73 5.36 -1.03 -5.04 117.98 121.41 2kdn s PHE 41 Ca -0.17 -0.90 -0.03 0.00 -0.96 0.00 0.00 56.93 54.87 2kdn s PHE 41 Cb 0.06 -1.45 0.05 0.00 -0.34 0.00 0.00 43.02 41.33 2kdn s PHE 41 CO 0.84 -0.41 0.09 -1.17 -1.46 0.00 0.00 175.22 173.11 2kdn s LEU 42 N 0.67 0.18 -0.05 6.12 1.98 -1.26 -0.94 118.68 125.38 2kdn s LEU 42 Ca -0.13 -0.17 0.02 0.00 -2.89 0.00 0.00 54.13 50.97 2kdn s LEU 42 Cb -0.16 -0.11 0.01 0.00 0.66 0.00 0.00 46.19 46.58 2kdn s LEU 42 CO 0.03 -0.29 -0.11 -0.70 -1.89 0.00 0.00 176.35 173.40 2kdn s GLU 43 N 2.18 1.34 -0.28 1.98 2.12 -0.87 -4.99 118.70 120.18 2kdn s GLU 43 Ca 0.04 -0.36 -0.07 0.00 0.36 0.00 0.00 54.97 54.95 2kdn s GLU 43 Cb -0.14 -1.18 0.00 0.00 0.26 0.00 0.00 34.13 33.08 2kdn s GLU 43 CO -0.06 0.06 0.07 -0.51 -0.54 0.00 0.00 175.26 174.28 2kdn s LEU 44 N 0.48 3.73 0.07 2.70 1.02 -1.26 -0.42 118.68 125.00 2kdn s LEU 44 Ca -0.09 -0.64 0.03 0.00 0.02 0.00 0.00 54.13 53.45 2kdn s LEU 44 Cb -0.13 -1.87 -0.04 0.00 0.02 0.00 0.00 46.19 44.17 2kdn s LEU 44 CO 0.02 -0.16 0.05 0.68 0.02 0.00 0.00 176.35 176.96 2kdn s VAL 45 N 1.51 4.38 -0.02 -1.59 -7.23 0.11 -4.93 120.40 112.62 2kdn s VAL 45 Ca 0.03 -0.80 -0.30 0.00 -1.81 0.00 0.00 61.98 59.10 2kdn s VAL 45 Cb -0.17 -3.09 -0.07 0.00 0.56 0.00 0.00 36.38 33.62 2kdn s VAL 45 CO 0.02 0.15 1.77 -0.62 -0.31 0.00 0.00 175.10 176.11 2kdn s ASP 46 N -2.28 6.59 -0.55 4.85 -1.08 -1.26 -0.89 116.67 122.05 2kdn s ASP 46 Ca 0.27 2.40 0.04 0.00 -0.52 0.00 0.00 52.55 54.74 2kdn s ASP 46 Cb -0.12 -2.53 0.14 0.00 -1.46 0.00 0.00 42.92 38.94 2kdn s ASP 46 CO 0.20 -0.97 0.30 -0.75 0.52 0.00 0.00 175.17 174.46 2kdn s LYS 47 N 4.19 2.04 -0.45 4.34 2.20 -0.71 -4.82 119.74 126.53 2kdn s LYS 47 Ca 0.79 -2.73 -0.26 0.00 -0.36 0.00 0.00 55.97 53.41 2kdn s LYS 47 Cb -0.37 -3.31 -0.06 0.00 -1.51 0.00 0.00 37.83 32.58 2kdn s LYS 47 CO 0.34 -1.14 2.34 -1.12 -0.36 0.00 0.00 175.35 175.41 2kdn s SER 48 N -0.46 4.68 -0.03 1.43 0.01 -1.26 -4.31 113.70 113.75 2kdn s SER 48 Ca 0.18 1.19 -0.04 0.00 1.31 0.00 0.00 55.95 58.60 2kdn s SER 48 Cb -0.23 -2.50 -0.01 0.00 0.21 0.00 0.00 66.02 63.49 2kdn s SER 48 CO -0.03 -2.68 -0.08 0.00 0.41 0.00 0.00 173.24 170.87 2kdn n GLY 50 N 