#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kzn s ALA 2 N 0.00 -1.40 -0.94 3.04 0.00 -1.26 -5.10 121.76 116.11 2kzn s ALA 2 Ca 0.00 1.05 -0.24 0.00 0.00 0.00 0.00 51.96 52.77 2kzn s ALA 2 Cb 0.00 -0.13 0.01 0.00 0.00 0.00 0.00 23.12 23.00 2kzn s ALA 2 CO 0.00 -0.32 1.65 0.71 0.00 0.00 0.00 175.76 177.81 2kzn s TYR 3 N -0.99 2.19 1.14 0.00 1.51 -1.26 -4.99 117.35 114.95 2kzn s TYR 3 Ca -0.10 -0.14 -0.16 0.00 -1.01 0.00 0.00 57.07 55.65 2kzn s TYR 3 Cb -0.02 -4.41 0.26 0.00 -0.11 0.00 0.00 41.96 37.67 2kzn s TYR 3 CO 0.07 -1.89 1.09 -0.80 -1.11 0.00 0.00 175.55 172.91 2kzn s ASN 4 N 6.25 1.43 0.28 2.29 0.01 -1.26 -4.89 114.94 119.05 2kzn s ASN 4 Ca 0.56 0.89 0.21 0.00 -0.71 0.00 0.00 52.86 53.80 2kzn s ASN 4 Cb -0.04 -1.33 1.04 0.00 0.41 0.00 0.00 41.25 41.34 2kzn s ASN 4 CO -0.04 -3.83 1.63 0.29 -1.51 0.00 0.00 177.10 173.64 2kzn n LYS 5 N -4.60 0.14 -0.36 -0.60 5.02 -1.26 -1.90 118.16 114.60 2kzn n LYS 5 Ca 0.09 0.56 0.05 0.00 -2.02 0.00 0.00 58.31 56.99 2kzn n LYS 5 Cb 0.58 -1.90 0.20 0.00 -0.02 0.00 0.00 35.03 33.89 2kzn n LYS 5 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 2kzn h GLU 6 N 0.00 1.02 -0.81 1.97 4.57 -1.98 -0.08 114.58 119.27 2kzn h GLU 6 Ca 0.00 -0.06 0.11 0.00 -1.18 0.00 0.00 59.36 58.22 2kzn h GLU 6 Cb 0.11 -0.23 -0.08 0.00 -0.16 0.00 0.00 28.75 28.39 2kzn h GLU 6 CO 0.00 0.68 0.44 1.49 -1.18 0.00 0.00 179.01 180.44 2kzn h GLU 7 N 1.05 0.70 0.36 1.92 4.57 -1.72 -1.54 114.58 119.91 2kzn h GLU 7 Ca 0.46 -0.04 -0.02 0.00 -1.18 0.00 0.00 59.36 58.58 2kzn h GLU 7 Cb 0.33 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 28.77 2kzn h GLU 7 CO -0.22 0.46 -0.17 -0.22 -1.18 0.00 0.00 179.01 177.68 2kzn h LYS 8 N 0.72 -0.46 -0.87 1.92 1.63 -1.54 -3.30 116.57 114.66 2kzn h LYS 8 Ca 0.40 0.03 -0.01 0.00 -0.85 0.00 0.00 60.65 60.23 2kzn h LYS 8 Cb 0.43 0.10 -0.04 0.00 -0.60 0.00 0.00 32.23 32.12 2kzn h LYS 8 CO -0.28 -0.31 0.52 0.82 -3.45 0.00 0.00 179.45 176.75 2kzn h ILE 9 N -1.11 1.24 -0.00 2.00 1.08 -0.97 0.81 117.51 120.56 2kzn h ILE 9 Ca -0.05 -0.54 -0.01 0.00 -0.39 0.00 0.00 64.86 63.86 2kzn h ILE 9 Cb 0.37 0.03 -0.00 0.00 -3.07 0.00 0.00 36.82 34.14 2kzn h ILE 9 CO 0.08 0.26 -0.07 0.50 -0.69 0.00 0.00 178.15 178.23 2kzn h LYS 10 N 1.20 0.00 -0.43 2.37 1.63 -1.46 -0.14 116.57 119.75 2kzn h LYS 10 Ca 0.31 -0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.11 2kzn h LYS 10 Cb -0.04 -0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.59 2kzn h LYS 10 CO -0.06 0.07 0.00 0.45 -3.45 0.00 0.00 179.45 176.47 2kzn n SER 11 N -4.45 3.54 0.07 4.20 2.88 -0.07 -4.72 113.62 115.07 2kzn n SER 11 Ca -0.03 -2.27 0.00 0.00 -1.33 0.00 0.00 58.87 55.24 2kzn n SER 11 Cb 0.15 -0.38 0.00 0.00 -0.75 0.00 0.00 64.21 63.23 2kzn n SER 11 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 2kzn n LEU 12 N 0.55 0.59 0.29 2.46 7.94 0.08 -4.91 117.00 124.00 2kzn n LEU 12 Ca 0.17 0.23 0.15 0.00 -1.11 0.00 0.00 56.01 55.45 2kzn n LEU 12 Cb 0.62 -0.07 0.90 0.00 0.53 0.00 0.00 43.42 45.39 2kzn n LEU 12 CO 0.13 -0.74 1.09 -1.13 -1.11 0.00 0.00 177.39 175.63 2kzn h ASN 13 N 0.00 0.00 -0.24 1.96 -0.73 -1.27 -3.00 115.58 112.29 2kzn h ASN 13 Ca 0.00 0.00 -0.00 0.00 1.87 0.00 0.00 56.30 58.17 2kzn h ASN 13 Cb 0.00 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 38.58 2kzn h ASN 13 CO 0.00 0.03 0.15 -0.09 -0.37 0.00 0.00 177.43 177.15 2kzn h ARG 14 N 0.00 0.33 0.34 6.67 1.12 -1.86 -0.70 114.38 120.27 2kzn h ARG 14 Ca -0.00 -0.03 -0.02 0.00 -1.11 0.00 0.00 59.98 58.82 2kzn h ARG 14 Cb 0.10 -0.07 0.00 0.00 -0.01 0.00 0.00 29.97 30.00 2kzn h ARG 14 CO 0.00 0.26 -0.16 0.52 -3.11 0.00 0.00 179.97 177.49 2kzn h MET 15 N 0.30 -0.43 -0.83 0.20 2.86 -1.92 -0.92 114.93 114.19 2kzn h MET 15 Ca 0.09 0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.75 2kzn h MET 15 Cb 0.02 0.10 -0.04 0.00 0.06 0.00 0.00 31.60 31.74 2kzn h MET 15 CO -0.02 -0.15 0.49 1.96 1.06 0.00 0.00 176.91 180.25 2kzn h GLN 16 N -0.70 1.13 0.41 1.72 4.20 -1.69 0.87 115.11 121.05 2kzn h GLN 16 Ca -0.05 -0.11 -0.01 0.00 0.06 0.00 0.00 58.65 58.54 2kzn h GLN 16 Cb 0.49 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 28.02 2kzn h GLN 16 CO 0.08 0.81 -0.26 -0.92 -0.67 0.00 0.00 178.83 177.86 2kzn h TYR 17 N 1.14 -0.69 -0.36 2.96 3.20 -1.15 -0.89 116.97 121.18 2kzn h TYR 17 Ca 0.30 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.23 2kzn h TYR 17 Cb -0.03 0.25 -0.02 0.00 1.54 0.00 0.00 36.73 38.47 2kzn h TYR 17 CO -0.00 -0.40 0.25 1.49 -1.64 0.00 0.00 178.16 177.85 2kzn h GLU 18 N -0.65 0.19 0.23 1.82 4.81 -0.48 -1.77 114.58 118.72 2kzn h GLU 18 Ca -0.04 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.16 2kzn h GLU 18 Cb 0.54 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.88 2kzn h GLU 18 CO 0.04 0.12 -0.11 0.28 -0.73 0.00 0.00 179.01 178.61 2kzn h VAL 19 N 0.19 0.00 -0.01 0.32 2.07 -0.75 -3.32 116.25 114.75 2kzn h VAL 19 Ca 0.16 -0.54 