#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kzc n MET 2 N 0.00 0.26 0.00 1.61 2.00 -1.26 -4.76 117.12 114.96 2kzc n MET 2 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 57.70 57.49 2kzc n MET 2 Cb 0.00 -1.50 0.00 0.00 0.00 0.00 0.00 33.22 31.72 2kzc n MET 2 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 175.97 176.91 2kzc n GLN 3 N -1.19 0.63 0.08 0.03 0.00 -1.26 -3.15 117.38 112.52 2kzc n GLN 3 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 57.05 2kzc n GLN 3 Cb 0.36 -1.21 0.00 0.00 0.00 0.00 0.00 30.24 29.39 2kzc n GLN 3 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.06 178.25 2kzc n PHE 4 N -0.04 -1.01 -0.14 3.69 3.01 -1.26 -4.55 117.46 117.16 2kzc n PHE 4 Ca 0.00 0.18 -0.10 0.00 1.01 0.00 0.00 57.45 58.54 2kzc n PHE 4 Cb 0.11 0.27 -0.05 0.00 -0.01 0.00 0.00 39.48 39.79 2kzc n PHE 4 CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 2kzc h LYS 5 N 0.00 -0.30 -0.25 -1.08 1.57 -1.91 0.21 116.57 114.81 2kzc h LYS 5 Ca 0.00 0.02 -0.11 0.00 -1.87 0.00 0.00 60.65 58.69 2kzc h LYS 5 Cb 0.00 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 2kzc h LYS 5 CO 0.00 -0.20 -0.31 0.00 -0.57 0.00 0.00 179.45 178.37 2kzc h ALA 6 N 0.42 1.00 0.33 3.86 0.00 -1.87 -1.79 119.26 121.21 2kzc h ALA 6 Ca 0.14 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 2kzc h ALA 6 Cb 0.58 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2kzc h ALA 6 CO -0.60 0.60 -0.16 1.49 0.00 0.00 0.00 179.25 180.58 2kzc h GLU 7 N 0.44 -0.43 -0.48 0.00 4.81 -1.57 0.35 114.58 117.70 2kzc h GLU 7 Ca 0.06 0.03 0.06 0.00 -0.13 0.00 0.00 59.36 59.37 2kzc h GLU 7 Cb 0.76 0.10 -0.05 0.00 0.63 0.00 0.00 28.75 30.18 2kzc h GLU 7 CO 0.06 -0.13 0.19 0.00 -0.73 0.00 0.00 179.01 178.41 2kzc h ALA 8 N -0.69 0.59 -0.09 2.92 0.00 -0.70 -2.12 119.26 119.18 2kzc h ALA 8 Ca -0.05 0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 2kzc h ALA 8 Cb 0.50 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2kzc h ALA 8 CO 0.07 -0.19 -0.25 -0.09 0.00 0.00 0.00 179.25 178.80 2kzc h ARG 9 N 0.39 0.16 0.75 0.00 9.65 -1.29 0.61 114.38 124.64 2kzc h ARG 9 Ca 0.22 -0.05 -0.03 0.00 -1.10 0.00 0.00 59.98 59.02 2kzc h ARG 9 Cb 0.20 -0.02 -0.00 0.00 -1.39 0.00 0.00 29.97 28.76 2kzc h ARG 9 CO -0.21 0.41 -0.46 -0.09 2.80 0.00 0.00 179.97 182.42 2kzc h ARG 10 N 0.15 -1.09 -0.36 0.20 2.43 -0.29 -1.46 114.38 113.95 2kzc h ARG 10 Ca 0.02 0.07 0.04 0.00 -0.81 0.00 0.00 59.98 59.31 2kzc h ARG 10 Cb 0.53 0.25 -0.04 0.00 -0.42 0.00 0.00 29.97 30.29 2kzc h ARG 10 CO 0.04 -0.73 0.13 -0.91 -1.51 0.00 0.00 179.97 176.99 2kzc h ASN 11 N -1.13 0.15 -0.15 -3.80 2.35 -1.07 -1.58 115.58 110.35 2kzc h ASN 11 Ca -0.10 0.04 0.03 0.00 -0.55 0.00 0.00 56.30 55.72 2kzc h ASN 11 Cb 0.91 0.02 -0.03 0.00 0.05 0.00 0.00 38.32 39.27 2kzc h ASN 11 CO 0.10 0.12 -0.05 0.50 -1.65 0.00 0.00 177.43 176.45 2kzc h LYS 12 N 