2.03 3.93 2.86 0.00 0.00 -1.26 -5.11 105.19 107.64 2kdn n GLY 50 Ca -0.03 -0.48 -0.07 0.00 0.00 0.00 0.00 46.02 45.44 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 0.13 -1.85 3.73 0.00 0.00 -1.26 -4.75 105.19 101.20 2kdn n GLY 52 Ca 0.06 -2.02 -0.41 0.00 0.00 0.00 0.00 46.02 43.65 2kdn n GLY 52 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2kdn s THR 53 N 0.00 4.09 -0.15 2.61 -4.23 -1.26 -4.89 115.64 111.81 2kdn s THR 53 Ca 0.00 1.77 -0.04 0.00 -1.18 0.00 0.00 61.69 62.24 2kdn s THR 53 Cb 0.00 -4.13 0.07 0.00 1.34 0.00 0.00 72.50 69.78 2kdn s THR 53 CO 0.00 0.29 0.19 -0.44 -0.54 0.00 0.00 174.62 174.12 2kdn s SER 54 N -0.04 1.18 0.05 3.99 0.01 -1.26 -1.03 113.70 116.60 2kdn s SER 54 Ca 0.49 -0.00 0.04 0.00 1.31 0.00 0.00 55.95 57.79 2kdn s SER 54 Cb -0.27 0.29 -0.02 0.00 0.21 0.00 0.00 66.02 66.23 2kdn s SER 54 CO 0.33 -0.29 -0.13 -0.36 0.41 0.00 0.00 173.24 173.20 2kdn s PHE 55 N 2.30 1.10 -0.24 2.43 0.08 -0.82 -1.74 117.98 121.09 2kdn s PHE 55 Ca 0.04 -0.39 -0.05 0.00 0.12 0.00 0.00 56.93 56.65 2kdn s PHE 55 Cb -0.14 -0.64 -0.01 0.00 -0.57 0.00 0.00 43.02 41.66 2kdn s PHE 55 CO -0.09 0.02 -0.00 0.34 -0.10 0.00 0.00 175.22 175.39 2kdn s ASP 56 N -1.34 4.59 -0.22 1.36 2.15 -0.07 -0.64 116.67 122.50 2kdn s ASP 56 Ca -0.01 -0.42 -0.06 0.00 0.43 0.00 0.00 52.55 52.48 2kdn s ASP 56 Cb -0.09 -1.79 -0.03 0.00 -0.30 0.00 0.00 42.92 40.72 2kdn s ASP 56 CO 0.01 -0.05 0.04 0.00 -0.17 0.00 0.00 175.17 175.00 2kdn s ALA 57 N 1.50 3.12 -0.41 3.66 0.00 0.47 -0.72 121.76 129.39 2kdn s ALA 57 Ca 0.05 -1.03 -0.18 0.00 0.00 0.00 0.00 51.96 50.80 2kdn s ALA 57 Cb -0.15 -1.92 0.01 0.00 0.00 0.00 0.00 23.12 21.06 2kdn s ALA 57 CO -0.01 -0.27 0.52 0.08 0.00 0.00 0.00 175.76 176.07 2kdn s VAL 58 N 1.22 4.99 -0.28 0.00 1.01 0.44 -0.41 120.40 127.37 2kdn s VAL 58 Ca 0.04 -0.02 -0.06 0.00 0.00 0.00 0.00 61.98 61.94 2kdn s VAL 58 Cb -0.14 -4.07 0.01 0.00 0.00 0.00 0.00 36.38 32.17 2kdn s VAL 58 CO 0.02 -0.42 0.06 -0.51 0.00 0.00 0.00 175.10 174.26 2kdn s ILE 59 N 2.42 3.86 -0.36 2.22 -1.16 -0.40 -2.05 121.20 125.73 2kdn s ILE 59 Ca 0.17 -0.66 -0.04 0.00 -0.51 0.00 0.00 60.65 59.61 2kdn s ILE 59 Cb -0.16 -2.96 0.07 0.00 