0.00 0.00 0.82 0.00 0.00 66.70 67.14 2kzn h VAL 19 Cb 0.40 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.17 2kzn h VAL 19 CO -0.03 0.00 0.02 0.00 0.02 0.00 0.00 177.57 177.58 2kzn h THR 20 N -0.84 0.32 -0.09 2.57 1.03 -0.91 0.32 112.91 115.31 2kzn h THR 20 Ca -0.03 0.00 -0.11 0.00 -0.01 0.00 0.00 66.41 66.26 2kzn h THR 20 Cb 0.23 0.98 -0.01 0.00 -1.07 0.00 0.00 68.15 68.28 2kzn h THR 20 CO 0.05 0.00 -0.44 1.56 -0.01 0.00 0.00 175.52 176.68 2kzn h GLN 21 N 0.00 0.21 0.00 0.00 1.08 -1.45 -3.15 115.11 111.80 2kzn h GLN 21 Ca 0.00 -0.10 0.00 0.00 -1.45 0.00 0.00 58.65 57.10 2kzn h GLN 21 Cb 0.04 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.47 2kzn h GLN 21 CO -0.00 0.61 -1.75 -1.71 -0.95 0.00 0.00 178.83 175.03 2kzn n ASN 22 N -4.01 0.85 -3.46 1.46 5.15 -0.55 -4.99 115.26 109.71 2kzn n ASN 22 Ca -0.02 -0.08 -0.20 0.00 -0.60 0.00 0.00 54.58 53.69 2kzn n ASN 22 Cb 0.49 1.76 0.06 0.00 -0.53 0.00 0.00 39.78 41.56 2kzn n ASN 22 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 2kzn n ASN 23 N -2.07 -4.40 -4.92 1.20 4.05 0.98 -5.05 115.26 105.06 2kzn n ASN 23 Ca -0.03 -0.77 -0.27 0.00 0.45 0.00 0.00 54.58 53.96 2kzn n ASN 23 Cb 0.46 -4.61 0.04 0.00 1.23 0.00 0.00 39.78 36.89 2kzn n ASN 23 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 177.26 173.38 2kzn s GLY 24 N -3.79 1.63 -0.15 8.20 0.00 -0.30 -5.00 107.32 107.92 2kzn s GLY 24 Ca 0.28 -0.71 0.02 0.00 0.00 0.00 0.00 44.72 44.31 2kzn s GLY 24 CO 0.78 -0.40 -0.21 -1.08 0.00 0.00 0.00 173.10 172.19 2kzn s THR 25 N -3.08 1.99 -0.50 0.90 -1.32 -1.26 -4.71 115.64 107.66 2kzn s THR 25 Ca 0.56 -0.92 0.03 0.00 -1.21 0.00 0.00 61.69 60.15 2kzn s THR 25 Cb -0.11 -1.77 0.13 0.00 -1.51 0.00 0.00 72.50 69.24 2kzn s THR 25 CO 0.46 0.53 0.25 -1.61 -2.21 0.00 0.00 174.62 172.04 2kzn s GLU 26 N 0.98 1.78 0.17 7.08 0.41 -1.26 -5.05 118.70 122.82 2kzn s GLU 26 Ca -0.03 -2.45 -0.32 0.00 -0.41 0.00 0.00 54.97 51.76 2kzn s GLU 26 Cb -0.15 -3.05 -0.11 0.00 -1.78 0.00 0.00 34.13 29.04 2kzn s GLU 26 CO -0.05 -1.12 1.77 -2.14 -0.49 0.00 0.00 175.26 173.22 2kzn s PRO 27 N -0.10 4.13 -0.75 0.39 0.02 -1.26 -3.92 135.00 133.51 2kzn s PRO 27 Ca 0.17 2.60 -0.24 0.00 0.02 0.00 0.00 61.00 63.55 2kzn s PRO 27 Cb -0.26 -3.30 -0.15 0.00 0.02 0.00 0.00 34.50 30.81 2kzn s PRO 27 CO -0.00 -0.79 2.40 -2.30 -0.33 0.00 0.00 177.00 175.98 2kzn n PRO 28 N 4.73 0.59 0.29 5.54 -0.02 -1.26 -4.80 135.00 140.06 2kzn n PRO 28 Ca 0.17 -0.47 0.19 0.00 -2.02 0.00 0.00 63.50 61.37 2kzn n PRO 28 Cb 0.37 -3.17 1.02 0.00 -0.02 0.00 0.00 33.50 31.69 2kzn n PRO 28 CO 0.00 0.00 0.00 0.74 1.98 0.00 0.00 175.50 178.22 2kzn h PHE 29 N 14.35 0.00 0.00 6.00 0.04 -2.01 -0.95 116.94 134.36 2kzn h PHE 29 Ca -0.06 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.70 2kzn h PHE 29 Cb 1.11 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.26 2kzn h PHE 29 CO 1.13 0.00 -0.01 -0.56 -0.60 0.00 0.00 178.31 178.27 2kzn h GLN 30 N 0.00 0.00 -6.26 1.51 3.07 -2.03 -3.42 115.11 107.99 2kzn h GLN 30 Ca 0.00 0.00 -0.67 0.00 0.09 0.00 0.00 58.65 58.07 2kzn h GLN 30 Cb 0.04 0.00 -0.16 0.00 0.08 0.00 0.00 27.48 27.44 2kzn h GLN 30 CO 0.00 0.01 -0.68 -0.80 0.09 0.00 0.00 178.83 177.45 2kzn s ASN 31 N -7.04 4.81 -0.08 0.06 -0.87 -0.36 -5.04 114.94 106.43 2kzn s ASN 31 Ca -0.05 -0.11 -0.11 0.00 -1.57 0.00 0.00 52.86 51.02 2kzn s ASN 31 Cb 0.17 -1.16 -0.29 0.00 -0.02 0.00 0.00 41.25 39.94 2kzn s ASN 31 CO 0.67 0.27 0.57 -0.33 -2.57 0.00 0.00 177.10 175.71 2kzn h GLU 32 N 4.34 0.34 0.00 -0.60 3.07 -1.83 -3.38 114.58 116.52 2kzn h GLU 32 Ca -0.49 -0.59 -0.09 0.00 -0.50 0.00 0.00 59.36 57.69 2kzn h GLU 32 Cb 1.17 0.22 -0.01 0.00 -0.84 0.00 0.00 28.75 29.28 2kzn h GLU 32 CO 0.55 1.28 -0.84 1.88 -1.40 0.00 0.00 179.01 180.49 2kzn h TYR 33 N 0.04 0.00 -5.93 4.33 0.05 -1.96 -3.48 116.97 110.02 2kzn h TYR 33 Ca -0.36 0.00 -0.41 0.00 0.05 0.00 0.00 58.73 58.00 2kzn h TYR 33 Cb 2.04 0.00 0.11 0.00 1.01 0.00 0.00 36.73 39.89 2kzn h TYR 33 CO 0.10 0.37 -0.69 0.91 -1.05 0.00 0.00 178.16 177.79 2kzn n TRP 34 N -2.99 -2.79 -0.08 4.88 8.01 -1.26 -4.69 117.44 118.51 2kzn n TRP 34 Ca -0.02 1.00 -0.21 0.00 -1.31 0.00 0.00 57.50 56.96 2kzn n TRP 34 Cb 0.71 -4.86 -0.12 0.00 -2.01 0.00 0.00 31.31 25.03 2kzn n TRP 34 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.69 176.28 2kzn n ASP 35 N -2.99 2.01 -1.98 -0.99 5.75 -1.26 -4.83 116.55 112.26 2kzn n ASP 35 Ca 0.02 0.11 -0.13 0.00 -0.01 0.00 0.00 54.79 54.77 2kzn n ASP 35 Cb 0.55 -0.69 -0.03 0.00 -1.03 0.00 0.00 41.12 39.93 2kzn n ASP 35 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 2kzn n HIS 36 N -3.62 -0.92 0.41 2.11 8.25 -1.26 -4.81 115.22 115.37 2kzn n HIS 36 Ca -0.41 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.10 2kzn n HIS 36 Cb 0.96 -2.78 0.24 0.00 1.12 0.00 0.00 29.99 29.52 2kzn n HIS 36 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 2kzn n LYS 37 N -2.42 0.05 -1.63 -0.41 