#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kzq s ASN 2 N 0.00 6.16 -0.07 6.12 0.01 -1.26 -4.99 114.94 120.91 3kzq s ASN 2 Ca 0.00 -0.88 0.03 0.00 -0.71 0.00 0.00 52.86 51.31 3kzq s ASN 2 Cb 0.00 -2.20 0.01 0.00 0.41 0.00 0.00 41.25 39.47 3kzq s ASN 2 CO 0.00 -0.57 -0.16 -0.63 -1.51 0.00 0.00 177.10 174.23 3kzq s ILE 3 N 1.94 1.39 0.05 0.60 1.01 -1.26 -0.80 121.20 124.13 3kzq s ILE 3 Ca 0.09 -0.65 0.03 0.00 0.00 0.00 0.00 60.65 60.12 3kzq s ILE 3 Cb -0.19 -1.23 -0.03 0.00 0.01 0.00 0.00 42.46 41.02 3kzq s ILE 3 CO 0.11 0.41 -0.09 -0.54 0.00 0.00 0.00 174.94 174.83 3kzq s LYS 4 N 0.43 0.60 -0.26 2.79 1.02 -0.67 -1.93 119.74 121.73 3kzq s LYS 4 Ca -0.13 -0.83 -0.03 0.00 0.02 0.00 0.00 55.97 55.00 3kzq s LYS 4 Cb -0.15 -0.39 0.02 0.00 -0.52 0.00 0.00 37.83 36.79 3kzq s LYS 4 CO 0.04 0.07 -0.03 -1.17 -0.92 0.00 0.00 175.35 173.35 3kzq s LEU 5 N -1.71 3.37 -0.13 3.17 2.96 -0.21 -0.07 118.68 126.07 3kzq s LEU 5 Ca -0.07 -0.85 -0.13 0.00 -0.22 0.00 0.00 54.13 52.86 3kzq s LEU 5 Cb -0.09 -1.71 -0.05 0.00 0.50 0.00 0.00 46.19 44.84 3kzq s LEU 5 CO 0.00 -0.15 0.29 -0.31 -1.32 0.00 0.00 176.35 174.87 3kzq s TYR 6 N 1.36 3.53 -0.32 5.38 1.51 0.44 -1.01 117.35 128.23 3kzq s TYR 6 Ca 0.00 0.65 -0.05 0.00 -1.01 0.00 0.00 57.07 56.67 3kzq s TYR 6 Cb -0.17 -2.27 0.04 0.00 -0.11 0.00 0.00 41.96 39.45 3kzq s TYR 6 CO -0.03 0.38 0.06 -0.47 -1.11 0.00 0.00 175.55 174.39 3kzq s TYR 7 N -0.02 3.23 -0.26 2.71 5.04 0.27 -1.28 117.35 127.04 3kzq s TYR 7 Ca 0.17 -1.50 -0.11 0.00 -2.44 0.00 0.00 57.07 53.20 3kzq s TYR 7 Cb -0.13 -2.21 -0.05 0.00 0.35 0.00 0.00 41.96 39.91 3kzq s TYR 7 CO 0.05 -0.73 0.19 0.08 -1.34 0.00 0.00 175.55 173.80 3kzq s VAL 8 N 1.37 5.32 0.36 3.14 1.01 0.28 -0.28 120.40 131.60 3kzq s VAL 8 Ca -0.02 0.20 -0.02 0.00 0.00 0.00 0.00 61.98 62.14 3kzq s VAL 8 Cb -0.19 -3.53 0.00 0.00 0.00 0.00 0.00 36.38 32.67 3kzq s VAL 8 CO 0.01 0.28 0.49 -1.38 0.00 0.00 0.00 175.10 174.50 3kzq s HIS 9 N 1.48 1.12 -0.07 5.22 -3.43 -0.15 -1.40 115.29 118.06 3kzq s HIS 9 Ca 0.08 -1.34 -0.06 0.00 -0.80 0.00 0.00 55.06 52.94 3kzq s HIS 9 Cb -0.15 -0.09 0.02 0.00 -1.43 0.00 0.00 32.58 30.94 3kzq s HIS 9 CO 0.08 -1.17 0.19 0.34 -2.00 0.00 0.00 174.74 172.19 3kzq s ASP 10 N -3.26 -0.20 0.53 7.38 -1.08 -1.26 -0.86 116.67 117.92 3kzq s ASP 10 Ca 0.31 0.39 0.21 0.00 -0.52 0.00 0.00 52.55 52.93 3kzq s ASP 10 Cb -0.01 0.37 1.35 0.00 -1.46 0.00 0.00 42.92 43.17 3kzq s ASP 10 CO 0.21 -0.09 2.08 -0.65 0.52 0.00 0.00 175.17 177.24 3kzq h PRO 11 N 6.15 0.00 -0.67 4.34 0.11 -1.91 -1.64 132.00 138.39 3kzq h PRO 11 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 3kzq h PRO 11 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3kzq h PRO 11 CO 0.39 0.00 0.00 -1.33 -0.21 0.00 0.00 178.00 176.85 3kzq n MET 12 N -4.44 3.69 -3.03 1.05 2.81 -1.26 -4.53 117.12 111.41 3kzq n MET 12 Ca 0.03 -2.90 -0.41 0.00 -1.81 0.00 0.00 57.70 52.62 3kzq n MET 12 Cb 0.35 -1.88 -0.05 0.00 -0.71 0.00 0.00 33.22 30.92 3kzq n MET 12 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3kzq h SER 14 N 7.44 0.19 0.06 0.00 0.02 -1.90 -2.42 113.55 116.94 3kzq h SER 14 Ca -0.30 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.57 3kzq h SER 14 Cb 1.14 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.62 3kzq h SER 14 CO 0.80 0.14 -0.23 -0.50 -1.14 0.00 0.00 176.83 175.90 3kzq h TRP 15 N 0.25 0.33 -0.45 3.45 4.06 -1.93 0.63 115.95 122.29 3kzq h TRP 15 Ca 0.08 -0.06 -0.08 0.00 2.06 0.00 0.00 58.89 60.90 3kzq h TRP 15 Cb -0.00 -0.09 -0.02 0.00 -1.00 0.00 0.00 29.16 28.05 3kzq h TRP 15 CO -0.08 0.52 -0.04 0.00 -3.56 0.00 0.00 178.44 175.28 3kzq h TRP 17 N 0.70 0.77 -0.84 0.00 -0.00 -1.09 -2.07 115.95 113.42 3kzq h TRP 17 Ca 0.13 -0.12 0.12 0.00 -0.00 0.00 0.00 58.89 59.03 3kzq h TRP 17 Cb 0.48 -0.21 -0.06 0.00 -0.00 0.00 0.00 29.16 29.37 3kzq h TRP 17 CO 0.02 0.75 0.54 0.78 -0.00 0.00 0.00 178.44 180.54 3kzq h GLY 18 N 0.57 1.09 1.84 2.65 0.00 -0.50 -2.50 103.07 106.23 3kzq h GLY 18 Ca 0.13 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 47.17 3kzq h GLY 18 CO 0.01 0.13 -0.13 -1.82 0.00 0.00 0.00 176.54 174.73 3kzq h TYR 19 N 0.69 0.00 -0.58 5.60 3.20 -0.29 -3.40 116.97 122.19 3kzq h TYR 19 Ca 0.41 0.00 0.10 0.00 3.14 0.00 0.00 58.73 62.38 3kzq h TYR 19 Cb 0.61 0.00 -0.11 0.00 1.54 0.00 0.00 36.73 38.77 3kzq h TYR 19 CO -0.00 0.00 -0.33 -0.22 -1.64 0.00 0.00 178.16 175.96 3kzq h LYS 20 N 0.00 -0.16 -0.87 1.82 3.64 -0.91 -0.41 116.57 119.68 3kzq h LYS 20 Ca 0.00 0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.44 3kzq h LYS 20 Cb 0.82 0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 32.62 3kzq h LYS 20 CO 0.00 -0.11 0.57 -1.35 -2.27 0.00 0.00 179.45 176.29 3kzq h PRO 21 N -0.17 1.01 -0.08 1.90 0.11 -1.81 -1.40 132.00 131.56 3kzq h PRO 21 Ca 0.23 -0.06 -0.09 0.00 0.11 0.00 0.00 66.00 66.19 3kzq h PRO 21 Cb 0.55 -0.23 0.00 0.00 0.11 0.00 0.00 31.00 31.43 3kzq h PRO 21 CO -0.67 0.67 -0.29 1.15 -0.21 0.00 0.00 178.00 178.64 3kzq h THR 22 N 1.04 1.41 -0.30 -1.15 2.02 -1.38 -2.40 112.91 112.15 3kzq h THR 22 Ca 0.36 -1.66 -0.07 0.00 0.77 0.00 0.00 66.41 65.80 3kzq h THR 22 Cb 0.10 2.26 -0.02 0.00 -1.74 0.00 0.00 68.15 68.75 3kzq h THR 22 CO -0.12 0.48 -0.12 -0.29 0.37 0.00 0.00 175.52 175.84 3kzq h ILE 23 N -0.13 1.23 -0.72 3.11 6.09 -1.12 0.92 117.51 126.89 3kzq h ILE 23 Ca -0.01 -1.01 -0.06 0.00 -1.37 0.00 0.00 64.86 62.40 3kzq h ILE 23 Cb 0.93 1.14 -0.03 0.00 0.47 0.00 0.00 36.82 39.32 3kzq h ILE 23 CO 0.06 0.33 0.20 -0.33 -3.07 0.00 0.00 178.15 175.35 3kzq h GLU 24 N 0.47 1.13 -0.17 2.19 5.08 -1.29 -0.58 114.58 121.41 3kzq h GLU 24 Ca 0.09 -0.25 -0.15 0.00 -1.00 0.00 0.00 59.36 58.05 3kzq h GLU 24 Cb 0.49 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 3kzq h GLU 24 CO 0.03 0.98 -0.51 -0.22 -1.00 0.00 0.00 179.01 178.28 3kzq h LYS 25 N 1.08 0.48 -0.63 2.33 3.64 -0.86 -2.37 116.57 120.23 3kzq h LYS 25 Ca 0.23 -0.28 -0.06 0.00 -1.27 0.00 0.00 60.65 59.26 3kzq h LYS 25 Cb 0.34 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.16 3kzq h LYS 25 CO -0.00 0.88 0.14 1.25 -2.27 0.00 0.00 179.45 179.45 3kzq h LEU 26 N 0.38 0.96 -1.05 5.20 5.85 -0.63 -0.35 115.31 125.66 3kzq h LEU 26 Ca 0.01 -0.24 -0.03 0.00 0.84 0.00 0.00 57.88 58.46 3kzq h LEU 26 Cb 1.03 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.77 3kzq h LEU 26 CO 0.09 0.95 0.27 0.50 -0.34 0.00 0.00 178.44 179.92 3kzq h LYS 27 N 0.93 0.95 -0.04 1.25 3.64 -0.98 -1.53 116.57 120.79 3kzq h LYS 27 Ca 0.20 -0.15 -0.14 0.00 -1.27 0.00 0.00 60.65 59.28 3kzq h LYS 27 Cb 0.38 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.01 3kzq h LYS 27 CO 0.00 0.77 -0.63 1.96 -2.27 0.00 0.00 179.45 179.28 3kzq h GLN 28 N 0.93 0.14 -0.00 1.90 4.20 -0.93 -3.15 115.11 118.20 3kzq h GLN 28 Ca 0.22 -0.10 0.00 0.00 0.06 0.00 0.00 58.65 58.83 3kzq h GLN 28 Cb 0.16 0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.96 3kzq h GLN 28 CO -0.02 0.73 -0.21 1.04 -0.67 