0.61 0.00 0.00 42.46 40.02 2kdn s ILE 59 CO 0.15 0.14 0.11 -0.69 -2.81 0.00 0.00 174.94 171.84 2kdn s VAL 60 N 1.49 3.38 0.04 4.00 1.01 -0.12 -0.55 120.40 129.65 2kdn s VAL 60 Ca 0.03 -1.55 -0.07 0.00 0.00 0.00 0.00 61.98 60.38 2kdn s VAL 60 Cb -0.17 -3.07 -0.00 0.00 0.00 0.00 0.00 36.38 33.14 2kdn s VAL 60 CO 0.02 -0.35 0.14 -0.55 0.00 0.00 0.00 175.10 174.35 2kdn s SER 61 N 1.56 0.11 0.56 3.32 0.15 -0.91 0.24 113.70 118.73 2kdn s SER 61 Ca 0.01 -0.46 0.36 0.00 0.70 0.00 0.00 55.95 56.56 2kdn s SER 61 Cb -0.21 0.25 1.66 0.00 -1.71 0.00 0.00 66.02 66.01 2kdn s SER 61 CO -0.01 -0.53 2.07 0.78 1.20 0.00 0.00 173.24 176.75 2kdn h ASN 62 N 3.57 0.00 0.00 5.45 -0.26 -1.87 -3.00 115.58 119.47 2kdn h ASN 62 Ca -0.32 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.42 2kdn h ASN 62 Cb 1.19 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.45 2kdn h ASN 62 CO 0.49 0.00 0.00 -3.20 -1.06 0.00 0.00 177.43 173.66 2kdn n ASN 63 N -3.00 0.00 0.00 5.81 5.15 -1.26 -1.56 115.26 120.39 2kdn n ASN 63 Ca -0.00 -0.56 0.00 0.00 -0.60 0.00 0.00 54.58 53.41 2kdn n ASN 63 Cb 0.22 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.47 2kdn n ASN 63 CO 0.00 0.00 0.00 0.33 1.40 0.00 0.00 177.26 178.99 2kdn n PHE 64 N -0.89 0.00 0.77 1.20 7.35 -1.13 -4.71 117.46 120.04 2kdn n PHE 64 Ca 0.09 -0.16 0.10 0.00 -0.76 0.00 0.00 57.45 56.72 2kdn n PHE 64 Cb 0.04 -0.02 0.47 0.00 0.35 0.00 0.00 39.48 40.32 2kdn n PHE 64 CO 0.00 0.00 0.00 -0.85 -0.76 0.00 0.00 176.76 175.15 2kdn n GLU 65 N -0.16 0.03 0.00 -4.13 -0.00 -0.60 -1.94 120.64 113.84 2kdn n GLU 65 Ca 0.00 0.12 0.13 0.00 -0.00 0.00 0.00 57.16 57.41 2kdn n GLU 65 Cb 0.16 -1.50 0.35 0.00 -0.00 0.00 0.00 31.44 30.45 2kdn n GLU 65 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.13 176.73 2kdn n ASP 66 N -1.48 0.37 -1.55 -1.84 5.75 -1.26 -4.93 116.55 111.62 2kdn n ASP 66 Ca 0.06 -0.06 -0.16 0.00 -0.01 0.00 0.00 54.79 54.62 2kdn n ASP 66 Cb 0.25 0.06 -0.04 0.00 -1.03 0.00 0.00 41.12 40.36 2kdn n ASP 66 CO 0.00 0.00 0.00 1.17 -0.11 0.00 0.00 177.20 178.26 2kdn n LYS 67 N -1.50 -1.21 -3.12 0.11 4.81 -0.82 -4.93 118.16 111.50 2kdn n LYS 67 Ca 0.06 0.92 -0.45 0.00 -0.87 0.00 0.00 