4.81 -1.26 -4.69 118.16 112.60 2kzn n LYS 37 Ca -0.15 0.28 -0.48 0.00 -0.87 0.00 0.00 58.31 57.09 2kzn n LYS 37 Cb 0.54 -1.50 -0.04 0.00 0.02 0.00 0.00 35.03 34.05 2kzn n LYS 37 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 2kzn n GLU 38 N -1.43 1.70 -1.53 1.64 4.07 -1.26 -4.49 120.64 119.33 2kzn n GLU 38 Ca 0.03 0.61 -0.53 0.00 -0.06 0.00 0.00 57.16 57.21 2kzn n GLU 38 Cb 0.11 -2.27 -0.07 0.00 -0.06 0.00 0.00 31.44 29.14 2kzn n GLU 38 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 2kzn n GLU 39 N 2.55 1.14 -3.30 5.31 1.02 -1.26 -4.60 120.64 121.50 2kzn n GLU 39 Ca 0.16 0.36 0.00 0.00 -0.02 0.00 0.00 57.16 57.66 2kzn n GLU 39 Cb 0.26 -2.31 0.00 0.00 -0.02 0.00 0.00 31.44 29.37 2kzn n GLU 39 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2kzn n GLY 40 N 5.71 -0.58 3.31 0.62 0.00 -1.26 -0.51 105.19 112.48 2kzn n GLY 40 Ca 0.36 -0.76 -0.19 0.00 0.00 0.00 0.00 46.02 45.43 2kzn n GLY 40 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2kzn s LEU 41 N 0.00 2.48 -0.31 0.99 1.43 -0.51 -2.31 118.68 120.44 2kzn s LEU 41 Ca 0.00 -0.91 -0.10 0.00 -1.03 0.00 0.00 54.13 52.09 2kzn s LEU 41 Cb 0.00 -0.68 -0.01 0.00 0.03 0.00 0.00 46.19 45.53 2kzn s LEU 41 CO 0.00 -0.13 0.17 -0.31 0.23 0.00 0.00 176.35 176.31 2kzn s TYR 42 N -2.46 3.19 0.09 0.29 2.02 -0.10 -1.87 117.35 118.50 2kzn s TYR 42 Ca 0.16 -0.43 0.07 0.00 -0.37 0.00 0.00 57.07 56.50 2kzn s TYR 42 Cb -0.03 -2.38 -0.03 0.00 -0.40 0.00 0.00 41.96 39.12 2kzn s TYR 42 CO 0.05 -0.41 -0.18 0.14 -1.57 0.00 0.00 175.55 173.59 2kzn s VAL 43 N 1.65 1.45 -0.45 0.71 -7.23 -0.92 -2.05 120.40 113.55 2kzn s VAL 43 Ca 0.05 -1.43 -0.29 0.00 -1.81 0.00 0.00 61.98 58.50 2kzn s VAL 43 Cb -0.17 -1.34 0.03 0.00 0.56 0.00 0.00 36.38 35.46 2kzn s VAL 43 CO 0.07 -0.13 1.19 -0.62 -0.31 0.00 0.00 175.10 175.30 2kzn s ASP 44 N -1.81 6.60 0.55 4.85 -1.08 -1.24 -0.82 116.67 123.72 2kzn s ASP 44 Ca 0.03 0.58 0.42 0.00 -0.52 0.00 0.00 52.55 53.05 2kzn s ASP 44 Cb -0.10 -2.55 1.61 0.00 -1.46 0.00 0.00 42.92 40.43 2kzn s ASP 44 CO 0.03 -1.26 1.70 0.40 0.52 0.00 0.00 175.17 176.56 2kzn h ILE 45 N 6.24 0.23 -0.06 4.11 2.04 -1.85 -0.49 117.51 127.73 2kzn h ILE 45 Ca -0.24 0.00 -0.18 0.00 1.00 0.00 0.00 64.86 65.45 2kzn h ILE 45 Cb 1.07 0.24 -0.01 0.00 -0.74 0.00 0.00 36.82 37.38 2kzn h ILE 45 CO 1.11 0.00 -0.71 -0.37 0.00 0.00 0.00 178.15 178.18 2kzn h VAL 46 N 0.00 1.40 0.00 1.67 -1.51 -1.90 -3.37 116.25 112.53 2kzn h VAL 46 Ca 0.71 -2.16 -0.24 0.00 -1.23 0.00 0.00 66.70 63.78 2kzn h VAL 46 Cb 2.88 2.13 -0.04 0.00 -2.13 0.00 0.00 31.29 34.12 2kzn h VAL 46 CO -0.01 0.64 -1.91 -0.24 -1.23 0.00 0.00 177.57 174.83 2kzn n SER 47 N -3.82 2.50 -2.33 4.19 2.88 -0.33 -5.02 113.62 111.69 2kzn n SER 47 Ca -0.04 -0.06 -0.13 0.00 -1.33 0.00 0.00 58.87 57.31 2kzn n SER 47 Cb 0.70 0.05 0.05 0.00 -0.75 0.00 0.00 64.21 64.25 2kzn n SER 47 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2kzn n GLY 48 N 2.58 0.06 3.48 0.46 0.00 -0.39 -5.06 105.19 106.33 2kzn n GLY 48 Ca -0.26 -0.14 -0.33 0.00 0.00 0.00 0.00 46.02 45.29 2kzn n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kzn s LYS 49 N -5.53 2.71 -0.03 1.61 -0.14 -1.26 -5.00 119.74 112.11 2kzn s LYS 49 Ca 0.26 -0.67 -0.30 0.00 -1.36 0.00 0.00 55.97 53.91 2kzn s LYS 49 Cb -0.12 -2.46 -0.06 0.00 -1.68 0.00 0.00 37.83 33.51 2kzn s LYS 49 CO 0.42 0.55 1.68 -1.25 -0.76 0.00 0.00 175.35 176.00 2kzn s PRO 50 N -0.54 4.18 -0.23 -1.68 0.04 -1.26 -3.62 135.00 131.90 2kzn s PRO 50 Ca 0.07 2.25 -0.05 0.00 0.04 0.00 0.00 61.00 63.32 2kzn s PRO 50 Cb -0.12 -3.94 -0.12 0.00 0.04 0.00 0.00 34.50 30.36 2kzn s PRO 50 CO 0.02 -0.84 -0.24 1.28 0.04 0.00 0.00 177.00 177.26 2kzn n LEU 51 N 6.92 2.34 -3.57 -3.56 4.77 -0.87 -4.53 117.00 118.50 2kzn n LEU 51 Ca 0.17 0.08 -0.06 0.00 -0.03 0.00 0.00 56.01 56.16 2kzn n LEU 51 Cb 0.42 -0.72 -0.03 0.00 -2.33 0.00 0.00 43.42 40.76 2kzn n LEU 51 CO 0.63 0.68 0.89 0.12 -1.33 0.00 0.00 177.39 178.38 2kzn s PHE 52 N -2.43 -0.22 0.20 -1.77 5.36 -1.19 -1.24 117.98 116.69 2kzn s PHE 52 Ca -0.31 0.19 -0.11 0.00 -0.96 0.00 0.00 56.93 55.75 2kzn s PHE 52 Cb 0.10 0.51 -0.07 0.00 -0.34 0.00 0.00 43.02 43.22 2kzn s PHE 52 CO 0.46 -0.32 0.54 -0.08 -1.46 0.00 0.00 175.22 174.36 2kzn s THR 53 N -2.38 4.93 -0.63 0.12 -1.32 -1.26 -0.92 115.64 114.18 2kzn s THR 53 Ca 0.06 0.55 0.25 0.00 -1.21 0.00 0.00 61.69 61.35 2kzn s THR 53 Cb -0.01 -3.65 0.27 0.00 -1.51 0.00 0.00 72.50 67.60 2kzn s THR 53 CO -0.05 0.03 1.66 -1.28 -2.21 0.00 0.00 174.62 172.76 2kzn h SER 54 N 2.86 0.00 0.59 8.08 0.87 -1.77 -3.29 113.55 120.90 2kzn h SER 54 Ca -0.47 -0.02 -0.01 0.00 -1.23 0.00 0.00 61.79 60.05 2kzn h SER 54 Cb 1.18 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.13 2kzn h SER 54 CO 0.68 0.01 -0.07 0.50 -0.53 0.00 0.00 176.83 177.43 2kzn h LYS 55 N 0.00 0.00 -0.74 2.24 3.64 -1.79 -2.85 116.57 117.07 2kzn h LYS 55 Ca 0.00 0.00 -0.54 0.00 -1.27 0.00 0.00 60.65 