0.00 0.00 178.83 179.69 3kzq n GLN 29 N -3.83 0.39 -2.48 1.46 6.02 -0.19 -4.89 117.38 113.86 3kzq n GLN 29 Ca -0.02 -0.16 -0.42 0.00 -0.01 0.00 0.00 57.00 56.40 3kzq n GLN 29 Cb 0.63 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 30.36 3kzq n GLN 29 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 3kzq s LEU 30 N -2.72 4.42 0.59 1.08 2.96 -0.66 -4.98 118.68 119.37 3kzq s LEU 30 Ca 0.21 2.02 -0.20 0.00 -0.22 0.00 0.00 54.13 55.94 3kzq s LEU 30 Cb 0.19 -3.59 -0.03 0.00 0.50 0.00 0.00 46.19 43.26 3kzq s LEU 30 CO 0.55 -0.35 1.34 -2.84 -1.32 0.00 0.00 176.35 173.73 3kzq s PRO 31 N 0.45 2.86 0.63 0.98 0.02 -1.26 -4.90 135.00 133.77 3kzq s PRO 31 Ca 0.54 2.17 0.38 0.00 0.02 0.00 0.00 61.00 64.12 3kzq s PRO 31 Cb -0.29 -2.07 2.13 0.00 0.02 0.00 0.00 34.50 34.29 3kzq s PRO 31 CO 0.32 -1.39 2.30 0.78 -0.33 0.00 0.00 177.00 178.68 3kzq h GLY 32 N 1.03 0.00 2.00 0.52 0.00 -1.99 -0.65 103.07 103.99 3kzq h GLY 32 Ca -0.51 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 46.82 3kzq h GLY 32 CO 0.55 0.00 -0.00 -0.39 0.00 0.00 0.00 176.54 176.70 3kzq h VAL 33 N 0.00 0.03 -3.68 4.60 -1.51 -1.96 -3.39 116.25 110.34 3kzq h VAL 33 Ca -0.00 -0.12 -0.66 0.00 -1.23 0.00 0.00 66.70 64.69 3kzq h VAL 33 Cb 0.04 1.11 -0.17 0.00 -2.13 0.00 0.00 31.29 30.14 3kzq h VAL 33 CO 0.00 0.00 -0.31 -0.63 -1.23 0.00 0.00 177.57 175.41 3kzq s ILE 34 N -4.07 5.18 -0.04 7.19 1.01 -0.25 -4.32 121.20 125.90 3kzq s ILE 34 Ca -0.04 0.05 -0.29 0.00 0.00 0.00 0.00 60.65 60.37 3kzq s ILE 34 Cb 0.12 -3.80 -0.03 0.00 0.01 0.00 0.00 42.46 38.77 3kzq s ILE 34 CO 0.45 -0.07 0.95 -1.10 0.00 0.00 0.00 174.94 175.17 3kzq s GLN 35 N 1.99 4.50 0.06 2.79 -0.21 -0.81 -4.85 119.66 123.12 3kzq s GLN 35 Ca 0.11 1.34 -0.26 0.00 0.02 0.00 0.00 55.36 56.56 3kzq s GLN 35 Cb -0.17 -3.49 -0.05 0.00 1.00 0.00 0.00 33.01 30.30 3kzq s GLN 35 CO 0.11 -0.12 0.83 0.12 -2.12 0.00 0.00 175.29 174.11 3kzq s PHE 36 N 1.31 3.75 -0.04 0.91 5.36 -1.26 -1.04 117.98 126.96 3kzq s PHE 36 Ca 0.49 1.56 -0.00 0.00 -0.96 0.00 0.00 56.93 58.02 3kzq s PHE 36 Cb -0.20 -2.90 0.03 0.00 -0.34 0.00 0.00 43.02 39.61 3kzq s PHE 36 CO 0.24 0.24 0.00 -2.00 -1.46 0.00 0.00 175.22 172.24 3kzq s GLU 37 N 0.03 0.37 0.21 10.12 2.12 -0.18 -4.95 118.70 126.42 3kzq s GLU 37 Ca 0.41 0.10 -0.26 0.00 0.36 0.00 0.00 54.97 55.58 3kzq s GLU 37 Cb -0.21 -0.62 -0.08 0.00 0.26 0.00 0.00 34.13 33.47 3kzq s GLU 37 CO 0.25 -0.19 0.84 0.71 -0.54 0.00 0.00 175.26 176.33 3kzq s TYR 38 N 1.34 3.89 -0.08 5.30 2.02 -1.26 -0.57 117.35 127.99 3kzq s TYR 38 Ca -0.05 1.71 0.02 0.00 -0.37 0.00 0.00 57.07 58.38 3kzq s TYR 38 Cb -0.13 -2.83 0.01 0.00 -0.40 0.00 0.00 41.96 38.61 3kzq s TYR 38 CO -0.02 0.45 -0.12 0.08 -1.57 0.00 0.00 175.55 174.37 3kzq s VAL 39 N -1.24 1.17 -0.01 0.71 1.01 0.62 -4.89 120.40 117.77 3kzq s VAL 39 Ca 0.39 -0.48 -0.26 0.00 0.00 0.00 0.00 61.98 61.63 3kzq s VAL 39 Cb -0.23 -1.08 -0.04 0.00 0.00 0.00 0.00 36.38 35.02 3kzq s VAL 39 CO 0.27 0.37 0.81 0.68 0.00 0.00 0.00 175.10 177.23 3kzq s VAL 40 N 0.81 4.88 -0.18 2.92 -7.23 -1.26 -0.97 120.40 119.37 3kzq s VAL 40 Ca -0.12 1.70 0.20 0.00 -1.81 0.00 0.00 61.98 61.95 3kzq s VAL 40 Cb -0.15 -4.15 -0.08 0.00 0.56 0.00 0.00 36.38 32.55 3kzq s VAL 40 CO 0.02 0.26 0.91 0.61 -0.31 0.00 0.00 175.10 176.59 3kzq n GLY 41 N 2.80 -1.32 1.60 2.32 0.00 -0.04 -3.90 105.19 106.65 3kzq n GLY 41 Ca 0.01 -0.20 -0.00 0.00 0.00 0.00 0.00 46.02 45.83 3kzq n GLY 41 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kzq n GLY 42 N 1.28 -0.40 0.17 -0.02 0.00 -1.26 -4.83 105.19 100.14 3kzq n GLY 42 Ca -0.05 -0.14 -0.07 0.00 0.00 0.00 0.00 46.02 45.76 3kzq n GLY 42 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3kzq h LEU 43 N 0.04 0.37 -7.63 0.99 5.85 -1.92 -3.43 115.31 109.58 3kzq h LEU 43 Ca 0.00 0.01 -0.24 0.00 0.84 0.00 0.00 57.88 58.48 3kzq h LEU 43 Cb 0.91 -0.07 -0.29 0.00 0.37 0.00 0.00 40.66 41.58 3kzq h LEU 43 CO 0.02 0.27 -0.68 0.00 -0.34 0.00 0.00 178.44 177.71 3kzq s ALA 44 N -6.16 -0.07 0.98 1.25 0.00 -1.26 -4.96 121.76 111.54 3kzq s ALA 44 Ca -0.13 0.21 -0.16 0.00 0.00 0.00 0.00 51.96 51.88 3kzq s ALA 44 Cb 0.11 -0.14 0.20 0.00 0.00 0.00 0.00 23.12 23.29 3kzq s ALA 44 CO 0.72 -0.05 1.28 -1.25 0.00 0.00 0.00 175.76 176.46 3kzq s PRO 45 N 0.37 0.48 0.05 0.00 0.04 -1.26 -0.54 135.00 134.14 3kzq s PRO 45 Ca -0.03 -0.31 -0.34 0.00 0.04 0.00 0.00 61.00 60.37 3kzq s PRO 45 Cb -0.04 -1.82 -0.12 0.00 0.04 0.00 0.00 34.50 32.55 3kzq s PRO 45 CO -0.01 -2.54 1.75 -0.25 0.04 0.00 0.00 177.00 175.99 3kzq n ASP 46 N -3.88 3.37 -3.50 6.66 8.00 -1.26 -4.35 116.55 121.60 3kzq n ASP 46 Ca 0.14 1.02 -0.14 0.00 0.71 0.00 0.00 54.79 56.52 3kzq n ASP 46 Cb 0.60 -1.42 -0.04 0.00 -0.02 0.00 0.00 41.12 40.24 3kzq n ASP 46 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 3kzq s THR 47 N 2.55 0.01 -1.71 -3.53 -1.32 -1.26 -5.05 115.64 105.33 3kzq s THR 47 Ca 0.85 -0.09 0.14 0.00 -1.21 0.00 0.00 61.69 61.38 3kzq s THR 47 Cb -0.66 -1.00 0.12 0.00 -1.51 0.00 0.00 72.50 69.45 3kzq s THR 47 CO 0.44 -0.05 0.95 0.59 -2.21 0.00 0.00 174.62 174.34 3kzq n ASN 48 N 0.20 2.19 -4.75 8.08 5.03 -1.26 -4.81 115.26 119.93 3kzq n ASN 48 Ca -0.18 -1.59 -0.40 0.00 0.87 0.00 0.00 54.58 53.28 3kzq n ASN 48 Cb 0.61 -0.01 -0.05 0.00 -1.02 0.00 0.00 39.78 39.31 3kzq n ASN 48 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 3kzq s LEU 49 N -1.15 4.60 0.31 3.41 1.43 -1.26 -4.97 118.68 121.05 3kzq s LEU 49 Ca 0.17 2.11 -0.29 0.00 -1.03 0.00 0.00 54.13 55.09 3kzq s LEU 49 Cb 0.12 -3.62 -0.11 0.00 0.03 0.00 0.00 46.19 42.61 3kzq s LEU 49 CO 0.17 -0.00 1.49 -2.84 0.23 0.00 0.00 176.35 175.40 3kzq s PRO 50 N -1.29 4.19 0.05 1.29 0.02 -1.26 -4.34 135.00 133.66 3kzq s PRO 50 Ca 0.43 2.46 -0.33 0.00 0.02 0.00 0.00 61.00 63.58 3kzq s PRO 50 Cb -0.29 -3.04 -0.12 0.00 0.02 0.00 0.00 34.50 31.07 3kzq s PRO 50 CO 0.37 -0.50 1.77 -0.12 -0.33 0.00 0.00 177.00 178.19 3kzq n MET 51 N 1.62 2.33 -1.85 5.54 1.56 -0.32 -4.92 117.12 121.09 3kzq n MET 51 Ca 0.05 0.85 -0.37 0.00 -0.27 0.00 0.00 57.70 57.96 3kzq n MET 51 Cb 0.39 -2.68 0.05 0.00 2.15 0.00 0.00 33.22 33.12 3kzq n MET 51 CO 0.00 0.00 0.00 -1.25 -0.73 0.00 0.00 175.97 173.99 3kzq s PRO 52 N 2.64 2.93 0.38 2.12 0.04 -1.26 -4.77 135.00 137.08 3kzq s PRO 52 Ca 0.85 2.05 0.11 0.00 0.04 0.00 0.00 61.00 64.06 3kzq s PRO 52 Cb -0.63 -2.04 0.91 0.00 0.04 0.00 0.00 34.50 32.77 3kzq s PRO 52 CO 0.43 -1.30 1.89 -1.35 0.04 0.00 0.00 177.00 176.71 3kzq h PRO 53 N 1.04 0.57 -0.90 0.56 0.11 -1.99 -0.32 132.00 131.07 3kzq h PRO 53 Ca -0.51 -0.03 0.05 0.00 0.11 0.00 0.00 66.00 65.62 3kzq h PRO 53 Cb 1.31 -0.13 -0.06 0.00 0.11 0.00 0.00 31.00 32.23 3kzq h PRO 53 CO 0.55 0.38 0.57 0.93 -0.21 0.00 0.00 178.00 180.22 3kzq h GLU 54 N 0.59 1.05 -0.18 1.05 5.08 -2.00 -1.01 114.58 119.16 3kzq h GLU 54 Ca 0.41 -0.06 -0.20 0.00 -1.00 0.00 0.00 59.36 58.51 3kzq h GLU 54 Cb 0.75 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.77 3kzq h GLU 