58.31 57.97 2kdn n LYS 67 Cb 0.34 -5.21 -0.02 0.00 0.02 0.00 0.00 35.03 30.15 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 -4.10 3.61 0.33 1.64 -0.14 -1.26 -4.86 119.74 114.95 2kdn s LYS 68 Ca 0.00 -2.12 0.11 0.00 -1.36 0.00 0.00 55.97 52.60 2kdn s LYS 68 Cb 0.00 -4.68 0.57 0.00 -1.68 0.00 0.00 37.83 32.04 2kdn s LYS 68 CO 0.00 -1.53 1.74 1.37 -0.76 0.00 0.00 175.35 176.17 2kdn h LEU 69 N 9.10 0.03 -0.99 3.17 8.10 -1.95 -1.08 115.31 131.69 2kdn h LEU 69 Ca 0.14 -0.01 -0.09 0.00 0.11 0.00 0.00 57.88 58.02 2kdn h LEU 69 Cb 1.03 -0.01 -0.01 0.00 -0.44 0.00 0.00 40.66 41.23 2kdn h LEU 69 CO 0.93 0.48 -0.27 0.17 -4.11 0.00 0.00 178.44 175.65 2kdn h LEU 70 N 0.03 0.41 -0.11 0.17 -0.00 -1.99 0.20 115.31 114.02 2kdn h LEU 70 Ca -0.00 -0.14 -0.23 0.00 -0.00 0.00 0.00 57.88 57.51 2kdn h LEU 70 Cb 0.82 -0.11 0.01 0.00 -0.00 0.00 0.00 40.66 41.38 2kdn h LEU 70 CO 0.06 0.68 -0.85 -0.78 -0.00 0.00 0.00 178.44 177.55 2kdn h ASP 71 N 0.36 0.93 -0.58 0.17 3.58 -1.80 -1.09 116.42 117.99 2kdn h ASP 71 Ca 0.05 -0.66 0.02 0.00 0.42 0.00 0.00 57.03 56.86 2kdn h ASP 71 Cb 0.67 -0.28 -0.03 0.00 1.72 0.00 0.00 39.33 41.40 2kdn h ASP 71 CO 0.05 1.45 0.36 -0.09 -2.88 0.00 0.00 179.24 178.13 2kdn h ARG 72 N 0.48 0.71 0.36 0.28 1.12 -1.01 -1.53 114.38 114.78 2kdn h ARG 72 Ca -0.08 -0.04 -0.01 0.00 -1.11 0.00 0.00 59.98 58.74 2kdn h ARG 72 Cb 1.49 -0.16 -0.01 0.00 -0.01 0.00 0.00 29.97 31.27 2kdn h ARG 72 CO 0.17 0.47 -0.28 1.25 -3.11 0.00 0.00 179.97 178.47 2kdn h HIS 73 N 0.73 -0.73 -0.78 2.20 2.76 -0.49 -1.68 115.15 117.15 2kdn h HIS 73 Ca 0.23 -0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.38 2kdn h HIS 73 Cb -0.02 0.27 -0.04 0.00 1.55 0.00 0.00 27.41 29.18 2kdn h HIS 73 CO -0.05 -0.41 0.43 0.07 -1.30 0.00 0.00 177.93 176.67 2kdn h ARG 74 N -0.64 1.08 0.07 5.26 0.11 -1.04 -1.08 114.38 118.14 2kdn h ARG 74 Ca -0.03 -0.12 -0.00 0.00 0.10 0.00 0.00 59.98 59.92 2kdn h ARG 74 Cb 0.55 -0.21 0.00 0.00 1.11 0.00 0.00 29.97 31.42 2kdn h ARG 74 CO -0.01 0.79 -0.03 -0.07 0.10 0.00 0.00 179.97 180.75 2kdn h LEU 75 N 1.07 -0.08 -0.54 0.08 3.38 -1.23 -1.79 115.31 116.21 2kdn h LEU 75 Ca 0.27 -0.19 0.06 0.00 0.09 0.00 0.00 57.88 