58.84 2kzn h LYS 55 Cb 0.82 0.00 -0.42 0.00 -0.41 0.00 0.00 32.23 32.22 2kzn h LYS 55 CO 0.00 0.07 -0.80 -3.47 -2.27 0.00 0.00 179.45 172.98 2kzn n ASP 56 N -3.30 4.89 -4.21 4.20 2.03 -1.24 -5.03 116.55 113.90 2kzn n ASP 56 Ca -0.01 -3.75 -0.20 0.00 0.52 0.00 0.00 54.79 51.35 2kzn n ASP 56 Cb 0.25 -0.35 -0.12 0.00 -0.72 0.00 0.00 41.12 40.18 2kzn n ASP 56 CO 0.00 0.00 0.00 -1.59 -1.92 0.00 0.00 177.20 173.69 2kzn s LYS 57 N -3.59 0.92 0.48 -0.67 0.00 -1.08 -4.93 119.74 110.87 2kzn s LYS 57 Ca 0.51 -1.03 0.04 0.00 0.00 0.00 0.00 55.97 55.49 2kzn s LYS 57 Cb 0.41 -0.99 -0.03 0.00 0.00 0.00 0.00 37.83 37.22 2kzn s LYS 57 CO 0.04 0.22 0.08 -0.06 0.00 0.00 0.00 175.35 175.63 2kzn s PHE 58 N -1.27 2.07 -0.08 1.78 0.08 -1.26 -5.00 117.98 114.29 2kzn s PHE 58 Ca 0.01 -0.83 -0.33 0.00 0.12 0.00 0.00 56.93 55.90 2kzn s PHE 58 Cb -0.10 -1.73 -0.11 0.00 -0.57 0.00 0.00 43.02 40.51 2kzn s PHE 58 CO 0.03 0.17 1.94 -0.40 -0.10 0.00 0.00 175.22 176.86 2kzn n ASP 59 N -1.27 3.56 -4.42 1.36 5.75 -1.26 -4.92 116.55 115.36 2kzn n ASP 59 Ca -0.11 0.89 -0.44 0.00 -0.01 0.00 0.00 54.79 55.12 2kzn n ASP 59 Cb 0.66 -1.41 -0.05 0.00 -1.03 0.00 0.00 41.12 39.29 2kzn n ASP 59 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 2kzn s SER 60 N 4.54 6.20 0.55 -1.12 1.04 -1.26 -4.91 113.70 118.74 2kzn s SER 60 Ca 0.93 -1.15 0.34 0.00 0.48 0.00 0.00 55.95 56.55 2kzn s SER 60 Cb -0.62 -2.33 1.44 0.00 0.10 0.00 0.00 66.02 64.61 2kzn s SER 60 CO 0.49 -1.15 2.01 0.06 0.98 0.00 0.00 173.24 175.62 2kzn h GLN 61 N 9.24 0.00 0.00 4.02 -0.00 -1.91 -2.46 115.11 124.00 2kzn h GLN 61 Ca -0.29 0.00 -0.01 0.00 -0.00 0.00 0.00 58.65 58.35 2kzn h GLN 61 Cb 1.08 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 28.56 2kzn h GLN 61 CO 1.09 0.00 -0.05 0.00 -0.00 0.00 0.00 178.83 179.87 2kzn n GLY 63 N 0.02 2.40 3.69 0.00 0.00 -0.93 -4.97 105.19 105.40 2kzn n GLY 63 Ca 0.00 -0.48 -0.42 0.00 0.00 0.00 0.00 46.02 45.12 2kzn n GLY 63 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2kzn s TRP 64 N 0.00 2.80 -0.20 1.61 0.51 -1.26 -4.88 118.94 117.52 2kzn s TRP 64 Ca 0.00 0.73 -0.30 0.00 -2.12 0.00 0.00 56.10 54.41 2kzn s TRP 64 Cb 0.00 -3.72 -0.07 0.00 -0.81 0.00 0.00 33.47 28.87 2kzn s TRP 64 CO 0.00 -2.71 2.16 -2.30 -0.51 0.00 0.00 176.95 173.59 2kzn n PRO 65 N 5.32 1.94 -4.21 4.98 -0.02 -1.21 -4.72 135.00 137.07 2kzn n PRO 65 Ca 0.14 0.58 -0.34 0.00 -2.02 0.00 0.00 63.50 61.85 2kzn n PRO 65 Cb 0.43 -3.02 -0.10 0.00 -0.02 0.00 0.00 33.50 30.78 2kzn n PRO 65 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2kzn s SER 66 N 7.32 5.30 0.19 2.55 1.04 -1.26 -1.53 113.70 127.30 2kzn s SER 66 Ca 1.00 0.04 0.07 0.00 0.48 0.00 0.00 55.95 57.55 2kzn s SER 66 Cb -0.47 -1.80 -0.04 0.00 0.10 0.00 0.00 66.02 63.81 2kzn s SER 66 CO 0.40 0.23 -0.15 -0.36 0.98 0.00 0.00 173.24 174.34 2kzn s PHE 67 N 0.03 1.66 -0.53 5.02 0.08 0.44 -4.89 117.98 119.79 2kzn s PHE 67 Ca 0.03 -0.57 0.24 0.00 0.12 0.00 0.00 56.93 56.75 2kzn s PHE 67 Cb -0.13 -0.79 0.21 0.00 -0.57 0.00 0.00 43.02 41.75 2kzn s PHE 67 CO 0.02 0.31 1.21 1.79 -0.10 0.00 0.00 175.22 178.45 2kzn h THR 68 N 2.76 0.00 -2.91 0.64 1.35 -1.87 0.82 112.91 113.70 2kzn h THR 68 Ca -0.39 -0.62 -0.10 0.00 -0.55 0.00 0.00 66.41 64.75 2kzn h THR 68 Cb 1.21 1.14 -0.19 0.00 -1.73 0.00 0.00 68.15 68.59 2kzn h THR 68 CO 0.60 0.00 -0.17 -1.59 -0.25 0.00 0.00 175.52 174.10 2kzn s LYS 69 N -3.22 0.79 0.57 4.72 -2.85 -1.26 -3.69 119.74 114.79 2kzn s LYS 69 Ca 0.04 -0.19 0.09 0.00 -1.00 0.00 0.00 55.97 54.91 2kzn s LYS 69 Cb 0.12 0.35 0.09 0.00 -2.06 0.00 0.00 37.83 36.34 2kzn s LYS 69 CO 0.75 -0.24 0.75 -0.35 0.10 0.00 0.00 175.35 176.36 2kzn n PRO 70 N 1.00 0.62 -3.18 1.78 -0.04 -1.26 -4.88 135.00 129.03 2kzn n PRO 70 Ca -0.20 -3.12 -0.41 0.00 -0.04 0.00 0.00 63.50 59.73 2kzn n PRO 70 Cb 0.57 -0.17 -0.07 0.00 -0.04 0.00 0.00 33.50 33.79 2kzn n PRO 70 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2kzn s ILE 71 N -2.57 4.97 0.50 0.52 1.01 -0.37 -4.98 121.20 120.28 2kzn s ILE 71 Ca 0.57 0.57 0.19 0.00 0.00 0.00 0.00 60.65 61.97 2kzn s ILE 71 Cb -0.05 -3.98 0.26 0.00 0.01 0.00 0.00 42.46 38.70 2kzn s ILE 71 CO 0.36 -0.19 2.11 1.05 0.00 0.00 0.00 174.94 178.28 2kzn h GLU 72 N 8.36 0.00 -0.07 2.79 4.11 -1.89 -2.29 114.58 125.58 2kzn h GLU 72 Ca -0.27 0.00 -0.05 0.00 0.07 0.00 0.00 59.36 59.11 2kzn h GLU 72 Cb 1.