54 CO -0.17 0.69 -0.69 1.98 -1.00 0.00 0.00 179.01 179.82 3kzq h MET 55 N 1.08 0.73 -0.68 2.33 4.05 -1.43 -1.99 114.93 119.02 3kzq h MET 55 Ca 0.37 -0.54 0.05 0.00 -0.28 0.00 0.00 59.70 59.29 3kzq h MET 55 Cb 0.08 0.10 -0.05 0.00 -0.80 0.00 0.00 31.60 30.93 3kzq h MET 55 CO -0.14 1.16 0.40 1.96 0.23 0.00 0.00 176.91 180.52 3kzq h GLN 56 N 0.52 0.73 -0.44 0.39 4.20 -1.04 0.59 115.11 120.06 3kzq h GLN 56 Ca -0.03 -0.04 -0.07 0.00 0.06 0.00 0.00 58.65 58.57 3kzq h GLN 56 Cb 1.30 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 28.90 3kzq h GLN 56 CO 0.14 0.49 0.01 0.37 -0.67 0.00 0.00 178.83 179.16 3kzq h GLN 57 N 0.76 0.77 -0.54 1.46 4.15 -1.09 -1.38 115.11 119.24 3kzq h GLN 57 Ca 0.29 -0.24 -0.08 0.00 0.77 0.00 0.00 58.65 59.39 3kzq h GLN 57 Cb 0.11 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 27.71 3kzq h GLN 57 CO -0.15 0.83 0.01 -0.22 -1.93 0.00 0.00 178.83 177.37 3kzq h LYS 58 N 0.62 0.91 -0.12 1.69 3.64 -0.90 -1.97 116.57 120.44 3kzq h LYS 58 Ca 0.13 -0.26 -0.13 0.00 -1.27 0.00 0.00 60.65 59.12 3kzq h LYS 58 Cb 0.48 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 3kzq h LYS 58 CO 0.02 0.90 -0.42 1.25 -2.27 0.00 0.00 179.45 178.93 3kzq h LEU 59 N 0.84 0.58 -1.30 5.20 5.85 -0.49 -1.70 115.31 124.30 3kzq h LEU 59 Ca 0.16 -0.61 0.05 0.00 0.84 0.00 0.00 57.88 58.31 3kzq h LEU 59 Cb 0.49 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 41.30 3kzq h LEU 59 CO 0.02 1.09 0.50 -0.08 -0.34 0.00 0.00 178.44 179.64 3kzq h GLU 60 N 0.10 0.86 -0.12 1.25 4.81 -1.27 -0.98 114.58 119.23 3kzq h GLU 60 Ca -0.02 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.12 3kzq h GLU 60 Cb 1.05 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 30.23 3kzq h GLU 60 CO 0.09 0.57 -0.09 0.78 -0.73 0.00 0.00 179.01 179.63 3kzq h GLY 61 N 0.89 0.20 0.95 1.92 0.00 -1.07 -2.27 103.07 103.68 3kzq h GLY 61 Ca 0.31 -0.11 -0.08 0.00 0.00 0.00 0.00 47.33 47.45 3kzq h GLY 61 CO -0.10 0.10 -0.10 -2.22 0.00 0.00 0.00 176.54 174.22 3kzq h ILE 62 N 0.18 1.28 -0.50 2.60 2.04 -0.27 -1.79 117.51 121.05 3kzq h ILE 62 Ca 0.04 -1.18 0.08 0.00 1.00 0.00 0.00 64.86 64.80 3kzq h ILE 62 Cb 0.28 1.30 -0.06 0.00 -0.74 0.00 0.00 36.82 37.60 3kzq h ILE 62 CO 0.01 0.39 0.14 -0.50 0.00 0.00 0.00 178.15 178.19 3kzq h TRP 63 N 0.49 0.23 -0.44 1.37 4.06 -1.11 -0.37 115.95 120.18 3kzq h TRP 63 Ca 0.09 0.03 -0.10 0.00 2.06 0.00 0.00 58.89 60.96 3kzq h TRP 63 Cb 0.61 -0.03 -0.02 0.00 -1.00 0.00 0.00 29.16 28.73 3kzq h TRP 63 CO 0.05 0.04 -0.14 -0.22 -3.56 0.00 0.00 178.44 174.61 3kzq h LYS 64 N 0.29 0.83 -0.63 0.49 1.63 -1.22 -0.06 116.57 117.90 3kzq h LYS 64 Ca 0.25 -0.30 0.01 0.00 -0.85 0.00 0.00 60.65 59.76 3kzq h LYS 64 Cb 0.30 -0.06 -0.03 0.00 -0.60 0.00 0.00 32.23 31.84 3kzq h LYS 64 CO -0.29 0.92 0.41 0.37 -3.45 0.00 0.00 179.45 177.41 3kzq h GLN 65 N 0.74 0.81 -0.09 1.90 4.15 -0.76 -1.13 115.11 120.73 3kzq h GLN 65 Ca 0.12 -0.05 -0.00 0.00 0.77 0.00 0.00 58.65 59.49 3kzq h GLN 65 Cb 0.65 -0.18 -0.00 0.00 0.21 0.00 0.00 27.48 28.15 3kzq h GLN 65 CO 0.05 0.54 0.05 0.82 -1.93 0.00 0.00 178.83 178.35 3kzq h ILE 66 N 0.84 1.06 -0.59 2.39 2.04 -0.49 -0.19 117.51 122.56 3kzq h ILE 66 Ca 0.23 -0.15 0.07 0.00 1.00 0.00 0.00 64.86 66.01 3kzq h ILE 66 Cb -0.08 1.01 -0.06 0.00 -0.74 0.00 0.00 36.82 36.94 3kzq h ILE 66 CO -0.06 0.05 0.26 -0.08 0.00 0.00 0.00 178.15 178.33 3kzq h GLU 67 N 0.08 0.47 -0.64 2.37 4.81 -0.86 0.20 114.58 121.00 3kzq h GLU 67 Ca 0.03 -0.03 -0.07 0.00 -0.13 0.00 0.00 59.36 59.17 3kzq h GLU 67 Cb 0.04 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.29 3kzq h GLU 67 CO -0.01 0.31 0.14 1.15 -0.73 0.00 0.00 179.01 179.87 3kzq h THR 68 N 0.48 1.26 0.21 0.32 2.02 -0.87 0.15 112.91 116.48 3kzq h THR 68 Ca 0.28 -0.96 -0.33 0.00 0.77 0.00 0.00 66.41 66.18 3kzq h THR 68 Cb 0.27 0.65 0.02 0.00 -1.74 0.00 0.00 68.15 67.36 3kzq h THR 68 CO -0.24 0.36 -1.49 -0.61 0.37 0.00 0.00 175.52 173.91 3kzq h GLN 69 N 0.95 0.44 -0.00 6.66 4.15 -0.33 -3.39 115.11 123.58 3kzq h GLN 69 Ca 0.20 -0.75 0.00 0.00 0.77 0.00 0.00 58.65 58.87 3kzq h GLN 69 Cb 0.38 0.28 0.00 0.00 0.21 0.00 0.00 27.48 28.35 3kzq h GLN 69 CO 0.01 1.35 -0.08 1.28 -1.93 0.00 0.00 178.83 179.46 3kzq n LEU 70 N -3.63 0.75 0.00 -2.39 4.77 0.62 -5.00 117.00 112.12 3kzq n LEU 70 Ca -0.17 -0.76 0.00 0.00 -0.03 0.00 0.00 56.01 55.06 3kzq n LEU 70 Cb 1.08 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.17 3kzq n LEU 70 CO 0.57 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 177.40 3kzq n GLY 71 N 0.63 0.67 3.64 -0.72 0.00 0.53 -4.99 105.19 104.95 3kzq n GLY 71 Ca 0.01 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.58 3kzq n GLY 71 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3kzq n THR 72 N -2.37 1.35 -2.76 2.61 -1.04 -1.25 -4.96 114.28 105.85 3kzq n THR 72 Ca 0.00 -0.34 -0.41 0.00 -2.04 0.00 0.00 64.05 61.26 3kzq n THR 72 Cb 0.03 -1.24 -0.04 0.00 -1.82 0.00 0.00 70.33 67.26 3kzq n THR 72 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 3kzq s LYS 73 N -0.91 4.62 -0.01 -2.82 1.02 -1.26 -4.38 119.74 115.99 3kzq s LYS 73 Ca 0.65 1.38 0.00 0.00 0.02 0.00 0.00 55.97 58.02 3kzq s LYS 73 Cb -0.69 -3.41 0.02 0.00 -0.52 0.00 0.00 37.83 33.23 3kzq s LYS 73 CO 0.55 0.12 0.01 -0.06 -0.92 0.00 0.00 175.35 175.05 3kzq s PHE 74 N 0.37 0.09 -0.50 3.18 0.08 -1.26 -4.81 117.98 115.13 3kzq s PHE 74 Ca 0.47 0.05 -0.19 0.00 0.12 0.00 0.00 56.93 57.39 3kzq s PHE 74 Cb -0.22 -0.19 0.06 0.00 -0.57 0.00 0.00 43.02 42.10 3kzq s PHE 74 CO 0.28 -0.06 0.60 1.21 -0.10 0.00 0.00 175.22 177.15 3kzq s ASN 75 N 0.62 6.21 0.43 1.36 3.84 0.19 -4.94 114.94 122.65 3kzq s ASN 75 Ca -0.05 -0.97 0.30 0.00 0.21 0.00 0.00 52.86 52.34 3kzq s ASN 75 Cb -0.08 -2.28 1.40 0.00 -0.55 0.00 0.00 41.25 39.74 3kzq s ASN 75 CO -0.02 -0.86 1.90 1.88 -2.79 0.00 0.00 177.10 177.21 3kzq h TYR 76 N 8.96 0.00 -0.26 0.43 0.05 -1.95 -2.96 116.97 121.25 3kzq h TYR 76 Ca -0.28 0.00 0.07 0.00 0.05 0.00 0.00 58.73 58.58 3kzq h TYR 76 Cb 1.10 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.83 3kzq h TYR 76 CO 0.74 0.00 0.63 -0.44 -1.05 0.00 0.00 178.16 178.04 3kzq h ASP 77 N 0.00 0.00 -0.77 3.88 3.32 -1.97 -2.11 116.42 118.78 3kzq h ASP 77 Ca 0.00 0.00 0.14 0.00 0.02 0.00 0.00 57.03 57.19 3kzq h ASP 77 Cb 0.26 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 39.72 3kzq h ASP 77 CO 0.00 0.00 0.34 0.15 -1.72 0.00 0.00 179.24 178.01 3kzq h PHE 78 N 0.00 0.59 0.00 4.55 3.57 -1.84 0.77 116.94 124.58 3kzq h PHE 78 Ca 0.12 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.63 3kzq h PHE 78 Cb 1.39 -0.14 -0.00 0.00 2.79 0.00 0.00 35.95 39.98 3kzq h PHE 78 CO 0.00 0.11 -0.12 -1.49 -2.23 0.00 0.00 178.31 174.59 3kzq h TRP 79 N 0.51 0.00 0.05 0.41 4.06 -1.68 -1.29 115.95 118.01 3kzq h TRP 79 Ca 0.42 0.00 -0.34 0.00 2.06 0.00 0.00 58.89 61.02 3kzq h TRP 79 Cb 0.60 0.00 -0.04 0.00 -1.00 0.00 0.00 29.16 28.71 3kzq h TRP 79 CO -0.14 0.12 -2.03 1.63 -3.56 0.00 0.00 178.44 