0.29 -0.02 0.00 0.81 3.64 -0.87 -1.64 116.57 118.77 2kzc h LYS 12 Ca 0.16 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.50 2kzc h LYS 12 Cb 0.13 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.95 2kzc h LYS 12 CO -0.16 -0.01 -0.21 -0.07 -2.27 0.00 0.00 179.45 176.73 2kzc h LEU 13 N -0.02 0.00 -0.33 5.20 3.38 -0.88 -1.17 115.31 121.49 2kzc h LEU 13 Ca 0.08 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 2kzc h LEU 13 Cb 0.13 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2kzc h LEU 13 CO -0.16 0.21 0.12 -0.03 0.09 0.00 0.00 178.44 178.66 2kzc h MET 14 N 0.00 0.50 -0.61 1.13 4.05 -0.48 -3.17 114.93 116.36 2kzc h MET 14 Ca -0.00 -0.10 0.12 0.00 -0.28 0.00 0.00 59.70 59.44 2kzc h MET 14 Cb 0.40 -0.08 -0.12 0.00 -0.80 0.00 0.00 31.60 31.01 2kzc h MET 14 CO 0.03 0.52 -0.15 0.78 0.23 0.00 0.00 176.91 178.31 2kzc h GLY 15 N 0.38 0.43 0.98 1.39 0.00 -0.33 -0.81 103.07 105.11 2kzc h GLY 15 Ca 0.11 0.20 0.01 0.00 0.00 0.00 0.00 47.33 47.65 2kzc h GLY 15 CO -0.01 -0.23 0.56 1.41 0.00 0.00 0.00 176.54 178.27 2kzc h LEU 16 N -0.00 0.96 -0.09 3.11 -0.00 -1.47 0.12 115.31 117.94 2kzc h LEU 16 Ca 0.29 -0.02 -0.02 0.00 -0.00 0.00 0.00 57.88 58.13 2kzc h LEU 16 Cb 0.44 -0.24 -0.00 0.00 -0.00 0.00 0.00 40.66 40.87 2kzc h LEU 16 CO -0.63 0.69 -0.01 -0.25 -0.00 0.00 0.00 178.44 178.24 2kzc h TRP 17 N 1.14 0.19 -0.94 1.13 7.01 -1.34 -1.81 115.95 121.32 2kzc h TRP 17 Ca 0.32 -0.04 0.00 0.00 2.11 0.00 0.00 58.89 61.28 2kzc h TRP 17 Cb -0.10 -0.05 -0.05 0.00 -2.10 0.00 0.00 29.16 26.86 2kzc h TRP 17 CO -0.01 0.47 0.60 0.28 -2.79 0.00 0.00 178.44 176.98 2kzc h VAL 18 N -0.14 1.25 -0.34 2.65 2.07 -0.85 -1.00 116.25 119.90 2kzc h VAL 18 Ca 0.02 -0.50 0.01 0.00 0.82 0.00 0.00 66.70 67.06 2kzc h VAL 18 Cb 0.40 -0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.04 2kzc h VAL 18 CO 0.01 0.25 0.20 0.00 0.02 0.00 0.00 177.57 178.05 2kzc h ALA 19 N 1.37 0.42 -0.39 1.67 0.00 -0.66 -0.36 119.26 121.31 2kzc h ALA 19 Ca 0.34 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.27 2kzc h ALA 19 Cb -0.10 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 2kzc h ALA 19 CO -0.07 -0.15 0.19 1.49 0.00 0.00 0.00 179.25 180.71 2kzc h GLU 20 N 0.41 0.38 -0.05 0.00 4.81 -0.79 -0.35 114.58 119.00 2kzc h GLU 20 Ca 0.13 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.32 2kzc h GLU 20 Cb -0.01 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.28 2kzc h GLU 20 CO -0.05 0.25 -0.04 0.28 -0.73 0.00 0.00 179.01 178.72 2kzc h VAL 21 N 0.39 1.06 0.00 0.32 2.07 -0.71 -0.52 116.25 118.86 2kzc h VAL 21 Ca 0.16 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 67.43 2kzc h VAL 21 Cb 0.07 1.