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.37 2kzn h GLU 72 CO 0.79 0.07 -0.15 0.93 0.07 0.00 0.00 179.01 180.71 2kzn h GLU 73 N 0.00 0.22 0.00 1.06 4.39 -1.94 -3.36 114.58 114.96 2kzn h GLU 73 Ca -0.00 -0.15 0.00 0.00 0.34 0.00 0.00 59.36 59.55 2kzn h GLU 73 Cb 0.13 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.80 2kzn h GLU 73 CO 0.01 0.75 -1.41 0.39 -1.16 0.00 0.00 179.01 177.59 2kzn n GLU 74 N -4.60 0.43 -3.84 2.33 -0.58 -1.14 -4.91 120.64 108.33 2kzn n GLU 74 Ca -0.08 -0.09 -0.36 0.00 -0.42 0.00 0.00 57.16 56.21 2kzn n GLU 74 Cb 0.39 -1.48 -0.07 0.00 -0.57 0.00 0.00 31.44 29.71 2kzn n GLU 74 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 2kzn s VAL 75 N -3.16 5.48 -0.11 2.62 1.01 -0.88 -4.56 120.40 120.81 2kzn s VAL 75 Ca 0.01 0.20 -0.00 0.00 0.00 0.00 0.00 61.98 62.19 2kzn s VAL 75 Cb 0.15 -3.42 0.02 0.00 0.00 0.00 0.00 36.38 33.13 2kzn s VAL 75 CO 0.85 0.57 -0.08 -0.70 0.00 0.00 0.00 175.10 175.74 2kzn s GLU 76 N -0.64 1.54 -0.02 2.72 2.56 -1.26 -4.77 118.70 118.84 2kzn s GLU 76 Ca 0.13 -0.28 -0.22 0.00 0.00 0.00 0.00 54.97 54.60 2kzn s GLU 76 Cb -0.12 -1.55 -0.05 0.00 2.00 0.00 0.00 34.13 34.41 2kzn s GLU 76 CO 0.02 -0.22 0.67 -1.83 -0.56 0.00 0.00 175.26 173.34 2kzn s GLU 77 N 1.54 4.40 -0.24 4.30 -1.05 -1.26 -0.79 118.70 125.60 2kzn s GLU 77 Ca 0.02 0.85 -0.01 0.00 -0.15 0.00 0.00 54.97 55.68 2kzn s GLU 77 Cb -0.13 -3.39 0.07 0.00 -0.44 0.00 0.00 34.13 30.24 2kzn s GLU 77 CO -0.06 0.24 0.02 0.15 0.95 0.00 0.00 175.26 176.56 2kzn s LYS 78 N 0.20 1.02 0.10 -4.83 -0.14 0.59 -4.97 119.74 111.72 2kzn s LYS 78 Ca 0.35 -0.82 -0.31 0.00 -1.36 0.00 0.00 55.97 53.83 2kzn s LYS 78 Cb -0.18 -2.28 -0.08 0.00 -1.68 0.00 0.00 37.83 33.61 2kzn s LYS 78 CO 0.19 -0.72 1.38 -1.17 -0.76 0.00 0.00 175.35 174.27 2kzn s LEU 79 N 1.61 4.37 -0.28 3.17 2.96 -1.26 -0.92 118.68 128.33 2kzn s LEU 79 Ca 0.00 2.30 -0.01 0.00 -0.22 0.00 0.00 54.13 56.20 2kzn s LEU 79 Cb -0.18 -3.58 0.04 0.00 0.50 0.00 0.00 46.19 42.97 2kzn s LEU 79 CO -0.11 -0.65 -0.03 -0.62 -1.32 0.00 0.00 176.35 173.62 2kzn s ASP 80 N 1.16 4.69 -0.42 3.68 2.15 -0.11 -4.94 116.67 122.88 2kzn s ASP 80 Ca 0.64 -1.16 0.04 0.00 0.43 0.00 0.00 52.55 52.50 2kzn s ASP 80 Cb -0.36 -1.68 0.17 0.00 -0.30 0.00 0.00 42.92 40.75 2kzn s ASP 80 CO 0.30 -0.22 0.37 0.42 -0.17 0.00 0.00 175.17 175.87 2kzn s THR 81 N 1.26 0.24 -0.10 1.71 -4.23 -1.26 -1.49 115.64 111.77 2kzn s THR 81 Ca -0.04 -2.53 -0.05 0.00 -1.18 0.00 0.00 61.69 57.89 2kzn s THR 81 Cb -0.19 -1.16 -0.04 0.00 1.34 0.00 0.00 72.50 72.45 2kzn s THR 81 CO -0.02 -1.15 0.15 0.28 -0.54 0.00 0.00 174.62 173.33 2kzn h SER 82 N 5.59 -0.04 -2.43 3.99 0.02 -1.97 -3.49 113.55 115.22 2kzn h SER 82 Ca 0.25 -0.12 0.15 0.00 -0.84 0.00 0.00 61.79 61.24 2kzn h SER 82 Cb 0.92 0.01 -0.30 0.00 0.14 0.00 0.00 62.40 63.17 2kzn h SER 82 CO 0.34 0.52 0.61 -2.28 -1.14 0.00 0.00 176.83 174.88 2kzn s HIS 83 N -1.79 -0.30 0.00 3.45 5.65 -1.26 -5.04 115.29 116.00 2kzn s HIS 83 Ca -0.03 0.64 0.00 0.00 0.25 0.00 0.00 55.06 55.92 2kzn s HIS 83 Cb -0.00 0.29 0.00 0.00 -1.18 0.00 0.00 32.58 31.68 2kzn s HIS 83 CO 0.10 -0.15 0.00 0.41 -0.65 0.00 0.00 174.74 174.46 2kzn n GLY 84 N 2.81 2.79 2.93 1.59 0.00 -1.26 -4.93 105.19 109.13 2kzn n GLY 84 Ca -0.15 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.74 2kzn n GLY 84 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2kzn s MET 85 N -0.09 0.08 -0.14 1.61 1.00 -1.26 -5.15 119.30 115.35 2kzn s MET 85 Ca 0.00 0.14 -0.11 0.00 0.00 0.00 0.00 55.69 55.72 2kzn s MET 85 Cb 0.00 -0.01 -0.05 0.00 0.00 0.00 0.00 34.83 34.77 2kzn s MET 85 CO 0.00 -0.04 0.23 -1.50 0.00 0.00 0.00 175.02 173.71 2kzn s ILE 86 N 0.27 5.35 0.11 2.53 -1.16 -1.26 -4.49 121.20 122.55 2kzn s ILE 86 Ca -0.02 0.42 -0.05 0.00 -0.51 0.00 0.00 60.65 60.49 2kzn s ILE 86 Cb -0.03 -3.54 -0.02 0.00 0.61 0.00 0.00 42.46 39.47 2kzn s ILE 86 CO -0.01 0.49 0.12 -0.13 -2.81 0.00 0.00 174.94 172.60 2kzn s ARG 87 N -0.15 0.90 0.03 3.50 3.00 -0.55 -4.98 118.95 120.69 2kzn s ARG 87 Ca 0.15 -1.23 0.04 0.00 0.00 0.00 0.00 55.73 54.69 2kzn s ARG 87 Cb -0.13 0.29 -0.02 0.00 0.00 0.00 0.00 34.95 35.10 2kzn s ARG 87 CO 0.04 -0.27 -0.12 0.99 0.00 0.00 0.00 175.30 175.94 2kzn s THR 88 N -3.96 0.90 -0.01 0.02 2.01 -1.12 -0.94 115.64 112.54 2kzn s THR 88 Ca 0.15 -0.82 0.02 0.00 0.31 0.00 0.00 61.69 61.34 2kzn s THR 88 Cb 0.06 -0.82 -0.00 0.00 0.01 0.00 0.00 72.50 71.75 2kzn s THR 88 CO -0.04 0.01 -0.06 -1.83 -0.69 0.00 0.00 174.62 172.01 2kzn s GLU 89 N -0.92 0.54 -0.24 4.92 -1.05 -0.09 -1.06 118.70 120.79 2kzn s GLU 89 Ca 0.00 -0.20 -0.13 0.00 -0.15 0.00 0.00 54.97 54.49 2kzn s GLU 89 Cb -0.07 -0.53 -0.04 0.00 -0.44 0.00 0.00 34.13 33.05 2kzn s GLU 89 CO 0.01 0.10 0.27 0.14 0.95 0.00 0.00 175.26 176.73 2kzn s VAL 90 N 0.00 5.27 -0.29 1.83 -7.23 -0.57 -0.30 120.40 119.11 2kzn s VAL 90 Ca 0.00 0.39 -0.15 0.00 -1.81 0.00 0.00 61.98 60.41 2kzn s VAL 90 Cb -0.04 -3.60 0.12 0.00 0.56 0.00 0.00 36.38 33.41 2kzn s VAL 90 CO -0.00 0.27 0.81 0.00 -0.31 0.00 0.00 175.10 175.86 2kzn s ARG 91 N 1.46 0.55 0.72 4.82 1.70 0.03 -2.49 118.95 125.75 2kzn s ARG 91 Ca 0.12 1.02 -0.03 0.00 -0.47 0.00 0.00 55.73 56.37 2kzn s ARG 91 Cb -0.15 0.22 0.12 0.00 -0.57 0.00 0.00 34.95 34.57 2kzn s ARG 91 CO 0.08 -0.13 1.00 0.45 -1.08 0.00 0.00 175.30 175.62 2kzn s SER 92 N 1.74 4.39 -0.04 -2.89 0.15 -1.04 -4.37 113.70 111.64 2kzn s SER 92 Ca -0.09 -0.15 -0.15 0.00 0.70 0.00 0.00 55.95 56.26 2kzn s SER 92 Cb -0.05 -0.29 -0.09 0.00 -1.71 0.00 0.00 66.02 63.88 2kzn s SER 92 CO -0.18 -1.83 0.63 0.03 1.20 0.00 0.00 173.24 173.08 2kzn h ARG 93 N -0.58 -0.43 0.07 5.44 2.47 -1.93 -3.12 114.38 116.30 2kzn h ARG 93 Ca -0.39 0.03 -0.00 0.00 -1.26 0.00 0.00 59.98 58.36 2kzn h ARG 93 Cb 1.27 0.10 0.00 0.00 -1.65 0.00 0.00 29.97 29.69 2kzn h ARG 93 CO 0.44 -0.22 -0.03 1.15 0.56 0.00 0.00 179.97 181.87 2kzn h THR 94 N -1.08 0.00 0.00 2.04 2.02 -2.01 -3.45 112.91 110.43 2kzn h THR 94 Ca -0.05 -0.33 -0.00 0.00 0.77 0.00 0.00 66.41 66.80 2kzn h THR 94 Cb 0.41 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 66.82 2kzn h THR 94 CO 0.07 0.00 -1.02 0.00 0.37 0.00 0.00 175.52 174.95 2kzn n ALA 95 N -2.31 1.99 0.76 6.16 0.00 -1.26 -4.77 120.51 121.08 2kzn n ALA 95 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.41 2kzn n ALA 95 Cb 0.04 0.37 0.00 0.00 0.00 0.00 0.00 19.45 19.86 2kzn n ALA 95 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2kzn n ASP 96 N -2.27 0.40 0.33 0.00 9.92 -1.26 -4.07 116.55 119.60 2kzn n ASP 96 Ca -0.00 -1.16 0.22 0.00 -0.53 0.00 0.00 54.79 53.31 2kzn n ASP 96 Cb 0.51 -0.20 1.17 0.00 -0.64 0.00 0.00 41.12 41.96 2kzn n ASP 96 CO 0.00 0.00 0.00 0.28 0.13 0.00 0.00 177.20 177.61 2kzn h SER 97 N 0.29 0.00 0.10 -2.24 0.02 -1.84 -2.73 113.55 107.14 2kzn h SER 97 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2kzn h SER 97 Cb 0.20 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.74 2kzn h SER 97 CO 0.00 0.00 -0.01 1.41 -1.14 0.00 0.00 176.83 177.09 2kzn n HIS 98 N -3.21 0.00 0.00 3.45 8.25 -1.26 -4.62 115.22 117.83 2kzn n HIS 98 Ca -0.03 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.43 2kzn n HIS 98 Cb 0.07 -0.05 0.00 0.00 1.12 0.00 0.00 29.99 31.13 2kzn n HIS 98 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2kzn n LEU 99 N -0.82 0.00 0.00 2.41 4.77 -1.20 -4.63 117.00 117.53 2kzn n LEU 99 Ca 0.21 0.78 0.00 0.00 -0.03 0.00 0.00 56.01 56.97 2kzn n LEU 99 Cb 0.19 -0.28 0.00 0.00 -2.33 0.00 0.00 43.42 40.99 2kzn n LEU 99 CO 0.19 -0.28 0.00 0.61 -1.33 0.00 0.00 177.39 176.58 2kzn n GLY 100 N -0.92 -0.63 3.20 -0.72 0.00 -1.04 -1.86 105.19 103.24 2kzn n GLY 100 Ca 0.00 -0.99 -0.21 0.00 0.00 0.00 0.00 46.02 44.83 2kzn n GLY 100 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2kzn s HIS 101 N -3.00 1.42 -0.00 1.61 3.76 -0.93 -1.52 115.29 116.63 2kzn s HIS 101 Ca 0.00 -0.42 0.03 0.00 -0.15 0.00 0.00 55.06 54.51 2kzn s HIS 101 Cb 0.00 -0.80 -0.01 0.00 1.11 0.00 0.00 32.58 32.88 2kzn s HIS 101 CO 0.00 0.10 -0.09 0.14 -0.85 0.00 0.00 174.74 174.04 2kzn s VAL 102 N -1.14 0.72 0.12 -0.90 -7.23 -0.23 -2.91 120.40 108.83 2kzn s VAL 102 Ca 0.02 -0.46 0.10 0.00 -1.81 0.00 0.00 61.98 59.83 2kzn s VAL 102 Cb -0.10 -0.61 -0.04 0.00 0.56 0.00 0.00 36.38 36.19 2kzn s VAL 102 CO 0.03 0.15 -0.26 0.12 -0.31 0.00 0.00 175.10 174.83 2kzn s PHE 103 N -0.31 2.20 -1.64 2.82 2.19 -1.24 -2.80 117.98 119.20 2kzn s PHE 103 Ca 0.03 -0.39 0.03 0.00 0.33 0.00 0.00 56.93 56.93 2kzn s PHE 103 Cb -0.04 -1.20 0.12 0.00 -1.31 0.00 0.00 43.02 40.59 2kzn s PHE 103 CO -0.00 0.31 0.97 0.09 1.83 0.00 0.00 175.22 178.41 2kzn n ASN 104 N 0.96 1.02 0.04 6.13 5.03 -1.26 -2.08 115.26 125.11 2kzn n ASN 104 Ca -0.18 -2.05 -0.04 0.00 0.87 0.00 0.00 54.58 53.18 2kzn n ASN 104 Cb 0.53 -0.23 -0.09 0.00 -1.02 0.00 0.00 39.78 38.98 2kzn n ASN 104 CO 0.00 0.00 0.00 -0.78 -1.83 0.00 0.00 177.26 174.65 2kzn h ASP 105 N 0.70 0.00 -3.36 6.41 3.58 -1.94 -3.46 116.42 118.35 2kzn h ASP 105 Ca 0.00 0.00 -0.53 0.00 0.42 0.00 0.00 57.03 56.92 2kzn h ASP 105 Cb 0.35 0.00 0.05 0.00 1.72 0.00 0.00 39.33 41.45 2kzn h ASP 105 CO 0.03 0.78 0.73 -0.83 -2.88 0.00 0.00 179.24 177.07 2kzn s GLY 106 N -4.80 2.33 -0.06 -0.78 0.00 -1.04 -4.99 107.32 97.98 2kzn s GLY 106 Ca -0.01 1.26 -0.26 0.00 0.00 0.00 0.00 44.72 45.71 2kzn s GLY 106 CO 0.80 2.23 0.83 2.56 0.00 0.00 0.00 173.10 179.53 2kzn s PRO 107 N -0.24 4.45 -0.06 2.90 0.04 -1.26 -3.42 135.00 137.42 2kzn s PRO 107 Ca 0.59 1.11 -0.31 0.00 0.04 0.00 0.00 61.00 62.43 2kzn s PRO 107 Cb -0.40 -3.48 0.13 0.00 0.04 0.00 0.00 34.50 30.79 2kzn s PRO 107 CO 0.41 -0.06 1.37 0.20 0.04 0.00 0.00 177.00 178.96 2kzn s GLY 108 N 0.95 -0.40 0.56 0.56 0.00 -1.26 -4.59 107.32 103.14 2kzn s GLY 108 Ca 0.43 0.67 0.24 0.00 0.00 0.00 0.00 44.72 46.06 2kzn s GLY 108 CO 0.20 1.64 2.13 -2.55 0.00 0.00 0.00 173.10 174.52 2kzn h PRO 109 N 2.00 0.00 0.00 2.90 0.11 -1.91 -1.81 132.00 133.29 2kzn h PRO 109 Ca -0.30 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.75 2kzn h PRO 109 Cb 1.19 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 2kzn h PRO 109 CO 0.30 0.00 -1.09 -2.95 -0.21 0.00 0.00 178.00 174.05 2kzn h ASN 110 N 0.00 0.00 0.00 -2.05 -1.07 -1.96 -3.48 115.58 107.02 2kzn h ASN 110 Ca 0.07 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.44 2kzn h ASN 110 Cb 0.33 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.58 2kzn h ASN 