174.46 3kzq n LYS 80 N -3.35 0.69 0.06 0.49 5.02 -0.24 -4.60 118.16 116.24 3kzq n LYS 80 Ca -0.00 0.22 0.08 0.00 -2.02 0.00 0.00 58.31 56.58 3kzq n LYS 80 Cb 0.32 -1.68 -0.05 0.00 -0.02 0.00 0.00 35.03 33.59 3kzq n LYS 80 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 3kzq n LEU 81 N -3.20 0.71 -4.69 -0.35 4.32 0.10 -4.96 117.00 108.93 3kzq n LEU 81 Ca -0.29 0.29 -0.23 0.00 -0.02 0.00 0.00 56.01 55.76 3kzq n LEU 81 Cb 1.06 0.00 -0.07 0.00 -1.62 0.00 0.00 43.42 42.79 3kzq n LEU 81 CO 0.41 -0.05 -0.28 0.00 -1.22 0.00 0.00 177.39 176.25 3kzq s THR 83 N -2.31 4.87 0.45 0.00 2.01 -1.26 -4.83 115.64 114.58 3kzq s THR 83 Ca 0.33 -0.47 -0.22 0.00 0.31 0.00 0.00 61.69 61.64 3kzq s THR 83 Cb -0.06 -4.29 -0.09 0.00 0.01 0.00 0.00 72.50 68.07 3kzq s THR 83 CO 0.21 -0.80 1.05 -2.84 -0.69 0.00 0.00 174.62 171.55 3kzq s PRO 84 N 2.63 3.96 -0.04 4.92 0.02 -1.26 -4.93 135.00 140.29 3kzq s PRO 84 Ca 0.15 1.43 0.01 0.00 0.02 0.00 0.00 61.00 62.62 3kzq s PRO 84 Cb -0.19 -2.29 0.02 0.00 0.02 0.00 0.00 34.50 32.06 3kzq s PRO 84 CO 0.12 -0.31 -0.04 0.08 -0.33 0.00 0.00 177.00 176.52 3kzq s VAL 85 N -1.84 0.53 -1.34 3.83 1.01 -1.26 -1.18 120.40 120.16 3kzq s VAL 85 Ca 0.63 -0.12 -0.16 0.00 0.00 0.00 0.00 61.98 62.32 3kzq s VAL 85 Cb -0.19 -0.56 0.07 0.00 0.00 0.00 0.00 36.38 35.70 3kzq s VAL 85 CO 0.23 0.22 1.86 -1.14 0.00 0.00 0.00 175.10 176.28 3kzq n ARG 86 N 4.04 3.13 -3.40 2.72 3.00 -1.26 -4.84 116.66 120.05 3kzq n ARG 86 Ca -0.25 -3.14 -0.08 0.00 -0.00 0.00 0.00 57.85 54.39 3kzq n ARG 86 Cb 0.51 -3.40 -0.08 0.00 0.00 0.00 0.00 32.46 29.50 3kzq n ARG 86 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 3kzq s SER 87 N 3.76 -0.05 0.00 6.15 0.15 -1.26 -4.60 113.70 117.85 3kzq s SER 87 Ca 0.51 0.48 0.05 0.00 0.70 0.00 0.00 55.95 57.68 3kzq s SER 87 Cb 0.06 1.29 -0.00 0.00 -1.71 0.00 0.00 66.02 65.66 3kzq s SER 87 CO 0.03 -0.28 0.44 0.35 1.20 0.00 0.00 173.24 174.98 3kzq n THR 88 N 5.38 0.00 0.03 6.45 -2.24 0.30 -4.67 114.28 119.52 3kzq n THR 88 Ca -0.04 -0.45 -0.13 0.00 -2.27 0.00 0.00 64.05 61.16 3kzq n THR 88 Cb 0.50 1.06 -0.01 0.00 -2.10 0.00 0.00 70.33 69.77 3kzq n THR 88 CO 0.00 0.00 0.00 1.88 -0.57 0.00 0.00 175.07 176.38 3kzq h TYR 89 N 0.53 0.73 -0.73 4.78 -1.99 -1.79 -1.84 116.97 116.66 3kzq h TYR 89 Ca 0.00 -0.33 -0.02 0.00 2.00 0.00 0.00 58.73 60.38 3kzq h TYR 89 Cb 0.17 -0.11 -0.03 0.00 2.00 0.00 0.00 36.73 38.75 3kzq h TYR 89 CO 0.00 1.12 0.37 0.37 -0.00 0.00 0.00 178.16 180.02 3kzq h GLN 90 N 0.36 1.03 -0.14 4.88 5.75 -1.89 0.17 115.11 125.27 3kzq h GLN 90 Ca -0.04 -0.13 -0.10 0.00 -0.15 0.00 0.00 58.65 58.23 3kzq h GLN 90 Cb 1.37 -0.20 -0.01 0.00 1.07 0.00 0.00 27.48 29.71 3kzq h GLN 90 CO 0.14 0.78 -0.33 0.66 -2.65 0.00 0.00 178.83 177.43 3kzq h SER 91 N 1.03 0.29 -0.36 -0.69 4.64 -1.62 -0.30 113.55 116.55 3kzq h SER 91 Ca 0.26 -0.11 -0.06 0.00 -0.47 0.00 0.00 61.79 61.41 3kzq h SER 91 Cb 0.07 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.07 3kzq h SER 91 CO -0.04 0.62 -0.02 0.00 -0.87 0.00 0.00 176.83 176.52 3kzq h ARG 93 N 0.45 1.13 -0.61 0.00 3.08 -0.14 -2.61 114.38 115.68 3kzq h ARG 93 Ca 0.10 -0.07 -0.07 0.00 0.07 0.00 0.00 59.98 60.01 3kzq h ARG 93 Cb 0.50 -0.26 -0.03 0.00 0.08 0.00 0.00 29.97 30.27 3kzq h ARG 93 CO 0.02 0.75 0.10 0.00 -1.07 0.00 0.00 179.97 179.77 3kzq h ALA 94 N 1.40 1.02 -0.39 0.04 0.00 -0.79 -0.79 119.26 119.76 3kzq h ALA 94 Ca 0.39 -0.25 -0.16 0.00 0.00 0.00 0.00 54.91 54.88 3kzq h ALA 94 Cb 0.06 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3kzq h ALA 94 CO -0.14 0.63 -0.39 -0.39 0.00 0.00 0.00 179.25 178.96 3kzq h VAL 95 N 0.94 1.27 -0.46 0.00 -1.51 -1.13 -1.26 116.25 114.11 3kzq h VAL 95 Ca 0.19 -1.56 0.04 0.00 -1.23 0.00 0.00 66.70 64.14 3kzq h VAL 95 Cb 0.40 1.38 -0.04 0.00 -2.13 0.00 0.00 31.29 30.90 3kzq h VAL 95 CO 0.01 0.52 0.22 0.40 -1.23 0.00 0.00 177.57 177.49 3kzq h ILE 96 N 0.77 0.95 -0.35 7.19 1.08 -1.21 0.26 117.51 126.19 3kzq h ILE 96 Ca 0.06 -0.15 -0.14 0.00 -0.39 0.00 0.00 64.86 64.25 3kzq h ILE 96 Cb 0.98 0.47 -0.01 0.00 -3.07 0.00 0.00 36.82 35.20 3kzq h ILE 96 CO 0.10 0.08 -0.33 0.00 -0.69 0.00 0.00 178.15 177.31 3kzq h ALA 97 N 1.25 0.76 -0.31 1.87 0.00 -1.04 -1.27 119.26 120.52 3kzq h ALA 97 Ca 0.20 -0.42 -0.09 0.00 0.00 0.00 0.00 54.91 54.61 3kzq h ALA 97 Cb 0.12 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3kzq h ALA 97 CO -0.15 0.65 -0.17 0.00 0.00 0.00 0.00 179.25 179.58 3kzq h ALA 98 N 0.98 1.13 -0.24 0.00 0.00 -0.94 -2.54 119.26 117.64 3kzq h ALA 98 Ca 0.07 -0.31 0.04 0.00 0.00 0.00 0.00 54.91 54.71 3kzq h ALA 98 Cb 0.87 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 3kzq h ALA 98 CO 0.08 0.54 0.16 0.78 0.00 0.00 0.00 179.25 180.81 3kzq h GLY 99 N 0.97 0.20 2.00 0.00 0.00 0.60 0.32 103.07 107.15 3kzq h GLY 99 Ca 0.08 -0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.35 3kzq h GLY 99 CO 0.04 0.06 0.00 0.74 0.00 0.00 0.00 176.54 177.38 3kzq h PHE 100 N 0.17 0.00 -0.51 5.60 0.04 -0.85 0.13 116.94 121.52 3kzq h PHE 100 Ca 0.10 0.00 -0.18 0.00 2.80 0.00 0.00 57.97 60.69 3kzq h PHE 100 Cb 0.20 0.00 -0.11 0.00 2.20 0.00 0.00 35.95 38.24 3kzq h PHE 100 CO -0.00 0.00 0.13 1.04 -0.60 0.00 0.00 178.31 178.88 3kzq n GLN 101 N -2.79 2.73 -3.44 1.51 6.02 0.00 -4.96 117.38 116.44 3kzq n GLN 101 Ca 0.01 -3.05 -0.25 0.00 -0.01 0.00 0.00 57.00 53.70 3kzq n GLN 101 Cb 0.25 -1.98 0.02 0.00 1.02 0.00 0.00 30.24 29.55 3kzq n GLN 101 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 3kzq n ASP 102 N -0.68 -4.96 -2.35 1.08 2.03 0.03 -4.89 116.55 106.82 3kzq n ASP 102 Ca 0.35 -0.49 -0.11 0.00 0.52 0.00 0.00 54.79 55.06 3kzq n ASP 102 Cb 1.17 -4.01 0.04 0.00 -0.72 0.00 0.00 41.12 37.60 3kzq n ASP 102 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 3kzq n SER 103 N -2.57 3.19 0.03 1.67 7.64 -0.59 -4.87 113.62 118.11 3kzq n SER 103 Ca -0.02 -2.91 -0.13 0.00 1.01 0.00 0.00 58.87 56.82 3kzq n SER 103 Cb 0.56 -0.41 -0.08 0.00 -1.01 0.00 0.00 64.21 63.27 3kzq n SER 103 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 3kzq h TYR 104 N 2.32 -0.03 -0.17 1.43 3.20 -1.82 -1.34 116.97 120.55 3kzq h TYR 104 Ca 0.11 -0.00 -0.16 0.00 3.14 0.00 0.00 58.73 61.82 3kzq h TYR 104 Cb 1.41 0.01 -0.01 0.00 1.54 0.00 0.00 36.73 39.68 3kzq h TYR 104 CO 0.67 0.20 -0.55 0.93 -1.64 0.00 0.00 178.16 177.76 3kzq h GLU 105 N -0.26 0.52 -0.16 1.82 5.08 -1.92 -0.35 114.58 119.31 3kzq h GLU 105 Ca -0.00 -0.33 -0.00 0.00 -1.00 0.00 0.00 59.36 58.03 3kzq h GLU 105 Cb 0.24 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.53 3kzq h GLU 105 CO 0.01 0.93 0.10 1.96 -1.00 0.00 0.00 179.01 181.00 3kzq h GLN 106 N 0.40 0.22 -0.62 2.33 7.50 -1.89 -0.80 115.11 122.25 3kzq h GLN 106 Ca 0.01 -0.02 -0.08 0.00 0.50 0.00 0.00 58.65 59.06 3kzq h GLN 106 Cb 1.09 -0.05 -0.02 0.00 0.05 0.00 0.00 27.48 28.55 3kzq h GLN 106 CO 0.10 0.20 0.09 1.98 -1.50 0.00 0.00 178.83 179.70 3kzq h MET 107 N 0.18 1.03 -0.15 1.46 4.05 -1.13 -0.29 