58.11 2kdn h LEU 75 Cb 0.02 0.02 -0.05 0.00 0.09 0.00 0.00 40.66 40.74 2kdn h LEU 75 CO -0.05 0.14 0.25 0.58 0.09 0.00 0.00 178.44 179.46 2kdn h VAL 76 N -0.30 0.91 -0.09 1.22 2.07 -1.10 -1.52 116.25 117.43 2kdn h VAL 76 Ca -0.01 -0.16 -0.05 0.00 0.82 0.00 0.00 66.70 67.30 2kdn h VAL 76 Cb 0.26 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 2kdn h VAL 76 CO 0.02 0.09 -0.16 0.78 0.02 0.00 0.00 177.57 178.31 2kdn h ASN 77 N 0.48 0.14 -0.04 0.57 -0.26 -1.10 0.13 115.58 115.50 2kdn h ASN 77 Ca 0.25 -0.03 -0.01 0.00 -0.56 0.00 0.00 56.30 55.95 2kdn h ASN 77 Cb 0.20 -0.04 -0.00 0.00 -1.06 0.00 0.00 38.32 37.42 2kdn h ASN 77 CO -0.20 0.32 0.00 0.74 -1.06 0.00 0.00 177.43 177.24 2kdn h THR 78 N 0.14 1.24 0.09 2.81 2.02 -0.37 -0.71 112.91 118.14 2kdn h THR 78 Ca 0.03 -0.74 -0.13 0.00 0.77 0.00 0.00 66.41 66.34 2kdn h THR 78 Cb 0.38 1.66 0.01 0.00 -1.74 0.00 0.00 68.15 68.46 2kdn h THR 78 CO 0.02 0.20 -0.57 0.40 0.37 0.00 0.00 175.52 175.94 2kdn h ILE 79 N -0.21 1.58 0.00 3.11 5.03 -1.35 -3.30 117.51 122.37 2kdn h ILE 79 Ca 0.01 -2.43 0.00 0.00 -0.12 0.00 0.00 64.86 62.33 2kdn h ILE 79 Cb 0.32 3.18 0.00 0.00 -3.03 0.00 0.00 36.82 37.29 2kdn h ILE 79 CO 0.00 0.67 0.00 0.18 -0.68 0.00 0.00 178.15 178.33 2kdn n LEU 80 N -4.27 0.00 0.02 1.44 4.32 0.44 -2.48 117.00 116.47 2kdn n LEU 80 Ca -0.12 0.27 -0.10 0.00 -0.02 0.00 0.00 56.01 56.04 2kdn n LEU 80 Cb 0.71 -0.27 -0.06 0.00 -1.62 0.00 0.00 43.42 42.18 2kdn n LEU 80 CO 0.45 -0.09 0.51 0.50 -1.22 0.00 0.00 177.39 177.53 2kdn h LYS 81 N 0.00 -0.38 -0.04 3.23 1.63 -1.19 0.12 116.57 119.94 2kdn h LYS 81 Ca 0.00 0.03 -0.23 0.00 -0.85 0.00 0.00 60.65 59.59 2kdn h LYS 81 Cb 0.18 0.09 0.01 0.00 -0.60 0.00 0.00 32.23 31.90 2kdn h LYS 81 CO 0.00 -0.25 -0.91 1.49 -3.45 0.00 0.00 179.45 176.33 2kdn h GLU 82 N -0.39 0.56 -0.01 1.90 4.57 -1.78 -3.37 114.58 116.06 2kdn h GLU 82 Ca 0.01 -0.55 0.03 0.00 -1.18 0.00 0.00 59.36 57.67 2kdn h GLU 82 Cb 0.43 0.15 -0.05 0.00 -0.16 0.00 0.00 28.75 29.12 2kdn h GLU 82 CO -0.23 1.18 -0.31 1.49 -1.18 0.00 0.00 179.01 179.95 2kdn h GLU 83 N 0.34 -0.44 -0.96 1.92 4.57 -1.32 -2.45 114.58 116.24 2kdn h GLU 83 Ca -0.08 0.03 0.27 0.00 -1.18 0.00 