110 CO -0.00 0.24 0.00 0.61 0.07 0.00 0.00 177.43 178.35 2kzn n GLY 111 N 1.26 0.70 3.85 9.14 0.00 -0.68 -5.05 105.19 114.42 2kzn n GLY 111 Ca -0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.70 2kzn n GLY 111 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2kzn s LEU 112 N 0.00 2.55 -0.27 0.99 1.43 -1.22 -4.37 118.68 117.79 2kzn s LEU 112 Ca 0.00 -1.40 0.01 0.00 -1.03 0.00 0.00 54.13 51.72 2kzn s LEU 112 Cb 0.00 -1.02 0.07 0.00 0.03 0.00 0.00 46.19 45.27 2kzn s LEU 112 CO 0.00 -1.02 -0.02 0.00 0.23 0.00 0.00 176.35 175.54 2kzn s ARG 113 N -4.14 1.56 -0.85 1.70 1.70 -0.88 -4.14 118.95 113.90 2kzn s ARG 113 Ca 0.24 -1.21 -0.25 0.00 -0.47 0.00 0.00 55.73 54.04 2kzn s ARG 113 Cb -0.01 -2.67 -0.06 0.00 -0.57 0.00 0.00 34.95 31.64 2kzn s ARG 113 CO 0.14 -0.70 2.01 -0.47 -1.08 0.00 0.00 175.30 175.21 2kzn s TYR 114 N 1.29 1.68 -0.39 5.89 5.04 0.28 -3.71 117.35 127.44 2kzn s TYR 114 Ca -0.01 0.86 -0.02 0.00 -2.44 0.00 0.00 57.07 55.46 2kzn s TYR 114 Cb -0.19 -3.95 0.10 0.00 0.35 0.00 0.00 41.96 38.27 2kzn s TYR 114 CO -0.09 -1.79 0.16 0.00 -1.34 0.00 0.00 175.55 172.49 2kzn s ILE 116 N 1.12 4.24 -0.19 0.00 -1.09 -0.59 -2.20 121.20 122.50 2kzn s ILE 116 Ca 0.07 -0.86 -0.29 0.00 -2.23 0.00 0.00 60.65 57.34 2kzn s ILE 116 Cb -0.22 -3.02 -0.03 0.00 -1.58 0.00 0.00 42.46 37.62 2kzn s ILE 116 CO -0.04 0.15 1.56 0.20 -1.23 0.00 0.00 174.94 175.58 2kzn s ASN 117 N -2.26 6.52 0.51 3.58 0.01 -0.78 -3.34 114.94 119.18 2kzn s ASN 117 Ca 0.27 1.72 0.16 0.00 -0.71 0.00 0.00 52.86 54.29 2kzn s ASN 117 Cb -0.12 -2.53 1.25 0.00 0.41 0.00 0.00 41.25 40.26 2kzn s ASN 117 CO 0.19 -1.13 2.14 0.77 -1.51 0.00 0.00 177.10 177.56 2kzn h SER 118 N 10.12 0.00 0.88 -1.22 4.64 -1.89 -2.22 113.55 123.87 2kzn h SER 118 Ca -0.33 -0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 60.88 2kzn h SER 118 Cb 1.15 -0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.22 2kzn h SER 118 CO 0.99 0.01 -0.51 0.00 -0.87 0.00 0.00 176.83 176.46 2kzn h ALA 119 N 1.99 0.89 0.00 5.18 0.00 -1.89 -3.19 119.26 122.23 2kzn h ALA 119 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2kzn h ALA 119 Cb 0.02 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2kzn h ALA 119 CO 0.00 0.64 -0.05 0.00 0.00 0.00 0.00 179.25 179.84 2kzn n ALA 120 N -2.32 2.35 -2.56 0.00 0.00 -0.84 -4.78 120.51 112.36 2kzn n ALA 120 Ca -0.00 -0.06 -0.27 0.00 0.00 0.00 0.00 53.44 53.11 2kzn n ALA 120 Cb 0.60 -1.44 -0.02 0.00 0.00 0.00 0.00 19.45 18.59 2kzn n ALA 120 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2kzn s LEU 121 N -4.21 4.03 -0.09 0.00 1.43 -1.21 -3.02 118.68 115.60 2kzn s LEU 121 Ca 0.11 0.63 -0.01 0.00 -1.03 0.00 0.00 54.13 53.83 2kzn s LEU 121 Cb 0.14 -3.47 0.03 0.00 0.03 0.00 0.00 46.19 42.92 2kzn s LEU 121 CO 0.59 -0.24 -0.04 -0.60 0.23 0.00 0.00 176.35 176.30 2kzn s ARG 122 N -3.84 1.10 -0.16 1.70 3.52 -0.00 -4.80 118.95 116.46 2kzn s ARG 122 Ca 0.43 -0.09 -0.29 0.00 -0.13 0.00 0.00 55.73 55.65 2kzn s ARG 122 Cb -0.10 -1.31 -0.01 0.00 -1.56 0.00 0.00 34.95 31.97 2kzn s ARG 122 CO 0.33 -0.29 1.17 -0.59 -0.81 0.00 0.00 175.30 175.11 2kzn s PHE 123 N 1.83 3.09 -0.33 5.12 -0.71 -1.26 -2.17 117.98 123.55 2kzn s PHE 123 Ca 0.05 1.22 0.03 0.00 -1.04 0.00 0.00 56.93 57.19 2kzn s PHE 123 Cb -0.12 -3.40 0.10 0.00 -1.21 0.00 0.00 43.02 38.38 2kzn s PHE 123 CO -0.07 -1.17 0.05 0.08 -1.34 0.00 0.00 175.22 172.77 2kzn s VAL 124 N 3.10 2.03 0.83 -2.49 1.01 -0.78 -4.98 120.40 119.12 2kzn s VAL 124 Ca 0.51 -2.15 -0.11 0.00 0.00 0.00 0.00 61.98 60.24 2kzn s VAL 124 Cb -0.20 -2.49 0.09 0.00 0.00 0.00 0.00 36.38 33.79 2kzn s VAL 124 CO 0.13 -0.58 1.09 -2.84 0.00 0.00 0.00 175.10 172.90 2kzn s PRO 125 N 1.04 1.75 0.32 2.72 0.02 -1.26 -1.42 135.00 138.16 2kzn s PRO 125 Ca 0.10 0.99 0.09 0.00 0.02 0.00 0.00 61.00 62.20 2kzn s PRO 125 Cb -0.19 -1.85 0.86 0.00 0.02 0.00 0.00 34.50 33.34 2kzn s PRO 125 CO -0.11 -1.94 1.74 1.57 -0.33 0.00 0.00 177.00 177.92 2kzn h LYS 126 N -1.34 0.59 0.00 5.54 2.10 -1.14 0.17 116.57 122.49 2kzn h LYS 126 Ca -0.46 -0.04 -0.07 0.00 -2.00 0.00 0.00 60.65 58.08 2kzn h LYS 126 Cb 1.26 -0.13 -0.01 0.00 -0.90 0.00 0.00 32.23 32.44 2kzn h LYS 126 CO 0.53 0.39 -0.35 1.25 -2.00 0.00 0.00 179.45 179.27 2kzn h HIS 127 N 0.61 0.00 0.00 0.07 2.76 -1.92 -2.95 115.15 113.72 2kzn h HIS 127 Ca 0.63 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.80 2kzn h HIS 127 Cb 1.17 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.13 2kzn h HIS 127 CO -0.01 0.35 -1.85 1.17 -1.30 0.00 0.00 177.93 176.29 2kzn n LYS 128 N -3.82 0.61 0.01 5.26 4.81 0.07 -4.29 118.16 120.81 2kzn n LYS 128 Ca -0.01 -0.16 -0.11 0.00 -0.87 0.00 0.00 58.31 57.16 2kzn n LYS 128 Cb 0.42 -1.55 -0.05 0.00 0.02 0.00 0.00 35.03 33.88 2kzn n LYS 128 CO 0.00 0.00 0.00 -0.07 1.17 0.00 0.00 177.40 178.50 2kzn h LEU 129 N 0.00 -0.10 -1.74 3.14 3.38 -0.58 -0.30 115.31 119.11 2kzn h LEU 129 Ca 0.00 