114.93 120.08 3kzq h MET 107 Ca 0.06 -0.28 0.02 0.00 -0.28 0.00 0.00 59.70 59.21 3kzq h MET 107 Cb 0.04 -0.12 -0.02 0.00 -0.80 0.00 0.00 31.60 30.70 3kzq h MET 107 CO -0.01 0.97 0.04 1.25 0.23 0.00 0.00 176.91 179.39 3kzq h LEU 108 N 0.94 0.04 -0.92 3.39 5.85 -0.82 -1.08 115.31 122.71 3kzq h LEU 108 Ca 0.19 0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.86 3kzq h LEU 108 Cb 0.44 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.47 3kzq h LEU 108 CO 0.01 0.05 0.04 -0.08 -0.34 0.00 0.00 178.44 178.12 3kzq h GLU 109 N 0.11 0.83 -0.38 1.25 4.81 -1.10 -1.86 114.58 118.24 3kzq h GLU 109 Ca 0.06 -0.21 -0.08 0.00 -0.13 0.00 0.00 59.36 59.00 3kzq h GLU 109 Cb 0.04 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.30 3kzq h GLU 109 CO -0.07 0.81 -0.11 0.00 -0.73 0.00 0.00 179.01 178.91 3kzq h ALA 110 N 1.26 1.11 -0.22 2.92 0.00 -0.54 -1.23 119.26 122.55 3kzq h ALA 110 Ca 0.16 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 3kzq h ALA 110 Cb 0.42 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 3kzq h ALA 110 CO 0.01 0.56 -0.04 0.82 0.00 0.00 0.00 179.25 180.60 3kzq h ILE 111 N 0.61 1.28 -0.09 0.00 2.04 -1.09 -0.55 117.51 119.72 3kzq h ILE 111 Ca 0.11 -1.02 0.04 0.00 1.00 0.00 0.00 64.86 64.99 3kzq h ILE 111 Cb 0.54 1.51 -0.06 0.00 -0.74 0.00 0.00 36.82 38.07 3kzq h ILE 111 CO 0.03 0.31 -0.29 1.56 0.00 0.00 0.00 178.15 179.76 3kzq h GLN 112 N 0.15 -0.38 -0.96 2.37 4.20 -1.17 0.05 115.11 119.37 3kzq h GLN 112 Ca 0.06 0.03 0.05 0.00 0.06 0.00 0.00 58.65 58.84 3kzq h GLN 112 Cb 0.49 0.09 -0.06 0.00 0.30 0.00 0.00 27.48 28.30 3kzq h GLN 112 CO 0.02 -0.25 0.62 0.45 -0.67 0.00 0.00 178.83 179.00 3kzq h HIS 113 N -0.39 1.16 -0.05 2.96 3.86 -1.24 0.46 115.15 121.91 3kzq h HIS 113 Ca 0.09 0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.32 3kzq h HIS 113 Cb 0.52 -0.38 -0.00 0.00 1.06 0.00 0.00 27.41 28.60 3kzq h HIS 113 CO -0.36 0.64 0.02 0.00 0.86 0.00 0.00 177.93 179.10 3kzq h ALA 114 N 1.41 0.06 0.26 2.45 0.00 -0.91 0.25 119.26 122.77 3kzq h ALA 114 Ca 0.39 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.23 3kzq h ALA 114 Cb 0.06 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.83 3kzq h ALA 114 CO -0.14 -0.38 -0.12 -0.92 0.00 0.00 0.00 179.25 177.68 3kzq h TYR 115 N -0.04 -0.32 0.00 0.00 3.20 -0.72 -0.97 116.97 118.13 3kzq h TYR 115 Ca 0.02 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.88 3kzq h TYR 115 Cb 0.11 0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.49 3kzq h TYR 115 CO -0.04 0.01 -1.01 0.66 -1.64 0.00 0.00 178.16 176.15 3kzq n TYR 116 N -5.09 0.87 -0.01 -3.82 4.01 0.16 -4.09 117.16 109.18 3kzq n TYR 116 Ca -0.09 0.25 -0.01 0.00 -0.16 0.00 0.00 57.90 57.89 3kzq n TYR 116 Cb 0.25 -0.89 -0.01 0.00 -0.31 0.00 0.00 39.34 38.38 3kzq n TYR 116 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 3kzq n LEU 117 N -2.58 2.91 -0.96 7.72 4.77 -0.28 0.55 117.00 129.13 3kzq n LEU 117 Ca 0.00 -0.01 0.10 0.00 -0.03 0.00 0.00 56.01 56.08 3kzq n LEU 117 Cb 0.54 -0.07 0.27 0.00 -2.33 0.00 0.00 43.42 41.82 3kzq n LEU 117 CO 0.40 0.52 0.72 0.54 -1.33 0.00 0.00 177.39 178.24 3kzq n ARG 118 N -2.55 2.24 -3.95 3.23 1.74 0.71 -4.60 116.66 113.48 3kzq n ARG 118 Ca -0.04 -1.90 -0.29 0.00 -0.77 0.00 0.00 57.85 54.86 3kzq n ARG 118 Cb 0.54 -1.46 0.01 0.00 -1.02 0.00 0.00 32.46 30.53 3kzq n ARG 118 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3kzq n ALA 119 N 1.08 -1.52 -2.69 7.54 0.00 -1.08 -4.97 120.51 118.86 3kzq n ALA 119 Ca 0.18 0.02 -0.30 0.00 0.00 0.00 0.00 53.44 53.35 3kzq n ALA 119 Cb 0.49 -3.37 -0.08 0.00 0.00 0.00 0.00 19.45 16.49 3kzq n ALA 119 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 3kzq s MET 120 N -6.57 2.55 -0.28 0.00 -1.94 -0.39 -4.74 119.30 107.94 3kzq s MET 120 Ca 0.46 -0.86 -0.29 0.00 -1.71 0.00 0.00 55.69 53.29 3kzq s MET 120 Cb -0.24 -2.53 0.00 0.00 2.01 0.00 0.00 34.83 34.07 3kzq s MET 120 CO 0.86 0.53 1.24 -1.25 -0.01 0.00 0.00 175.02 176.38 3kzq s PRO 121 N -2.41 4.02 0.35 2.03 0.04 -1.26 -4.16 135.00 133.60 3kzq s PRO 121 Ca 0.26 1.28 0.27 0.00 0.04 0.00 0.00 61.00 62.85 3kzq s PRO 121 Cb -0.11 -3.82 0.96 0.00 0.04 0.00 0.00 34.50 31.57 3kzq s PRO 121 CO 0.19 -0.98 1.78 -1.00 0.04 0.00 0.00 177.00 177.03 3kzq h PRO 122 N 8.77 0.00 -0.01 0.56 0.13 -1.91 -3.15 132.00 136.39 3kzq h PRO 122 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 3kzq h PRO 122 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 3kzq h PRO 122 CO 1.02 0.00 -0.28 -2.39 -0.23 0.00 0.00 178.00 176.12 3kzq n HIS 123 N -2.57 0.00 -3.36 1.56 1.44 -1.26 -4.54 115.22 106.49 3kzq n HIS 123 Ca 0.03 0.00 -0.38 0.00 -2.01 0.00 0.00 57.72 55.36 3kzq n HIS 123 Cb 0.33 -0.12 -0.06 0.00 0.12 0.00 0.00 29.99 30.26 3kzq n HIS 123 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 3kzq s GLU 124 N -2.52 4.21 0.25 -1.40 0.41 -1.19 -4.80 118.70 113.66 3kzq s GLU 124 Ca 0.23 0.48 -0.05 0.00 -0.41 0.00 0.00 54.97 55.22 3kzq s GLU 124 Cb 0.19 -3.36 0.47 0.00 -1.78 0.00 0.00 34.13 29.66 3kzq s GLU 124 CO 0.53 0.36 1.68 1.49 -0.49 0.00 0.00 175.26 178.83 3kzq h GLU 125 N 5.92 0.26 -0.90 1.61 4.81 -1.92 -0.05 114.58 124.31 3kzq h GLU 125 Ca -0.45 -0.02 0.09 0.00 -0.13 0.00 0.00 59.36 58.86 3kzq h GLU 125 Cb 1.19 -0.06 -0.06 0.00 0.63 0.00 0.00 28.75 30.45 3kzq h GLU 125 CO 0.70 0.17 0.58 0.00 -0.73 0.00 0.00 179.01 179.74 3kzq h ALA 126 N 1.62 1.62 -0.41 2.92 0.00 -1.95 -0.99 119.26 122.07 3kzq h ALA 126 Ca 0.42 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.29 3kzq h ALA 126 Cb 0.72 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 3kzq h ALA 126 CO -0.52 0.20 0.11 1.15 0.00 0.00 0.00 179.25 180.20 3kzq h THR 127 N 0.91 1.22 -0.78 0.00 2.02 -1.28 -2.71 112.91 112.29 3kzq h THR 127 Ca 0.41 -0.76 -0.04 0.00 0.77 0.00 0.00 66.41 66.80 3kzq h THR 127 Cb 0.39 0.94 -0.04 0.00 -1.74 0.00 0.00 68.15 67.70 3kzq h THR 127 CO -0.18 0.27 0.34 0.45 0.37 0.00 0.00 175.52 176.77 3kzq h HIS 128 N 0.52 1.16 -0.31 3.16 -0.00 -0.89 -0.52 115.15 118.27 3kzq h HIS 128 Ca 0.13 -0.07 -0.07 0.00 -0.00 0.00 0.00 60.37 60.36 3kzq h HIS 128 Cb 0.29 -0.35 -0.01 0.00 -0.00 0.00 0.00 27.41 27.34 3kzq h HIS 128 CO 0.01 0.86 -0.09 -0.07 -0.00 0.00 0.00 177.93 178.65 3kzq h LEU 129 N 1.13 0.61 -0.36 2.43 3.38 -1.18 0.37 115.31 121.69 3kzq h LEU 129 Ca 0.27 -0.37 0.02 0.00 0.09 0.00 0.00 57.88 57.88 3kzq h LEU 129 Cb 0.17 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 3kzq h LEU 129 CO -0.03 0.84 0.20 -0.61 0.09 0.00 0.00 178.44 178.93 3kzq h GLN 130 N 0.37 0.39 -0.76 1.13 4.15 -1.21 -1.21 115.11 117.96 3kzq h GLN 130 Ca 0.08 -0.02 -0.04 0.00 0.77 0.00 0.00 58.65 59.43 3kzq h GLN 130 Cb 0.59 -0.09 -0.03 0.00 0.21 0.00 0.00 27.48 28.15 3kzq h GLN 130 CO 0.03 0.26 0.31 -0.07 -1.93 0.00 0.00 178.83 177.43 3kzq h LEU 131 N 0.40 1.05 -0.83 -2.39 3.38 -1.01 0.15 115.31 116.06 3kzq h LEU 131 Ca 0.15 -0.17 0.05 0.00 0.09 0.00 0.00 57.88 58.00 3kzq h LEU 131 Cb 