0.00 59.36 58.40 2kdn h GLU 83 Cb 1.54 0.10 -0.04 0.00 -0.16 0.00 0.00 28.75 30.19 2kdn h GLU 83 CO 0.17 -0.29 0.69 -0.07 -1.18 0.00 0.00 179.01 178.32 2kdn h LEU 84 N -0.46 0.04 -1.91 1.64 3.38 -0.91 -2.18 115.31 114.91 2kdn h LEU 84 Ca 0.06 0.01 0.19 0.00 0.09 0.00 0.00 57.88 58.23 2kdn h LEU 84 Cb 0.55 -0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.27 2kdn h LEU 84 CO -0.27 0.01 0.58 1.56 0.09 0.00 0.00 178.44 180.42 2kdn h GLN 85 N 0.04 0.00 0.00 1.13 1.08 -1.63 0.42 115.11 116.15 2kdn h GLN 85 Ca 0.46 0.00 -0.09 0.00 -1.45 0.00 0.00 58.65 57.57 2kdn h GLN 85 Cb 1.79 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 29.21 2kdn h GLN 85 CO -0.03 0.00 -0.43 -0.91 -0.95 0.00 0.00 178.83 176.52 2kdn h ASN 86 N 0.00 0.00 -2.47 1.46 2.35 -1.59 -3.45 115.58 111.87 2kdn h ASN 86 Ca 0.31 0.00 -0.53 0.00 -0.55 0.00 0.00 56.30 55.53 2kdn h ASN 86 Cb 1.47 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 39.80 2kdn h ASN 86 CO -0.00 0.43 -0.51 -0.63 -1.65 0.00 0.00 177.43 175.06 2kdn s ILE 87 N -3.15 4.78 -0.22 2.81 1.01 0.15 -4.76 121.20 121.81 2kdn s ILE 87 Ca 0.03 -1.06 0.06 0.00 0.00 0.00 0.00 60.65 59.68 2kdn s ILE 87 Cb 0.08 -3.50 -0.21 0.00 0.01 0.00 0.00 42.46 38.85 2kdn s ILE 87 CO 0.72 -0.19 -0.04 1.57 0.00 0.00 0.00 174.94 177.00 2kdn n HIS 88 N -0.74 0.19 -3.38 3.97 -0.00 -0.19 -4.87 115.22 110.19 2kdn n HIS 88 Ca -0.08 0.05 -0.17 0.00 -0.00 0.00 0.00 57.72 57.52 2kdn n HIS 88 Cb 0.56 -1.03 -0.09 0.00 -0.00 0.00 0.00 29.99 29.43 2kdn n HIS 88 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2kdn s ALA 89 N -2.52 -0.46 -0.15 1.57 0.00 -0.94 -5.03 121.76 114.24 2kdn s ALA 89 Ca -0.25 -0.53 -0.07 0.00 0.00 0.00 0.00 51.96 51.11 2kdn s ALA 89 Cb 0.08 -1.89 -0.04 0.00 0.00 0.00 0.00 23.12 21.27 2kdn s ALA 89 CO 0.69 -1.85 0.12 0.12 0.00 0.00 0.00 175.76 174.83 2kdn s PHE 90 N 2.06 3.47 0.13 0.00 5.36 -1.26 -1.94 117.98 125.79 2kdn s PHE 90 Ca 0.12 0.39 0.08 0.00 -0.96 0.00 0.00 56.93 56.56 2kdn s PHE 90 Cb -0.14 -2.00 -0.04 0.00 -0.34 0.00 0.00 43.02 40.50 2kdn s PHE 90 CO -0.23 0.52 -0.19 0.45 -1.46 0.00 0.00 175.22 174.31 2kdn s SER 91 N -0.47 2.50 -0.06 6.13 0.15 0.19 -4.97 113.70 