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.91 2kzc h VAL 21 CO -0.12 0.08 0.00 0.18 0.02 0.00 0.00 177.57 177.73 2kzc n LEU 22 N -4.45 0.00 -0.10 2.57 4.77 -0.19 -4.92 117.00 114.68 2kzc n LEU 22 Ca -0.02 0.48 -0.01 0.00 -0.03 0.00 0.00 56.01 56.43 2kzc n LEU 22 Cb 0.14 -0.48 -0.00 0.00 -2.33 0.00 0.00 43.42 40.75 2kzc n LEU 22 CO 0.35 -0.06 -0.01 0.61 -1.33 0.00 0.00 177.39 176.95 2kzc n GLY 23 N 1.14 0.37 3.92 -0.72 0.00 -0.20 -5.07 105.19 104.63 2kzc n GLY 23 Ca 0.07 -0.92 -0.27 0.00 0.00 0.00 0.00 46.02 44.90 2kzc n GLY 23 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kzc s LYS 24 N -3.34 2.89 0.03 1.61 1.02 -0.22 -5.02 119.74 116.71 2kzc s LYS 24 Ca 0.00 -0.02 -0.25 0.00 0.02 0.00 0.00 55.97 55.71 2kzc s LYS 24 Cb 0.00 -2.27 0.08 0.00 -0.52 0.00 0.00 37.83 35.13 2kzc s LYS 24 CO 0.00 -0.72 1.16 0.43 -0.92 0.00 0.00 175.35 175.30 2kzc n SER 25 N -2.60 -1.29 0.00 2.83 7.64 -1.26 -4.30 113.62 114.64 2kzc n SER 25 Ca 0.05 -1.41 0.00 0.00 1.01 0.00 0.00 58.87 58.51 2kzc n SER 25 Cb 0.58 2.04 0.00 0.00 -1.01 0.00 0.00 64.21 65.82 2kzc n SER 25 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2kzc n GLY 26 N -0.83 3.22 0.09 0.23 0.00 -1.26 -2.93 105.19 103.71 2kzc n GLY 26 Ca 0.03 -0.18 -0.02 0.00 0.00 0.00 0.00 46.02 45.85 2kzc n GLY 26 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2kzc h ASP 27 N 0.27 0.00 -0.60 1.61 5.19 -2.00 -3.31 116.42 117.58 2kzc h ASP 27 Ca 0.00 0.00 0.11 0.00 -0.62 0.00 0.00 57.03 56.52 2kzc h ASP 27 Cb 0.00 0.00 -0.12 0.00 0.18 0.00 0.00 39.33 39.39 2kzc h ASP 27 CO 0.00 0.69 -0.30 -0.33 -3.12 0.00 0.00 179.24 176.19 2kzc h GLU 28 N 0.00 -0.13 -0.60 3.56 5.08 -1.96 0.09 114.58 120.62 2kzc h GLU 28 Ca -0.18 0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.20 2kzc h GLU 28 Cb 1.69 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 30.93 2kzc h GLU 28 CO 0.06 -0.09 0.40 0.00 -1.00 0.00 0.00 179.01 178.38 2kzc h ALA 29 N 1.13 1.58 0.04 3.43 0.00 -1.63 0.37 119.26 124.18 2kzc h ALA 29 Ca 0.25 -0.04 -0.25 0.00 0.00 0.00 0.00 54.91 54.86 2kzc h ALA 29 Cb 0.54 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 18.10 2kzc h ALA 29 CO -0.67 0.39 -1.06 -0.91 0.00 0.00 0.00 179.25 176.99 2kzc h ASN 30 N 0.80 0.65 -0.54 0.00 2.35 -1.51 -1.86 115.58 115.48 2kzc h ASN 30 Ca 0.22 -0.56 -0.04 0.00 -0.55 0.00 0.00 56.30 55.37 2kzc h ASN 30 Cb -0.08 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.07 2kzc h ASN 30 CO -0.05 1.37 0.17 0.00 -1.65 0.00 0.00 177.43 177.27 2kzc h ALA 31 N 0.58 0.70 0.00 -0.83 0.00 -0.45 -2.60 119.26 116.66 2kzc h ALA 31 Ca -0.12 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.56 2kzc h ALA 31 Cb 1.72 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 19.29 2kzc h ALA 31 CO 0.19 0.36 -0.20 -0.92 0.00 0.00 0.00 179.25 178.68 2kzc h TYR 32 N 0.74 0.00 0.00 0.00 5.03 -0.88 -1.66 116.97 120.20 2kzc h TYR 32 Ca 0.17 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.48 2kzc h TYR 32 Cb 0.27 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.55 2kzc h TYR 32 CO 0.02 0.20 