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 2kzn h LEU 129 Cb 0.97 0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.77 2kzn h LEU 129 CO 0.00 -0.04 -0.12 0.07 0.09 0.00 0.00 178.44 178.44 2kzn h LYS 130 N -0.02 0.00 -0.03 1.13 2.10 -1.76 0.10 116.57 118.09 2kzn h LYS 130 Ca 0.04 0.00 -0.12 0.00 -2.00 0.00 0.00 60.65 58.57 2kzn h LYS 130 Cb 0.08 0.00 0.01 0.00 -0.90 0.00 0.00 32.23 31.42 2kzn h LYS 130 CO -0.09 0.12 -0.46 1.49 -2.00 0.00 0.00 179.45 178.52 2kzn h GLU 131 N 0.00 0.37 -0.57 0.07 4.81 -1.63 -3.33 114.58 114.30 2kzn h GLU 131 Ca -0.00 -0.35 0.00 0.00 -0.13 0.00 0.00 59.36 58.88 2kzn h GLU 131 Cb 0.44 0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.90 2kzn h GLU 131 CO 0.02 1.02 0.00 0.39 -0.73 0.00 0.00 179.01 179.70 2kzn n GLU 132 N -4.32 2.63 -2.66 1.92 -0.58 -0.16 -4.93 120.64 112.54 2kzn n GLU 132 Ca -0.09 -1.92 -0.06 0.00 -0.42 0.00 0.00 57.16 54.66 2kzn n GLU 132 Cb 0.59 -1.59 0.02 0.00 -0.57 0.00 0.00 31.44 29.89 2kzn n GLU 132 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2kzn n GLY 133 N 1.04 0.47 1.66 0.62 0.00 -0.49 -4.96 105.19 103.53 2kzn n GLY 133 Ca 0.18 -0.47 -0.15 0.00 0.00 0.00 0.00 46.02 45.57 2kzn n GLY 133 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2kzn n TYR 134 N -3.34 2.02 0.30 1.61 4.01 -0.10 -4.72 117.16 116.93 2kzn n TYR 134 Ca -0.01 -1.96 0.20 0.00 -0.16 0.00 0.00 57.90 55.96 2kzn n TYR 134 Cb 0.52 -0.71 1.06 0.00 -0.31 0.00 0.00 39.34 39.90 2kzn n TYR 134 CO 0.00 0.00 0.00 1.05 -0.46 0.00 0.00 176.86 177.45 2kzn h GLU 135 N 1.31 0.00 -0.47 -0.72 4.11 -1.89 -1.43 114.58 115.49 2kzn h GLU 135 Ca 0.38 0.00 0.03 0.00 0.07 0.00 0.00 59.36 59.84 2kzn h GLU 135 Cb 1.75 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.96 2kzn h GLU 135 CO 0.76 0.00 0.27 0.66 0.07 0.00 0.00 179.01 180.77 2kzn h SER 136 N 0.00 0.43 0.45 3.06 4.64 -1.96 -2.78 113.55 117.38 2kzn h SER 136 Ca 0.00 0.01 -0.17 0.00 -0.47 0.00 0.00 61.79 61.15 2kzn h SER 136 Cb 0.05 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.05 2kzn h SER 136 CO 0.00 0.30 -0.74 0.22 -0.87 0.00 0.00 176.83 175.74 2kzn h TYR 137 N 0.54 0.33 -0.03 4.77 3.20 -1.66 -2.23 116.97 121.90 2kzn h TYR 137 Ca 0.19 -0.15 0.01 0.00 3.14 0.00 0.00 58.73 61.92 2kzn h TYR 137 Cb 0.04 -0.05 -0.00 0.00 1.54 0.00 0.00 36.73 38.26 2kzn h TYR 137 CO -0.08 0.90 0.11 -0.07 -1.64 0.00 0.00 178.16 177.38 2kzn h LEU 138 N 0.16 0.00 0.15 2.82 4.07 -1.40 0.27 115.31 121.39 2kzn h LEU 138 Ca -0.03 0.00 -0.25 0.00 0.08 0.00 0.00 57.88 57.68 2kzn h LEU 138 Cb 1.31 0.00 0.02 0.00 1.08 0.00 0.00 40.66 43.07 2kzn h LEU 138 CO 0.12 0.00 -1.17 -0.74 -1.08 0.00 0.00 178.44 175.56 2kzn h HIS 139 N 0.00 0.59 0.03 1.13 -0.00 -1.20 -3.35 115.15 112.36 2kzn h HIS 139 Ca 0.01 -0.43 -0.00 0.00 -0.00 0.00 0.00 60.37 59.95 2kzn h HIS 139 Cb 0.24 -0.02 0.00 0.00 -0.00 0.00 0.00 27.41 27.63 2kzn h HIS 139 CO 0.00 1.45 -0.02 -0.07 -0.00 0.00 0.00 177.93 179.30 2kzn h LEU 140 N -0.24 -0.04 -0.12 0.26 3.38 0.06 -2.83 115.31 115.79 2kzn h LEU 140 Ca -0.23 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.63 2kzn h LEU 140 Cb 1.79 0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.55 2kzn h LEU 140 CO 0.14 0.09 0.00 2.19 0.09 0.00 0.00 178.44 180.96 2kzn h PHE 141 N -0.17 0.00 -3.73 1.13 -0.00 -1.41 -3.46 116.94 109.31 2kzn h PHE 141 Ca -0.00 0.00 -0.49 0.00 -0.00 0.00 0.00 57.97 57.47 2kzn h PHE 141 Cb 0.15 0.00 -0.03 0.00 -0.00 0.00 0.00 35.95 36.08 2kzn h PHE 141 CO -0.03 0.00 0.19 1.21 -0.00 0.00 0.00 178.31 179.67 2kzn s ASN 142 N -5.13 7.05 0.39 -0.68 2.47 -1.07 -4.98 114.94 113.00 2kzn s ASN 142 Ca 0.09 1.52 0.10 0.00 0.42 0.00 0.00 52.86 54.98 2kzn s ASN 142 Cb 0.09 -2.46 0.81 0.00 -1.45 0.00 0.00 41.25 38.24 2kzn s ASN 142 CO 0.60 -0.08 1.93 0.07 -3.72 0.00 0.00 177.10 175.90 2kzn h LYS 143 N 2.96 0.23 -6.74 0.43 2.10 -1.89 -3.44 116.57 110.21 2kzn h LYS 143 Ca -0.48 -0.05 -0.51 0.00 -2.00 0.00 0.00 60.65 57.61 2kzn h LYS 143 Cb 1.19 -0.03 0.01 0.00 -0.90 0.00 0.00 32.23 32.50 2kzn h LYS 143 CO 0.65 0.36 0.48 -0.51 -2.00 0.00 0.00 179.45 178.42 2kzn s LEU 144 N -8.79 4.52 0.00 7.07 1.43 -1.26 -5.06 118.68 116.59 2kzn s LEU 144 Ca -0.05 2.20 0.00 0.00 -1.03 0.00 0.00 54.13 55.25 2kzn s LEU 144 Cb 0.16 -3.62 -0.00 0.00 0.03 0.00 0.00 46.19 42.76 2kzn s LEU 144 CO 0.73 -0.19 0.02 -0.62 0.23 0.00 0.00 176.35 176.52 2kzn n GLU 145 N 1.74 1.09 -1.71 1.70 1.02 -1.26 -4.89 120.64 118.33 2kzn n GLU 145 Ca 0.01 -0.46 -0.34 0.00 -0.02 0.00 0.00 57.16 56.35 2kzn n GLU 145 Cb 0.45 0.22 0.06 0.00 -0.02 0.00 0.00 31.44 32.15 2kzn n GLU 145 CO 0.00 0.00 0.00 -3.38 1.18 0.00 0.00 177.13 174.93 2kzn s HIS 146 N -1.63 2.45 -2.53 -0.32 -3.43 -1.26 -5.21 115.29 103.36 2kzn s HIS 146 Ca 0.02 1.56 0.28 0.00 -0.80 0.00 0.00 55.06 56.12 2kzn s HIS 146 Cb 0.00 -3.27 1.00 0.00 -1.43 0.00 0.00 32.58 28.88 2kzn s HIS 146 CO 0.02 -1.96 1.72 1.58 -2.00 0.00 0.00 174.74 174.09