117.16 2kdn s SER 91 Ca 0.12 -0.76 -0.03 0.00 0.70 0.00 0.00 55.95 55.97 2kdn s SER 91 Cb -0.12 -0.13 0.03 0.00 -1.71 0.00 0.00 66.02 64.08 2kdn s SER 91 CO 0.02 -0.00 0.13 0.00 1.20 0.00 0.00 173.24 174.58 2kdn s MET 92 N -2.32 0.11 -0.29 5.44 0.23 -1.26 -0.40 119.30 120.82 2kdn s MET 92 Ca 0.10 0.27 0.01 0.00 -1.03 0.00 0.00 55.69 55.04 2kdn s MET 92 Cb -0.08 -0.06 0.06 0.00 -1.53 0.00 0.00 34.83 33.22 2kdn s MET 92 CO 0.05 -0.10 -0.05 0.15 -2.03 0.00 0.00 175.02 173.05 2kdn s LYS 93 N 0.65 2.29 -0.12 3.16 3.01 0.45 -4.94 119.74 124.24 2kdn s LYS 93 Ca -0.05 -1.35 -0.17 0.00 -1.01 0.00 0.00 55.97 53.39 2kdn s LYS 93 Cb -0.07 -3.05 -0.04 0.00 -1.01 0.00 0.00 37.83 33.66 2kdn s LYS 93 CO -0.03 -0.62 0.44 0.00 0.51 0.00 0.00 175.35 175.64 2kdn s HIS 95 N 0.49 0.73 0.23 0.00 3.76 0.29 -4.98 115.29 115.81 2kdn s HIS 95 Ca 0.24 -1.06 0.05 0.00 -0.15 0.00 0.00 55.06 54.14 2kdn s HIS 95 Cb -0.15 -0.28 -0.03 0.00 1.11 0.00 0.00 32.58 33.23 2kdn s HIS 95 CO 0.09 -0.67 0.30 0.95 -0.85 0.00 0.00 174.74 174.56 2kdn s THR 96 N -4.05 5.04 0.53 1.30 -4.23 -1.26 -2.13 115.64 110.84 2kdn s THR 96 Ca 0.25 -1.05 0.20 0.00 -1.18 0.00 0.00 61.69 59.91 2kdn s THR 96 Cb 0.05 -3.71 0.31 0.00 1.34 0.00 0.00 72.50 70.49 2kdn s THR 96 CO 0.05 -0.30 2.12 -0.65 -0.54 0.00 0.00 174.62 175.30 2kdn h PRO 97 N 1.42 0.00 -0.20 3.99 0.11 -1.86 0.27 132.00 135.73 2kdn h PRO 97 Ca -0.51 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.54 2kdn h PRO 97 Cb 1.23 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 2kdn h PRO 97 CO 0.62 0.00 -0.13 1.25 -0.21 0.00 0.00 178.00 179.53 2kdn h LEU 98 N 0.00 0.46 -0.66 2.35 7.12 -1.95 0.32 115.31 122.95 2kdn h LEU 98 Ca 0.06 -0.43 -0.02 0.00 0.13 0.00 0.00 57.88 57.62 2kdn h LEU 98 Cb 0.25 -0.13 -0.03 0.00 -0.53 0.00 0.00 40.66 40.22 2kdn h LEU 98 CO -0.00 0.80 0.34 -0.08 -0.13 0.00 0.00 178.44 179.37 2kdn h GLU 99 N 0.13 0.93 -0.18 1.25 4.57 -1.70 -1.95 114.58 117.64 2kdn h GLU 99 Ca 0.04 -0.12 -0.05 0.00 -1.18 0.00 0.00 59.36 58.04 2kdn h GLU 99 Cb 0.64 -0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 29.04 2kdn h GLU 99 CO 0.04 0.72 -0.13 -0.92 -1.18 0.00 0.00 179.01 177.54 2kdn h TYR 