0.03 -0.27 -0.06 0.00 0.09 0.00 0.00 40.66 40.45 3kzq h LEU 131 CO -0.09 0.93 0.51 0.00 0.09 0.00 0.00 178.44 179.89 3kzq h ALA 132 N 1.16 1.12 -0.10 1.53 0.00 -0.33 -1.02 119.26 121.61 3kzq h ALA 132 Ca 0.25 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.10 3kzq h ALA 132 Cb 0.21 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 3kzq h ALA 132 CO -0.02 0.28 -0.12 -0.22 0.00 0.00 0.00 179.25 179.17 3kzq h LYS 133 N 0.96 0.26 -0.13 0.00 3.64 -0.90 -0.33 116.57 120.07 3kzq h LYS 133 Ca 0.35 -0.14 0.01 0.00 -1.27 0.00 0.00 60.65 59.59 3kzq h LYS 133 Cb 0.12 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 3kzq h LYS 133 CO -0.16 0.69 0.09 0.93 -2.27 0.00 0.00 179.45 178.73 3kzq h GLU 134 N -0.15 0.14 -0.27 1.90 5.08 -0.16 -0.03 114.58 121.10 3kzq h GLU 134 Ca 0.02 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 3kzq h GLU 134 Cb 0.65 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.86 3kzq h GLU 134 CO 0.03 0.10 0.00 0.44 -1.00 0.00 0.00 179.01 178.57 3kzq n ILE 135 N -4.52 0.35 -1.54 3.13 -5.35 -0.44 -4.95 119.36 106.05 3kzq n ILE 135 Ca -0.01 -0.46 -0.00 0.00 -0.27 0.00 0.00 62.75 62.01 3kzq n ILE 135 Cb 0.10 0.42 -0.00 0.00 -1.74 0.00 0.00 39.64 38.42 3kzq n ILE 135 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3kzq n GLY 136 N 1.19 0.38 3.74 3.28 0.00 -0.02 -5.06 105.19 108.69 3kzq n GLY 136 Ca 0.16 -0.97 -0.30 0.00 0.00 0.00 0.00 46.02 44.91 3kzq n GLY 136 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kzq s LEU 137 N -0.09 2.37 -0.43 0.99 1.43 -0.15 -4.94 118.68 117.87 3kzq s LEU 137 Ca 0.00 1.45 -0.29 0.00 -1.03 0.00 0.00 54.13 54.26 3kzq s LEU 137 Cb 0.00 -3.93 0.01 0.00 0.03 0.00 0.00 46.19 42.30 3kzq s LEU 137 CO 0.00 -2.45 1.42 0.21 0.23 0.00 0.00 176.35 175.76 3kzq s ASN 138 N -3.55 6.29 0.09 2.29 3.84 -1.26 -4.79 114.94 117.85 3kzq s ASN 138 Ca 0.63 0.76 -0.16 0.00 0.21 0.00 0.00 52.86 54.30 3kzq s ASN 138 Cb -0.17 -2.54 -0.08 0.00 -0.55 0.00 0.00 41.25 37.90 3kzq s ASN 138 CO 0.56 -1.48 1.43 0.58 -2.79 0.00 0.00 177.10 175.40 3kzq h VAL 139 N 6.47 1.30 -0.66 -5.21 2.07 -1.92 -1.13 116.25 117.17 3kzq h VAL 139 Ca -0.27 -1.33 0.03 0.00 0.82 0.00 0.00 66.70 65.94 3kzq h VAL 139 Cb 1.11 1.55 -0.04 0.00 -1.52 0.00 0.00 31.29 32.39 3kzq h VAL 139 CO 1.10 0.42 0.41 -0.61 0.02 0.00 0.00 177.57 178.91 3kzq h GLN 140 N 0.36 0.78 -0.86 1.57 5.75 -1.99 0.20 115.11 120.93 3kzq h GLN 140 Ca 0.05 -0.05 -0.02 0.00 -0.15 0.00 0.00 58.65 58.49 3kzq h GLN 140 Cb 0.74 -0.18 -0.04 0.00 1.07 0.00 0.00 27.48 29.07 3kzq h GLN 140 CO 0.05 0.52 0.46 0.37 -2.65 0.00 0.00 178.83 177.58 3kzq h GLN 141 N 0.81 1.21 -0.45 1.69 4.15 -1.92 0.24 115.11 120.84 3kzq h GLN 141 Ca 0.27 -0.15 -0.06 0.00 0.77 0.00 0.00 58.65 59.48 3kzq h GLN 141 Cb 0.02 -0.23 -0.02 0.00 0.21 0.00 0.00 27.48 27.46 3kzq h GLN 141 CO -0.11 0.89 0.05 0.35 -1.93 0.00 0.00 178.83 178.08 3kzq h PHE 142 N 1.21 0.81 -0.23 3.99 3.57 -0.09 -1.39 116.94 124.81 3kzq h PHE 142 Ca 0.30 -0.12 -0.00 0.00 3.53 0.00 0.00 57.97 61.68 3kzq h PHE 142 Cb 0.04 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 38.55 3kzq h PHE 142 CO 0.01 0.78 0.13 0.87 -2.23 0.00 0.00 178.31 177.87 3kzq h LYS 143 N 0.61 0.32 -1.00 1.11 1.57 0.17 -1.12 116.57 118.22 3kzq h LYS 143 Ca 0.13 -0.03 0.10 0.00 -1.87 0.00 0.00 60.65 58.98 3kzq h LYS 143 Cb 0.42 -0.06 -0.08 0.00 0.08 0.00 0.00 32.23 32.59 3kzq h LYS 143 CO 0.01 0.27 0.64 -0.91 -0.57 0.00 0.00 179.45 178.89 3kzq h ASN 144 N 0.28 0.98 -0.14 0.86 2.35 -0.21 -1.35 115.58 118.34 3kzq h ASN 144 Ca 0.08 0.03 -0.06 0.00 -0.55 0.00 0.00 56.30 55.80 3kzq h ASN 144 Cb 0.04 -0.17 -0.00 0.00 0.05 0.00 0.00 38.32 38.23 3kzq h ASN 144 CO -0.01 0.56 -0.14 0.44 -1.65 0.00 0.00 177.43 176.63 3kzq h ASP 145 N 1.07 0.37 -0.73 5.81 3.32 -1.02 -2.39 116.42 122.86 3kzq h ASP 145 Ca 0.47 -0.48 0.12 0.00 0.02 0.00 0.00 57.03 57.16 3kzq h ASP 145 Cb 0.35 -0.10 -0.05 0.00 0.22 0.00 0.00 39.33 39.75 3kzq h ASP 145 CO -0.23 0.78 0.48 0.24 -1.72 0.00 0.00 179.24 178.79 3kzq h MET 146 N -0.03 0.50 0.00 3.56 2.86 -0.85 -2.41 114.93 118.56 3kzq h MET 146 Ca 0.02 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 3kzq h MET 146 Cb 0.67 -0.11 0.00 0.00 0.06 0.00 0.00 31.60 32.22 3kzq h MET 146 CO 0.04 0.33 -0.11 -0.25 1.06 0.00 0.00 176.91 177.98 3kzq n ASP 147 N -4.49 0.78 -4.94 1.22 8.00 -0.54 -4.96 116.55 111.62 3kzq n ASP 147 Ca 0.13 0.49 -0.24 0.00 0.71 0.00 0.00 54.79 55.88 3kzq n ASP 147 Cb 0.42 -0.62 0.01 0.00 -0.02 0.00 0.00 41.12 40.91 3kzq n ASP 147 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 3kzq s GLY 148 N -3.58 1.51 0.47 0.44 0.00 -0.91 -4.99 107.32 100.27 3kzq s GLY 148 Ca 0.10 -0.90 0.26 0.00 0.00 0.00 0.00 44.72 44.19 3kzq s GLY 148 CO 0.62 -0.74 1.73 -0.91 0.00 0.00 0.00 173.10 173.80 3kzq h THR 149 N 0.37 0.00 -0.02 0.90 1.35 -1.92 -3.19 112.91 110.41 3kzq h THR 149 Ca -0.47 -0.83 -0.00 0.00 -0.55 0.00 0.00 66.41 64.56 3kzq h THR 149 Cb 1.24 1.83 -0.00 0.00 -1.73 0.00 0.00 68.15 69.49 3kzq h THR 149 CO 0.59 0.00 0.01 0.25 -0.25 0.00 0.00 175.52 176.12 3kzq h LEU 150 N 0.00 0.02 -1.36 3.87 6.46 -1.94 -2.60 115.31 119.75 3kzq h LEU 150 Ca 0.00 -0.08 -0.01 0.00 -0.12 0.00 0.00 57.88 57.68 3kzq h LEU 150 Cb 0.84 -0.00 -0.03 0.00 -0.73 0.00 0.00 40.66 40.74 3kzq h LEU 150 CO 0.00 0.09 0.31 0.25 -0.62 0.00 0.00 178.44 178.47 3kzq h LEU 151 N -0.05 0.66 -0.67 2.25 6.46 -1.76 -1.74 115.31 120.45 3kzq h LEU 151 Ca 0.01 -0.04 -0.04 0.00 -0.12 0.00 0.00 57.88 57.68 3kzq h LEU 151 Cb 0.08 -0.17 -0.03 0.00 -0.73 0.00 0.00 40.66 39.81 3kzq h LEU 151 CO -0.00 0.52 0.26 -0.08 -0.62 0.00 0.00 178.44 178.52 3kzq h GLU 152 N 0.76 1.01 -0.56 1.25 4.57 -1.51 0.13 114.58 120.23 3kzq h GLU 152 Ca 0.20 -0.19 -0.04 0.00 -1.18 0.00 0.00 59.36 58.15 3kzq h GLU 152 Cb -0.00 -0.16 -0.02 0.00 -0.16 0.00 0.00 28.75 28.40 3kzq h GLU 152 CO -0.03 0.85 0.20 0.78 -1.18 0.00 0.00 179.01 179.63 3kzq h GLY 153 N 0.95 0.92 0.92 1.92 0.00 -1.05 0.33 103.07 107.07 3kzq h GLY 153 Ca 0.22 -0.52 -0.00 0.00 0.00 0.00 0.00 47.33 47.03 3kzq h GLY 153 CO -0.02 0.49 0.05 -2.08 0.00 0.00 0.00 176.54 174.99 3kzq h VAL 154 N 0.78 1.10 -0.09 4.60 2.07 -0.87 -0.71 116.25 123.12 3kzq h VAL 154 Ca 0.18 -0.27 0.03 0.00 0.82 0.00 0.00 66.70 67.46 3kzq h VAL 154 Cb 0.24 1.09 -0.03 0.00 -1.52 0.00 0.00 31.29 31.07 3kzq h VAL 154 CO -0.01 0.09 -0.10 0.15 0.02 0.00 0.00 177.57 177.72 3kzq h PHE 155 N 0.06 -0.24 -0.69 1.57 3.57 -0.58 -0.67 116.94 119.97 3kzq h PHE 155 Ca 0.04 0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.64 3kzq h PHE 155 Cb 0.09 0.12 -0.04 0.00 2.79 0.00 0.00 35.95 38.90 3kzq h PHE 155 CO -0.04 -0.15 0.46 1.96 -2.23 0.00 0.00 178.31 178.31 3kzq h GLN 156 N -0.12 0.56 -0.09 1.11 1.08 -0.76 -1.27 115.11 115.62 3kzq h GLN 156 Ca 0.07 -0.03 -0.13 0.00 -1.45 0.00 0.00 58.65 57.11 3kzq h GLN 156 Cb 0.22 -0.13 -0.01 0.00 -0.05 0.00 0.00 27.48 27.51 3kzq h GLN 156 CO -0.16 0.37 -0.52 -0.44 -0.95 