0.00 0.00 -1.32 0.00 0.00 178.16 177.05 2kzc n ALA 33 N -2.44 1.68 0.06 1.82 0.00 -0.71 -0.89 120.51 120.03 2kzc n ALA 33 Ca -0.02 -0.05 -0.21 0.00 0.00 0.00 0.00 53.44 53.15 2kzc n ALA 33 Cb 0.27 -1.16 -0.15 0.00 0.00 0.00 0.00 19.45 18.41 2kzc n ALA 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2kzc h ALA 34 N 2.50 -0.03 -0.73 0.00 0.00 -1.37 -3.40 119.26 116.23 2kzc h ALA 34 Ca 0.00 -0.84 0.10 0.00 0.00 0.00 0.00 54.91 54.17 2kzc h ALA 34 Cb 0.07 0.22 -0.05 0.00 0.00 0.00 0.00 17.79 18.03 2kzc h ALA 34 CO 0.00 0.57 0.48 0.93 0.00 0.00 0.00 179.25 181.23 2kzc h GLU 35 N -0.24 0.61 0.00 0.00 4.39 -1.12 -0.01 114.58 118.20 2kzc h GLU 35 Ca -0.21 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.45 2kzc h GLU 35 Cb 1.79 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 30.30 2kzc h GLU 35 CO 0.15 0.40 0.00 0.28 -1.16 0.00 0.00 179.01 178.68 2kzc n VAL 36 N -4.49 0.00 0.08 3.13 0.31 -1.18 -3.33 118.33 112.85 2kzc n VAL 36 Ca 0.12 0.00 0.11 0.00 -0.01 0.00 0.00 64.34 64.57 2kzc n VAL 36 Cb 0.34 -0.50 -0.07 0.00 -0.91 0.00 0.00 33.84 32.70 2kzc n VAL 36 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 2kzc n VAL 37 N -1.39 0.35 1.65 2.52 0.31 -0.02 -4.51 118.33 117.24 2kzc n VAL 37 Ca 0.11 -0.52 0.12 0.00 -0.01 0.00 0.00 64.34 64.04 2kzc n VAL 37 Cb 0.29 -0.18 0.57 0.00 -0.91 0.00 0.00 33.84 33.61 2kzc n VAL 37 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 2kzc n LYS 38 N -2.48 1.37 -0.01 5.55 4.81 -1.18 -3.80 118.16 122.43 2kzc n LYS 38 Ca -0.02 -0.55 0.07 0.00 -0.87 0.00 0.00 58.31 56.95 2kzc n LYS 38 Cb 0.55 -1.41 -0.11 0.00 0.02 0.00 0.00 35.03 34.09 2kzc n LYS 38 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2kzc n ALA 39 N -0.28 2.77 -2.16 3.14 0.00 -1.26 -4.79 120.51 117.93 2kzc n ALA 39 Ca 0.18 -0.35 -0.32 0.00 0.00 0.00 0.00 53.44 52.94 2kzc n ALA 39 Cb 0.22 -0.50 -0.05 0.00 0.00 0.00 0.00 19.45 19.12 2kzc n ALA 39 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2kzc n ASP 40 N -1.88 3.51 -3.30 0.00 2.03 -1.25 -4.39 116.55 111.28 2kzc n ASP 40 Ca -0.02 -2.75 -0.04 0.00 0.52 0.00 0.00 54.79 52.50 2kzc n ASP 40 Cb 0.35 -1.73 -0.05 0.00 -0.72 0.00 0.00 41.12 38.97 2kzc n ASP 40 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 2kzc s PHE 41 N 9.24 -1.14 0.00 -0.67 0.08 -1.26 -4.98 117.98 119.24 2kzc s PHE 41 Ca 0.65 1.27 0.00 0.00 0.12 0.00 0.00 56.93 58.96 2kzc s PHE 41 Cb 0.01 0.28 0.00 0.00 -0.57 0.00 0.00 43.02 42.73 2kzc s PHE 41 CO 0.12 -0.76 0.00 0.39 -0.10 0.00 0.00 175.22 174.87 2kzc n GLU 42 N 5.39 -0.72 0.00 0.44 -0.58 -1.26 -4.87 120.64 119.04 2kzc n GLU 42 Ca -0.03 0.18 0.00 0.00 -0.42 0.00 0.00 57.16 56.89 2kzc n GLU 42 Cb 0.50 -3.88 0.00 0.00 -0.57 0.00 0.00 31.44 27.50 2kzc n GLU 42 CO 0.00 0.00 0.00 -0.85 -0.48 0.00 0.00 177.13 175.80 2kzc n GLU 43 N -1.26 0.62 -0.65 3.49 0.28 -1.26 -4.85 120.64 117.01 2kzc