100 N 0.91 0.31 -0.68 0.92 3.20 -0.91 -2.76 116.97 117.96 2kdn h TYR 100 Ca 0.23 -0.04 0.02 0.00 3.14 0.00 0.00 58.73 62.08 2kdn h TYR 100 Cb 0.08 -0.09 -0.04 0.00 1.54 0.00 0.00 36.73 38.22 2kdn h TYR 100 CO -0.00 0.42 0.45 0.22 -1.64 0.00 0.00 178.16 177.61 2kdn h ASP 101 N 0.27 0.74 -0.42 -2.11 1.82 -0.12 -1.11 116.42 115.49 2kdn h ASP 101 Ca 0.05 -0.01 -0.03 0.00 -0.39 0.00 0.00 57.03 56.65 2kdn h ASP 101 Cb 0.41 -0.18 -0.02 0.00 0.68 0.00 0.00 39.33 40.22 2kdn h ASP 101 CO 0.02 0.52 0.15 0.11 -1.61 0.00 0.00 179.24 178.43 2kdn h LYS 102 N 0.87 0.63 0.13 0.28 6.56 -1.34 -1.92 116.57 121.78 2kdn h LYS 102 Ca 0.26 -0.13 -0.01 0.00 -1.06 0.00 0.00 60.65 59.72 2kdn h LYS 102 Cb -0.02 -0.10 0.00 0.00 -0.57 0.00 0.00 32.23 31.54 2kdn h LYS 102 CO -0.06 0.61 -0.06 -0.07 -2.06 0.00 0.00 179.45 177.80 2kdn h LEU 103 N 0.53 -0.15 -1.52 2.94 3.38 -1.29 -2.66 115.31 116.54 2kdn h LEU 103 Ca 0.14 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2kdn h LEU 103 Cb 0.23 0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.02 2kdn h LEU 103 CO -0.01 0.04 0.00 0.07 0.09 0.00 0.00 178.44 178.63 2kdn h LYS 104 N -0.33 0.00 0.00 1.13 2.10 -1.27 0.14 116.57 118.34 2kdn h LYS 104 Ca -0.02 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.62 2kdn h LYS 104 Cb 0.26 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.59 2kdn h LYS 104 CO 0.03 0.00 -0.07 1.03 -2.00 0.00 0.00 179.45 178.44 2kdn h SER 105 N 0.00 0.00 0.00 7.07 0.87 -0.96 -3.26 113.55 117.27 2kdn h SER 105 Ca 0.00 0.00 -0.04 0.00 -1.23 0.00 0.00 61.79 60.52 2kdn h SER 105 Cb 0.39 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.34 2kdn h SER 105 CO 0.00 0.07 -1.17 2.29 -0.53 0.00 0.00 176.83 177.49 2kdn n LYS 106 N -3.92 0.26 0.00 2.24 0.00 -0.99 -5.06 118.16 110.68 2kdn n LYS 106 Ca -0.03 0.02 0.00 0.00 -0.00 0.00 0.00 58.31 58.30 2kdn n LYS 106 Cb 0.16 -1.06 0.00 0.00 -0.00 0.00 0.00 35.03 34.13 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 3.33 0.70 0.55 2.58 0.00 0.46 -5.15 105.19 107.66 2kdn n GLY 107 Ca -0.05 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.11 2kdn n GLY 107 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76