0.00 0.00 178.83 177.13 3kzq h ASP 157 N 0.58 0.25 -0.31 1.46 3.32 -0.37 -2.54 116.42 118.82 3kzq h ASP 157 Ca 0.32 -0.13 -0.02 0.00 0.02 0.00 0.00 57.03 57.22 3kzq h ASP 157 Cb 0.48 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.94 3kzq h ASP 157 CO -0.11 0.73 0.11 1.56 -1.72 0.00 0.00 179.24 179.81 3kzq h GLN 158 N 0.18 0.47 -0.56 3.56 1.08 -0.02 -0.48 115.11 119.34 3kzq h GLN 158 Ca 0.01 -0.09 0.05 0.00 -1.45 0.00 0.00 58.65 57.16 3kzq h GLN 158 Cb 0.97 -0.07 -0.05 0.00 -0.05 0.00 0.00 27.48 28.28 3kzq h GLN 158 CO 0.08 0.49 0.30 -0.07 -0.95 0.00 0.00 178.83 178.68 3kzq h LEU 159 N 0.35 0.43 0.00 1.46 3.38 -1.19 -0.30 115.31 119.44 3kzq h LEU 159 Ca 0.10 0.03 -0.17 0.00 0.09 0.00 0.00 57.88 57.93 3kzq h LEU 159 Cb 0.21 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 3kzq h LEU 159 CO -0.01 0.29 -0.84 0.77 0.09 0.00 0.00 178.44 178.74 3kzq h SER 160 N 0.57 0.00 -0.26 -0.43 4.64 -1.45 -2.53 113.55 114.09 3kzq h SER 160 Ca 0.25 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.56 3kzq h SER 160 Cb 0.15 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.22 3kzq h SER 160 CO -0.16 0.79 0.15 0.25 -0.87 0.00 0.00 176.83 176.98 3kzq h LEU 161 N 0.00 0.33 -0.71 5.97 5.85 -0.72 0.14 115.31 126.17 3kzq h LEU 161 Ca -0.02 -0.07 0.15 0.00 0.84 0.00 0.00 57.88 58.77 3kzq h LEU 161 Cb 1.62 -0.08 -0.11 0.00 0.37 0.00 0.00 40.66 42.46 3kzq h LEU 161 CO 0.10 0.30 0.16 0.00 -0.34 0.00 0.00 178.44 178.66 3kzq h ALA 162 N 1.03 0.90 -0.44 1.25 0.00 -0.96 -1.57 119.26 119.48 3kzq h ALA 162 Ca 0.09 0.17 -0.11 0.00 0.00 0.00 0.00 54.91 55.06 3kzq h ALA 162 Cb 0.05 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 3kzq h ALA 162 CO -0.02 -0.34 -0.16 0.87 0.00 0.00 0.00 179.25 179.60 3kzq h LYS 163 N 0.26 0.89 -0.40 0.00 1.57 -1.11 -2.27 116.57 115.50 3kzq h LYS 163 Ca 0.40 -0.37 0.08 0.00 -1.87 0.00 0.00 60.65 58.89 3kzq h LYS 163 Cb 0.66 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.92 3kzq h LYS 163 CO -0.50 1.02 0.28 0.77 -0.57 0.00 0.00 179.45 180.44 3kzq h SER 164 N 0.72 0.16 0.35 0.86 0.02 -0.56 -0.98 113.55 114.11 3kzq h SER 164 Ca 0.10 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 3kzq h SER 164 Cb 0.72 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.23 3kzq h SER 164 CO 0.06 0.10 -0.05 0.18 -1.14 0.00 0.00 176.83 175.97 3kzq n LEU 165 N -4.46 0.29 0.00 5.07 4.77 -0.63 -4.88 117.00 117.16 3kzq n LEU 165 Ca 0.06 0.07 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 3kzq n LEU 165 Cb 0.35 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.26 3kzq n LEU 165 CO 0.35 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.07 3kzq n GLY 166 N 1.23 0.59 3.66 -0.72 0.00 -0.37 -4.98 105.19 104.59 3kzq n GLY 166 Ca 0.16 -0.68 -0.35 0.00 0.00 0.00 0.00 46.02 45.16 3kzq n GLY 166 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3kzq s VAL 167 N -2.00 5.07 0.00 1.61 1.01 -0.89 -4.95 120.40 120.26 3kzq s VAL 167 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 61.98 62.05 3kzq s VAL 167 Cb 0.00 -3.32 0.00 0.00 0.00 0.00 0.00 36.38 33.06 3kzq s VAL 167 CO 0.00 0.43 0.70 -0.46 0.00 0.00 0.00 175.10 175.76 3kzq n ASN 168 N 3.75 1.08 -3.72 3.32 6.94 -1.26 -4.33 115.26 121.04 3kzq n ASN 168 Ca -0.16 -1.48 -0.10 0.00 -0.02 0.00 0.00 54.58 52.82 3kzq n ASN 168 Cb 0.52 0.00 -0.06 0.00 -2.36 0.00 0.00 39.78 37.88 3kzq n ASN 168 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 3kzq s SER 169 N -0.48 -0.12 0.04 0.53 1.04 -1.26 -5.14 113.70 108.31 3kzq s SER 169 Ca 0.00 -0.39 0.03 0.00 0.48 0.00 0.00 55.95 56.08 3kzq s SER 169 Cb 0.00 0.42 -0.02 0.00 0.10 0.00 0.00 66.02 66.52 3kzq s SER 169 CO 0.00 -0.78 -0.10 -0.31 0.98 0.00 0.00 173.24 173.04 3kzq s TYR 170 N -3.59 0.86 0.42 5.02 2.02 -1.26 -3.98 117.35 116.83 3kzq s TYR 170 Ca 0.02 -0.37 -0.23 0.00 -0.37 0.00 0.00 57.07 56.12 3kzq s TYR 170 Cb 0.02 -0.51 -0.09 0.00 -0.40 0.00 0.00 41.96 40.98 3kzq s TYR 170 CO -0.10 -0.02 1.05 -1.25 -1.57 0.00 0.00 175.55 173.66 3kzq s PRO 171 N -1.19 4.07 0.12 -1.71 0.04 -1.26 -4.65 135.00 130.43 3kzq s PRO 171 Ca -0.03 1.47 0.02 0.00 0.04 0.00 0.00 61.00 62.50 3kzq s PRO 171 Cb -0.08 -2.42 -0.04 0.00 0.04 0.00 0.00 34.50 31.99 3kzq s PRO 171 CO 0.01 -0.22 -0.06 -1.12 0.04 0.00 0.00 177.00 175.65 3kzq s SER 172 N -1.67 1.31 -0.02 6.66 0.01 -0.50 -4.93 113.70 114.56 3kzq s SER 172 Ca 0.60 -1.04 0.04 0.00 1.31 0.00 0.00 55.95 56.86 3kzq s SER 172 Cb -0.21 0.08 -0.01 0.00 0.21 0.00 0.00 66.02 66.09 3kzq s SER 172 CO 0.26 -0.46 -0.14 -0.76 0.41 0.00 0.00 173.24 172.55 3kzq s LEU 173 N -3.10 1.97 -0.03 2.44 1.43 -1.26 -0.56 118.68 119.57 3kzq s LEU 173 Ca 0.15 -0.26 -0.00 0.00 -1.03 0.00 0.00 54.13 52.99 3kzq s LEU 173 Cb 0.05 -0.75 0.03 0.00 0.03 0.00 0.00 46.19 45.55 3kzq s LEU 173 CO -0.02 0.15 0.02 -0.69 0.23 0.00 0.00 176.35 176.05 3kzq s VAL 174 N -0.18 0.05 -0.18 -1.59 1.01 -0.40 -1.37 120.40 117.73 3kzq s VAL 174 Ca 0.02 0.21 -0.18 0.00 0.00 0.00 0.00 61.98 62.03 3kzq s VAL 174 Cb -0.07 -0.20 -0.03 0.00 0.00 0.00 0.00 36.38 36.07 3kzq s VAL 174 CO 0.00 0.14 0.50 -0.22 0.00 0.00 0.00 175.10 175.53 3kzq s LEU 175 N 1.35 4.18 -0.13 3.92 2.96 0.21 -0.42 118.68 130.75 3kzq s LEU 175 Ca -0.05 0.70 -0.04 0.00 -0.22 0.00 0.00 54.13 54.51 3kzq s LEU 175 Cb -0.13 -2.70 -0.04 0.00 0.50 0.00 0.00 46.19 43.83 3kzq s LEU 175 CO -0.03 -0.13 0.03 -1.58 -1.32 0.00 0.00 176.35 173.32 3kzq s GLN 176 N 1.37 3.44 -0.28 1.98 0.74 0.91 -0.62 119.66 127.19 3kzq s GLN 176 Ca 0.24 -0.37 0.00 0.00 0.05 0.00 0.00 55.36 55.28 3kzq s GLN 176 Cb -0.15 -2.98 0.08 0.00 1.10 0.00 0.00 33.01 31.06 3kzq s GLN 176 CO 0.10 0.51 0.04 0.42 -0.55 0.00 0.00 175.29 175.81 3kzq s ILE 177 N -0.34 1.20 0.00 -2.34 1.01 -0.38 -1.67 121.20 118.68 3kzq s ILE 177 Ca 0.08 -1.37 0.00 0.00 0.00 0.00 0.00 60.65 59.36 3kzq s ILE 177 Cb -0.12 -1.75 0.00 0.00 0.01 0.00 0.00 42.46 40.59 3kzq s ILE 177 CO 0.02 -0.45 0.00 0.59 0.00 0.00 0.00 174.94 175.10 3kzq n ASN 178 N 4.74 0.00 -0.87 3.58 3.02 0.02 -2.08 115.26 123.67 3kzq n ASN 178 Ca -0.05 0.00 0.12 0.00 -0.03 0.00 0.00 54.58 54.62 3kzq n ASN 178 Cb 0.43 0.00 0.14 0.00 -0.61 0.00 0.00 39.78 39.75 3kzq n ASN 178 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3kzq n ASP 179 N 9.57 2.75 -4.74 6.41 8.00 -1.26 -4.97 116.55 132.32 3kzq n ASP 179 Ca 0.00 -1.90 -0.25 0.00 0.71 0.00 0.00 54.79 53.34 3kzq n ASP 179 Cb 0.00 0.03 -0.06 0.00 -0.02 0.00 0.00 41.12 41.07 3kzq n ASP 179 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3kzq s ALA 180 N -2.04 3.40 0.03 2.24 0.00 -0.89 -5.14 121.76 119.36 3kzq s ALA 180 Ca 0.28 -1.33 0.03 0.00 0.00 0.00 0.00 51.96 50.94 3kzq s ALA 180 Cb 0.20 -1.17 -0.02 0.00 0.00 0.00 0.00 23.12 22.13 3kzq s ALA 180 CO 0.32 0.44 -0.10 0.71 0.00 0.00 0.00 175.76 177.14 3kzq s TYR 181 N -1.84 0.88 -0.08 0.00 2.02 -1.26 -1.24 117.35 115.82 3kzq s TYR 181 Ca 0.30 -0.32 -0.01 0.00 -0.37 0.00 0.00 57.07 56.66 3kzq s TYR 181 Cb -0.09 -0.53 0.03 0.00 -0.40 0.00 0.00 41.96 40.97 3kzq s TYR 181 CO 0.21 -0.01 0.00 -0.06 -1.57 0.00 0.00 175.55 174.13 3kzq s PHE 182 N -0.80 0.70 0.32 2.71 0.08 0.20 -4.99 117.98 116.20 3kzq s PHE 182 Ca -0.01 -0.21 -0.28 0.00 0.12 0.00 0.00 56.93 56.54 3kzq s PHE 182 Cb -0.07 -0.82 -0.10 0.00 -0.57 0.00 0.00 43.02 41.47 3kzq s PHE 182 CO 0.01 -0.35 1.15 -1.25 -0.10 0.00 0.00 175.22 174.68 3kzq s PRO 183 N 1.96 4.46 -0.17 0.24 0.04 -1.26 -0.62 135.00 139.66 3kzq s PRO 183 Ca 0.05 1.89 0.02 0.00 0.04 0.00 0.00 61.00 62.99 3kzq s PRO 183 Cb -0.13 -3.05 0.02 0.00 0.04 0.00 0.00 34.50 31.38 3kzq s PRO 183 CO -0.05 0.02 -0.21 0.42 0.04 0.00 0.00 177.00 177.22 3kzq s ILE 184 N -1.22 2.06 0.42 0.56 -1.09 -0.47 -4.88 121.20 116.58 3kzq s ILE 184 Ca 0.48 -0.95 -0.26 0.00 -2.23 0.00 0.00 60.65 57.68 3kzq s ILE 184 Cb -0.33 -1.85 -0.09 0.00 -1.58 0.00 0.00 42.46 38.61 3kzq s ILE 184 CO 0.43 0.54 1.44 -0.70 -1.23 0.00 0.00 174.94 175.42 3kzq s GLU 185 N 1.11 3.85 -0.01 2.79 2.12 -1.26 -3.99 118.70 123.32 3kzq s GLU 185 Ca 0.01 2.46 -0.24 0.00 0.36 0.00 0.00 54.97 57.55 3kzq s GLU 185 Cb -0.14 -2.77 -0.05 0.00 0.26 0.00 0.00 34.13 31.43 3kzq s GLU 185 CO -0.09 -0.70 0.72 0.08 -0.54 0.00 0.00 175.26 174.74 3kzq s VAL 186 N -1.18 4.88 -0.23 3.70 1.01 -1.26 -4.80 120.40 122.52 3kzq s VAL 186 Ca 0.58 1.52 0.00 0.00 0.00 0.00 0.00 61.98 64.08 3kzq s VAL 186 Cb -0.44 -4.07 0.03 0.00 0.00 0.00 0.00 36.38 31.91 3kzq s VAL 186 CO 0.58 0.32 -0.11 -0.62 0.00 0.00 0.00 175.10 175.27 3kzq s ASP 187 N 0.27 4.03 0.39 3.32 -1.08 -1.26 -5.01 116.67 117.33 3kzq s ASP 187 Ca 0.37 -0.96 0.19 0.00 -0.52 0.00 0.00 52.55 51.64 3kzq s ASP 187 Cb -0.19 -1.58 0.73 0.00 -1.46 0.00 0.00 42.92 40.42 3kzq s ASP 187 CO 0.20 -0.11 1.76 1.88 0.52 0.00 0.00 175.17 179.42 3kzq h TYR 188 N 7.93 0.00 0.00 -5.34 0.05 -1.97 -3.26 116.97 114.38 3kzq h TYR 188 Ca -0.32 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.46 3kzq h TYR 188 Cb 1.10 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.84 3kzq h TYR 188 CO 0.57 0.35 -1.65 1.28 -1.05 0.00 0.00 178.16 177.66 3kzq n LEU 189 N -3.54 0.20 -3.76 3.88 4.77 -1.26 -4.61 117.00 112.68 3kzq n LEU 189 Ca -0.00 -0.11 -0.13 0.00 -0.03 0.00 0.00 56.01 55.74 3kzq n LEU 189 Cb 0.49 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.46 3kzq n LEU 189 CO 0.36 0.05 -0.05 -0.55 -1.33 0.00 0.00 177.39 175.88 3kzq s SER 190 N -3.88 -0.31 0.16 -1.43 0.15 -1.23 -4.98 113.70 102.19 3kzq s SER 190 Ca -0.04 0.60 0.10 0.00 0.70 0.00 0.00 55.95 57.31 3kzq s SER 190 Cb 0.13 0.59 -0.12 0.00 -1.71 0.00 0.00 66.02 64.91 3kzq s SER 190 CO 0.79 -0.11 1.29 0.74 1.20 0.00 0.00 173.24 177.15 3kzq h THR 191 N 4.84 1.37 -0.51 6.45 2.02 -1.89 -3.39 112.91 121.80 3kzq h THR 191 Ca -0.28 -2.96 -0.03 0.00 0.77 0.00 0.00 66.41 63.91 3kzq h THR 191 Cb 1.19 2.67 -0.02 0.00 -1.74 0.00 0.00 68.15 70.24 3kzq h THR 191 CO 0.33 0.78 0.22 -0.33 0.37 0.00 0.00 175.52 176.88 3kzq h GLU 192 N 0.00 0.75 -0.15 6.66 4.39 -1.97 -1.64 114.58 122.62 3kzq h GLU 192 Ca -0.03 -0.13 -0.05 0.00 0.34 0.00 0.00 59.36 59.50 3kzq h GLU 192 Cb 1.65 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 30.16 3kzq h GLU 192 CO 0.10 0.65 -0.13 -1.35 -1.16 0.00 0.00 179.01 177.13 3kzq h PRO 193 N 0.67 0.23 -0.16 2.33 0.11 -1.99 -2.09 132.00 131.11 3kzq h PRO 193 Ca 0.17 -0.05 -0.11 0.00 0.11 0.00 0.00 66.00 66.12 3kzq h PRO 193 Cb 0.17 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.25 3kzq h PRO 193 CO -0.02 0.37 -0.33 1.15 -0.21 0.00 0.00 178.00 178.96 3kzq h THR 194 N 0.22 1.35 -1.00 -1.15 2.02 -1.58 -1.49 112.91 111.28 3kzq h THR 194 Ca 0.05 -1.59 0.02 0.00 0.77 0.00 0.00 66.41 65.66 3kzq h THR 194 Cb 0.37 1.97 -0.05 0.00 -1.74 0.00 0.00 68.15 68.69 3kzq h THR 194 CO 0.02 0.48 0.66 -0.07 0.37 0.00 0.00 175.52 176.98 3kzq h LEU 195 N 0.14 1.12 -0.41 2.58 3.38 -1.26 -0.85 115.31 120.01 3kzq h LEU 195 Ca 0.00 -0.02 -0.12 0.00 0.09 0.00 0.00 57.88 57.83 3kzq h LEU 195 Cb 0.93 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 3kzq h LEU 195 CO 0.07 0.79 -0.22 0.50 0.09 0.00 0.00 178.44 179.67 3kzq h LYS 196 N 1.31 0.87 -0.70 1.13 3.64 -1.26 0.28 116.57 121.84 3kzq h LYS 196 Ca 0.38 -0.39 0.05 0.00 -1.27 0.00 0.00 60.65 59.43 3kzq h LYS 196 Cb -0.08 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 31.67 3kzq h LYS 196 CO -0.10 1.03 0.41 -0.07 -2.27 0.00 0.00 179.45 178.45 3kzq h LEU 197 N 0.68 0.62 0.26 5.20 3.38 -0.85 -1.21 115.31 123.39 3kzq h LEU 197 Ca 0.09 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 3kzq h LEU 197 Cb 0.79 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.44 3kzq h LEU 197 CO 0.06 0.40 -0.12 0.40 0.09 0.00 0.00 178.44 179.27 3kzq h ILE 198 N 0.75 0.79 -0.90 1.22 2.04 -0.76 -2.25 117.51 118.41 3kzq h ILE 198 Ca 0.31 -0.45 0.04 0.00 1.00 0.00 0.00 64.86 65.75 3kzq h ILE 198 Cb 0.16 1.05 -0.05 0.00 -0.74 0.00 0.00 36.82 37.23 3kzq h ILE 198 CO -0.17 0.10 0.59 0.03 0.00 0.00 0.00 178.15 178.70 3kzq h ARG 199 N -0.59 1.07 -0.70 2.37 3.08 -0.82 -1.95 114.38 116.84 3kzq h ARG 199 Ca -0.04 -0.06 -0.06 0.00 0.07 0.00 0.00 59.98 59.89 3kzq h ARG 199 Cb 0.43 -0.24 -0.03 0.00 0.08 0.00 0.00 29.97 30.21 3kzq h ARG 199 CO 0.06 0.71 0.19 0.93 -1.07 0.00 0.00 179.97 180.79 3kzq h GLU 200 N 1.10 1.10 -0.29 0.04 5.08 -1.12 -1.58 114.58 118.91 3kzq h GLU 200 Ca 0.36 -0.25 -0.14 0.00 -1.00 0.00 0.00 59.36 58.33 3kzq h GLU 200 Cb 0.05 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.15 3kzq h GLU 200 CO -0.11 0.95 -0.38 0.00 -1.00 0.00 0.00 179.01 178.47 3kzq h ARG 201 N 1.05 0.77 0.17 2.33 2.47 -1.04 -1.60 114.38 118.54 3kzq h ARG 201 Ca 0.22 -0.44 0.01 0.00 -1.26 0.00 0.00 59.98 58.51 3kzq h ARG 201 Cb 0.33 0.03 -0.02 0.00 -1.65 0.00 0.00 29.97 28.66 3kzq h ARG 201 CO -0.00 1.07 -0.21 0.82 0.56 0.00 0.00 179.97 182.21 3kzq h ILE 202 N 0.53 0.54 -0.80 2.04 2.04 -1.17 -2.38 117.51 118.31 3kzq h ILE 202 Ca 0.04 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.91 3kzq h ILE 202 Cb 0.97 0.54 -0.04 0.00 -0.74 0.00 0.00 36.82 37.54 3kzq h ILE 202 CO 0.09 0.00 0.53 0.40 0.00 0.00 0.00 178.15 179.17 3kzq h ILE 203 N -0.43 1.19 -0.30 -0.67 1.08 -1.30 -2.23 117.51 114.86 3kzq h ILE 203 Ca 0.01 -0.37 0.01 0.00 -0.39 0.00 0.00 64.86 64.12 3kzq h ILE 203 Cb 0.42 0.03 -0.01 0.00 -3.07 0.00 0.00 36.82 34.18 3kzq h ILE 203 CO -0.07 0.20 0.20 -0.33 -0.69 0.00 0.00 178.15 177.45 3kzq h GLU 204 N 1.07 0.35 -0.74 2.37 5.08 -1.22 -2.87 114.58 118.62 3kzq h GLU 204 Ca 0.30 -0.02 -0.16 0.00 -1.00 0.00 0.00 59.36 58.48 3kzq h GLU 204 Cb -0.11 -0.08 -0.09 0.00 0.50 0.00 0.00 28.75 28.97 3kzq h GLU 204 CO -0.07 0.23 0.20 0.09 -1.00 0.00 0.00 179.01 178.46 3kzq n ASN 205 N -4.49 4.80 -0.89 1.42 4.13 -0.85 -5.10 115.26 114.28 3kzq n ASN 205 Ca 0.02 -3.06 0.11 0.00 1.68 0.00 0.00 54.58 53.33 3kzq n ASN 205 Cb 0.10 -0.72 0.09 0.00 -1.54 0.00 0.00 39.78 37.71 3kzq n ASN 205 CO 0.00 0.00 0.00 0.23 0.28 0.00 0.00 177.26 177.77