n GLU 43 Ca 0.00 0.00 -0.02 0.00 -0.16 0.00 0.00 57.16 56.98 2kzc n GLU 43 Cb 0.18 -1.15 -0.01 0.00 1.43 0.00 0.00 31.44 31.89 2kzc n GLU 43 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2kzc n ALA 44 N -0.17 -0.04 0.00 -1.84 0.00 -1.26 -3.30 120.51 113.91 2kzc n ALA 44 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2kzc n ALA 44 Cb 0.07 -0.51 0.00 0.00 0.00 0.00 0.00 19.45 19.01 2kzc n ALA 44 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kzc n GLY 45 N 0.09 -1.48 1.67 0.00 0.00 -1.26 -5.00 105.19 99.21 2kzc n GLY 45 Ca -0.02 0.50 -0.02 0.00 0.00 0.00 0.00 46.02 46.48 2kzc n GLY 45 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2kzc n HIS 46 N 0.00 -0.77 -0.06 1.61 1.44 -1.22 -5.03 115.22 111.19 2kzc n HIS 46 Ca 0.00 -0.75 -0.15 0.00 -2.01 0.00 0.00 57.72 54.82 2kzc n HIS 46 Cb 0.00 0.87 -0.13 0.00 0.12 0.00 0.00 29.99 30.85 2kzc n HIS 46 CO 0.00 0.00 0.00 0.93 -2.81 0.00 0.00 176.34 174.46 2kzc h GLU 47 N 0.37 0.03 0.00 -1.40 4.39 -1.94 -3.30 114.58 112.73 2kzc h GLU 47 Ca -0.29 -0.04 -0.12 0.00 0.34 0.00 0.00 59.36 59.25 2kzc h GLU 47 Cb 1.12 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.77 2kzc h GLU 47 CO -0.13 1.02 -0.55 0.22 -1.16 0.00 0.00 179.01 178.41 2kzc h ASP 48 N -0.94 0.00 -0.26 1.42 3.58 -1.86 -0.13 116.42 118.22 2kzc h ASP 48 Ca -0.01 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.43 2kzc h ASP 48 Cb 1.05 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.09 2kzc h ASP 48 CO 0.01 0.55 0.14 0.58 -2.88 0.00 0.00 179.24 177.65 2kzc h VAL 49 N 0.00 1.12 0.22 2.25 2.07 -1.77 -2.18 116.25 117.96 2kzc h VAL 49 Ca -0.01 -0.30 -0.01 0.00 0.82 0.00 0.00 66.70 67.20 2kzc h VAL 49 Cb 1.35 0.85 0.00 0.00 -1.52 0.00 0.00 31.29 31.97 2kzc h VAL 49 CO 0.07 0.11 -0.11 0.24 0.02 0.00 0.00 177.57 177.91 2kzc h MET 50 N 0.31 -0.29 -0.82 1.57 2.86 -1.45 -3.05 114.93 114.06 2kzc h MET 50 Ca 0.09 0.02 0.11 0.00 -2.06 0.00 0.00 59.70 57.86 2kzc h MET 50 Cb 0.06 0.07 -0.06 0.00 0.06 0.00 0.00 31.60 31.72 2kzc h MET 50 CO -0.02 -0.01 0.53 0.07 1.06 0.00 0.00 176.91 178.55 2kzc h ARG 51 N -0.57 0.68 0.08 1.72 0.11 -1.08 -1.07 114.38 114.25 2kzc h ARG 51 Ca -0.03 -0.04 -0.00 0.00 0.10 0.00 0.00 59.98 60.01 2kzc h ARG 51 Cb 0.42 -0.15 -0.01 0.00 1.11 0.00 0.00 29.97 31.34 2kzc h ARG 51 CO 0.05 0.45 -0.13 -0.22 0.10 0.00 0.00 179.97 180.22 2kzc h LYS 52 N 0.70 -0.21 0.00 0.08 3.11 -1.32 -1.02 116.57 117.91 2kzc h LYS 52 Ca 0.39 0.01 -0.08 0.00 -2.81 0.00 0.00 60.65 58.17 2kzc h LYS 52 Cb 0.54 0.05 -0.01 0.00 -1.00 0.00 0.00 32.23 31.81 2kzc h LYS 52 CO -0.16 -0.14 -0.36 -0.39 -2.81 0.00 0.00 179.45 175.59 2kzc h VAL 53 N -0.22 1.15 0.17 2.00 -1.51 -1.28 -0.74 116.25 115.83 2kzc h VAL 53 Ca -0.01 -1.27 -0.01 0.00 -1.23 0.00 0.00 66.70 64.18 2kzc h VAL 53 Cb 0.20 1.71 0.00 0.00 -2.13 0.00 0.00 31.29 31.07 2kzc h VAL 53 CO -0.04 0.35 -0.08 -0.07 -1.23 0.00 0.00 177.57 176.50 2kzc h LEU 54 N 0.00 -0.19 -0.25 4.19 3.38 -1.17 0.28 115.31 121.55 2kzc h LEU 54 Ca -0.00 -0.30 0.02 0.00 0.09 0.00 0.00 57.88 57.69 2kzc h LEU 54 Cb 0.68 0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.46 2kzc h LEU 54 CO 0.05 0.23 0.12 1.23 0.09 0.00 0.00 178.44 180.15 2kzc h GLY 55 N -0.65 0.33 2.00 0.83 0.00 -1.01 -2.08 103.07 102.48 2kzc h GLY 55 Ca -0.02 -0.08 -0.03 0.00 0.00 0.00 0.00 47.33 47.20 2kzc h GLY 55 CO 0.04 0.07 -0.12 -0.55 0.00 0.00 0.00 176.54 175.97 2kzc h ASP 56 N 0.25 0.00 1.20 0.19 5.19 -1.14 -0.61 116.42 121.50 2kzc h ASP 56 Ca 0.10 0.00 -0.10 0.00 -0.62 0.00 0.00 57.03 56.41 2kzc h ASP 56 Cb 0.04 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.53 2kzc h ASP 56 CO -0.08 0.12 -0.47 -0.07 -3.12 0.00 0.00 179.24 175.62 2kzc h LEU 57 N 0.00 0.00 1.18 1.55 3.38 -0.52 -3.48 115.31 117.41 2kzc h LEU 57 Ca -0.00 0.00 -0.41 0.00 0.09 0.00 0.00 57.88 57.56 2kzc h LEU 57 Cb 0.51 0.00 0.05 0.00 0.09 0.00 0.00 40.66 41.31 2kzc h LEU 57 CO 0.02 0.47 -0.60 -0.67 0.09 0.00 0.00 178.44 177.75 2kzc n ASP 58 N -3.35 -6.04 -0.40 -0.43 -0.08 -0.24 -2.15 116.55 103.86 2kzc n ASP 58 Ca 0.01 -0.26 -0.04 0.00 -1.51 0.00 0.00 54.79 52.98 2kzc n ASP 58 Cb 0.65 -4.90 -0.01 0.00 2.34 0.00 0.00 41.12 39.20 2kzc n ASP 58 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2kzc n GLY 59 N -1.47 0.55 0.29 0.27 0.00 -1.24 -4.94 105.19 98.65 2kzc n GLY 59 Ca -0.12 -0.81 0.12 0.00 0.00 0.00 0.00 46.02 45.21 2kzc n GLY 59 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2kzc h LYS 60 N 0.00 0.00 -3.98 1.61 1.57 -1.75 -3.43 116.57 110.59 2kzc h LYS 60 Ca -0.10 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.54 2kzc h LYS 60 Cb 0.55 0.00 -0.19 0.00 0.08 0.00 0.00 32.23 32.67 2kzc h LYS 60 CO 0.13 0.00 -0.65 1.03 -0.57 0.00 0.00 179.45 179.39 2kzc s ARG 61 N -4.85 0.44 0.42 3.15 1.81 -1.26 -5.13 118.95 113.54 2kzc s ARG 61 Ca -0.05 -0.77 -0.25 0.00 -1.72 0.00 0.00 55.73 52.94 2kzc s ARG 61 Cb 0.16 0.16 -0.08 0.00 -0.45 0.00 0.00 34.95 34.74 2kzc s ARG 61 CO 0.61 -0.09 1.29 -1.25 -0.68 0.00 0.00 175.30 175.19 2kzc s PRO 62 N -2.25 3.88 0.39 3.54 0.04 -1.26 -4.90 135.00 134.43 2kzc s PRO 62 Ca -0.08 2.13 0.10 0.00 0.04 0.00 0.00 61.00 63.19 2kzc s PRO 62 Cb -0.04 -2.68 0.88 0.00 0.04 0.00 0.00 34.50 32.70 2kzc s PRO 62 CO -0.04 -0.56 1.93 1.49 0.04 0.00 0.00 177.00 179.86 2kzc h GLU 63 N 2.51 0.59 -0.50 4.56 4.81 -1.99 -1.74 114.58 122.82 2kzc h GLU 63 Ca -0.50 -0.04 0.09 0.00 -0.13 0.00 0.00 59.36 58.79 2kzc h GLU 63 Cb 1.25 -0.13 -0.07 0.00 0.63 0.00 0.00 28.75 30.42 2kzc h GLU 63 CO 0.62 0.39 0.07 0.00 -0.73 0.00 0.00 179.01 179.35 2kzc h ALA 64 N 1.63 0.53 -0.25 2.92 0.00 -2.00 0.11 119.26 122.20 2kzc h ALA 64 Ca 0.36 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.37 2kzc h ALA 64 Cb 0.57 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2kzc h ALA 64 CO -0.13 -0.34 0.11 1.49 0.00 0.00 0.00 179.25 180.38 2kzc h GLU 65 N 0.19 0.37 -0.36 0.00 4.81 -1.71 -2.85 114.58 115.04 2kzc h GLU 65 Ca 0.25 -0.06 0.03 0.00 -0.13 0.00 0.00 59.36 59.45 2kzc h GLU 65 Cb 0.36 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.64 2kzc h GLU 65 CO -0.36 0.39 0.18 0.28 -0.73 0.00 0.00 179.01 178.78 2kzc h VAL 66 N 0.26 0.98 0.53 0.32 2.07 -0.95 -0.78 116.25 118.68 2kzc h VAL 66 Ca 0.08 -0.13 -0.02 0.00 0.82 0.00 0.00 66.70 67.46 2kzc h VAL 66 Cb 0.16 0.58 -0.00 0.00 -1.52 0.00 0.00 31.29 30.50 2kzc h VAL 66 CO -0.01 0.07 -0.31 0.03 0.02 0.00 0.00 177.57 177.37 2kzc h ARG 67 N 0.37 -0.76 -0.79 1.57 3.08 -0.82 -2.39 114.38 114.64 2kzc h ARG 67 Ca 0.15 0.05 0.07 0.00 0.07 0.00 0.00 59.98 60.32 2kzc h ARG 67 Cb 0.07 0.17 -0.06 0.00 0.08 0.00 0.00 29.97 30.23 2kzc h ARG 67 CO -0.11 -0.50 0.47 0.00 -1.07 0.00 0.00 179.97 178.75 2kzc h ALA 68 N -0.35 1.08 0.19 0.04 0.00 -1.33 -0.27 119.26 118.61 2kzc h ALA 68 Ca -0.06 0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.87 2kzc h ALA 68 Cb 0.63 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 2kzc h ALA 68 CO 0.08 0.17 -0.36 -0.22 0.00 0.00 0.00 179.25 178.91 2kzc h LYS 69 N 0.84 -0.61 -0.27 0.00 1.63 -0.97 0.10 116.57 117.30 2kzc h LYS 69 Ca 0.35 0.04 -0.01 0.00 -0.85 0.00 0.00 60.65 60.18 2kzc h LYS 69 Cb 0.21 0.14 -0.01 0.00 -0.60 0.00 0.00 32.23 31.96 2kzc h LYS 69 CO -0.19 -0.41 0.13 -0.92 -3.45 0.00 0.00 179.45 174.61 2kzc h TYR 70 N -0.64 0.39 0.02 1.91 3.20 -0.89 -2.36 116.97 118.61 2kzc h TYR 70 Ca 0.01 -0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.87 2kzc h TYR 70 Cb 0.64 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.77 2kzc h TYR 70 CO -0.29 0.37 -0.08 0.93 -1.64 0.00 0.00 178.16 177.45 2kzc h GLU 71 N 0.30 -0.15 0.00 1.82 4.39 -0.95 -1.92 114.58 118.06 2kzc h GLU 71 Ca 0.09 0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.80 2kzc h GLU 71 Cb 0.13 0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 28.81 2kzc h GLU 71 CO -0.01 -0.10 -0.02 0.78 -1.16 0.00 0.00 179.01 178.50 2kzc h GLY 72 N -0.16 0.00 2.00 -3.84 0.00 -0.90 -3.00 103.07 97.17 2kzc h GLY 72 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.36 2kzc h GLY 72 CO -0.07 0.00 0.00 -2.00 0.00 0.00 0.00 176.54 174.47 2kzc h LEU 73 N 0.00 0.00 -0.48 3.11 5.85 -0.79 -3.09 115.31 119.91 2kzc h LEU 73 Ca -0.00 0.00 0.05 0.00 0.84 0.00 0.00 57.88 58.77 2kzc h LEU 73 Cb 0.04 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.02 2kzc h LEU 73 CO 0.00 0.00 0.22 -0.03 -0.34 0.00 0.00 178.44 178.30 2kzc h MET 74 N 0.00 0.43 -0.50 1.25 4.05 -1.60 0.25 114.93 118.81 2kzc h MET 74 Ca 0.00 -0.03 -0.12 0.00 -0.28 0.00 0.00 59.70 59.28 2kzc h MET 74 Cb 0.47 -0.10 -0.02 0.00 -0.80 0.00 0.00 31.60 31.15 2kzc h MET 74 CO 0.00 0.28 -0.15 0.00 0.23 0.00 0.00 176.91 177.27 2kzc h ALA 75 N 1.27 0.78 -0.55 0.39 0.00 -1.79 -2.57 119.26 116.79 2kzc h ALA 75 Ca 0.21 -0.36 -0.11 0.00 0.00 0.00 0.00 54.91 54.65 2kzc h ALA 75 Cb 0.15 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2kzc h ALA 75 CO -0.17 0.66 -0.10 0.28 0.00 0.00 0.00 179.25 179.93 2kzc h VAL 76 N 0.86 1.27 -0.45 0.00 2.07 -1.52 -1.15 116.25 117.32 2kzc h VAL 76 Ca 0.13 -1.26 0.04 0.00 0.82 0.00 0.00 66.70 66.43 2kzc h VAL 76 Cb 0.71 0.95 -0.04 0.00 -1.52 0.00 0.00 31.29 31.39 2kzc h VAL 76 CO 0.05 0.45 0.22 0.00 0.02 0.00 0.00 177.57 178.31 2kzc h ALA 77 N 0.93 0.57 -0.54 1.67 0.00 -0.39 -1.03 119.26 120.47 2kzc h ALA 77 Ca 0.14 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 2kzc h ALA 77 Cb 0.67 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 2kzc h ALA 77 CO 0.05 -0.14 0.16 0.87 0.00 0.00 0.00 179.25 180.19 2kzc h LYS 78 N 0.44 0.85 -0.19 0.00 1.57 -1.31 -2.70 116.57 115.24 2kzc h LYS 78 Ca 0.20 -0.19 0.05 0.00 -1.87 0.00 0.00 60.65 58.84 2kzc h LYS 78 Cb 0.12 -0.12 -0.05 0.00 0.08 0.00 0.00 32.23 32.26 2kzc h LYS 78 CO -0.15 0.79 -0.12 0.00 -0.57 0.00 0.00 179.45 179.40 2kzc h ALA 79 N 1.03 0.03 -0.16 3.86 0.00 -0.42 -2.01 119.26 121.59 2kzc h ALA 79 Ca 0.17 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.13 2kzc h ALA 79 Cb 0.30 0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2kzc h ALA 79 CO -0.00 -0.55 -0.05 1.96 0.00 0.00 0.00 179.25 180.61 2kzc h GLN 80 N -0.11 0.24 0.00 0.00 4.20 -1.12 -0.43 115.11 117.89 2kzc h GLN 80 Ca 0.11 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.77 2kzc h GLN 80 Cb 0.28 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 28.01 2kzc h GLN 80 CO -0.26 0.31 -0.05 -0.07 -0.67 0.00 0.00 178.83 178.08 2kzc h LEU 81 N 0.23 0.00 0.08 1.46 3.38 -1.10 0.29 115.31 119.66 2kzc h LEU 81 Ca 0.05 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 2kzc h LEU 81 Cb 0.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2kzc h LEU 81 CO 0.01 0.05 -0.04 0.24 0.09 0.00 0.00 178.44 178.79 2kzc h MET 82 N 0.00 -0.11 0.00 1.13 2.86 -0.65 -3.39 114.93 114.77 2kzc h MET 82 Ca -0.00 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 2kzc h MET 82 Cb 0.90 0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.58 2kzc h MET 82 CO 0.01 0.44 0.00 -3.47 1.06 0.00 0.00 176.91 174.94 2kzc n ASP 83 N -4.84 0.00 0.28 1.22 2.03 -0.25 -3.40 116.55 111.60 2kzc n ASP 83 Ca -0.08 0.48 0.17 0.00 0.52 0.00 0.00 54.79 55.88 2kzc n ASP 83 Cb 0.29 -0.49 0.80 0.00 -0.72 0.00 0.00 41.12 41.01 2kzc n ASP 83 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 2kzc h GLU 84 N 0.00 0.00 0.00 -0.67 4.11 -0.62 -3.49 114.58 113.91 2kzc h GLU 84 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2kzc h GLU 84 Cb 0.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.67 2kzc h GLU 84 CO 0.00 0.05 0.00 -0.11 0.07 0.00 0.00 179.01 179.02