#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 -0.40 0.15 1.61 -0.00 -1.26 -4.80 117.12 112.42 2kzc n MET 2 Ca 0.00 0.05 0.12 0.00 -0.00 0.00 0.00 57.70 57.87 2kzc n MET 2 Cb 0.00 -2.96 0.64 0.00 -0.00 0.00 0.00 33.22 30.90 2kzc n MET 2 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 175.97 176.34 2kzc h GLN 3 N 0.00 0.04 0.06 3.17 -0.00 -2.04 0.13 115.11 116.47 2kzc h GLN 3 Ca 0.00 -0.00 -0.36 0.00 -0.00 0.00 0.00 58.65 58.28 2kzc h GLN 3 Cb 0.10 -0.01 -0.04 0.00 0.00 0.00 0.00 27.48 27.53 2kzc h GLN 3 CO 0.00 0.03 -2.09 1.19 0.00 0.00 0.00 178.83 177.96 2kzc n PHE 4 N -4.48 0.75 0.02 3.99 3.01 -1.26 -1.10 117.46 118.39 2kzc n PHE 4 Ca 0.02 0.19 -0.11 0.00 1.01 0.00 0.00 57.45 58.56 2kzc n PHE 4 Cb 0.26 -1.09 -0.05 0.00 -0.01 0.00 0.00 39.48 38.59 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 -0.20 -0.09 0.00 -1.08 1.79 -1.88 -2.71 116.57 112.40 2kzc h LYS 5 Ca -0.49 0.01 -0.04 0.00 -2.18 0.00 0.00 60.65 57.95 2kzc h LYS 5 Cb 1.86 0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 32.52 2kzc h LYS 5 CO -0.05 -0.06 -0.18 0.00 -1.08 0.00 0.00 179.45 178.08 2kzc h ALA 6 N 0.95 1.50 0.94 3.86 0.00 -0.86 -3.25 119.26 122.40 2kzc h ALA 6 Ca 0.05 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 2kzc h ALA 6 Cb 0.16 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 17.93 2kzc h ALA 6 CO -0.11 0.22 -0.45 1.05 0.00 0.00 0.00 179.25 179.96 2kzc h GLU 7 N 0.00 -1.22 0.00 0.00 4.11 -0.77 -2.53 114.58 114.16 2kzc h GLU 7 Ca -0.00 0.08 -0.02 0.00 0.07 0.00 0.00 59.36 59.49 2kzc h GLU 7 Cb 0.36 0.28 -0.00 0.00 0.50 0.00 0.00 28.75 29.88 2kzc h GLU 7 CO 0.02 -0.81 -0.19 0.00 0.07 0.00 0.00 179.01 178.10 2kzc h ALA 8 N -1.20 0.90 0.04 1.06 0.00 -1.58 -1.11 119.26 117.36 2kzc h ALA 8 Ca -0.13 -0.07 -0.25 0.00 0.00 0.00 0.00 54.91 54.46 2kzc h ALA 8 Cb 0.97 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.76 2kzc h ALA 8 CO 0.21 0.10 -1.05 -0.09 0.00 0.00 0.00 179.25 178.42 2kzc h ARG 9 N 0.00 0.45 0.41 0.00 9.65 -1.63 0.71 114.38 123.97 2kzc h ARG 9 Ca -0.00 -0.54 -0.01 0.00 -1.10 0.00 0.00 59.98 58.33 2kzc h ARG 9 Cb 1.06 0.17 -0.02 0.00 -1.39 0.00 0.00 29.97 29.79 2kzc h ARG 9 CO 0.01 1.19 -0.36 -0.09 2.80 0.00 0.00 179.97 183.52 2kzc h ARG 10 N 0.23 -0.75 -0.17 0.20 2.43 -0.94 -1.73 114.38 113.66 2kzc h ARG 10 Ca -0.11 0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.09 2kzc h ARG 10 Cb 1.70 0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 31.42 2kzc h ARG 10 CO 0.19 -0.50 0.04 -0.91 -1.51 0.00 0.00 179.97 177.28 2kzc h ASN 11 N -0.77 0.26 -0.13 -3.80 4.21 -1.26 -2.67 115.58 111.42 2kzc h ASN 11 Ca -0.03 -0.24 0.03 0.00 1.21 0.00 0.00 56.30 57.27 2kzc h ASN 11 Cb 0.68 -0.07 -0.03 0.00 -1.12 0.00 0.00 38.32 37.78 2kzc h ASN 11 CO -0.04 0.43 -0.07 0.50 -1.29 0.00 0.00 177.43 176.97 2kzc h LYS 12 N 0.08 -0.06 -0.64 0.81 3.64 -0.87 -2.50 116.57 117.04 2kzc h LYS 12 Ca 0.05 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 2kzc h LYS 12 Cb 0.27 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.08 2kzc h LYS 12 CO 0.00 -0.04 0.41 -0.07 -2.27 0.00 0.00 179.45 177.48 2kzc h LEU 13 N -0.06 0.74 0.23 5.20 3.38 -1.15 -1.42 115.31 122.23 2kzc h LEU 13 Ca 0.08 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 2kzc h LEU 13 Cb 0.17 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 2kzc h LEU 13 CO -0.17 0.55 -0.14 -0.03 0.09 0.00 0.00 178.44 178.75 2kzc h MET 14 N 0.87 -0.34 -0.89 1.13 4.05 -1.18 -2.84 114.93 115.73 2kzc h MET 14 Ca 0.23 0.02 0.19 0.00 -0.28 0.00 0.00 59.70 59.86 2kzc h MET 14 Cb -0.07 0.08 -0.07 0.00 -0.80 0.00 0.00 31.60 30.74 2kzc h MET 14 CO -0.05 -0.22 0.58 0.78 0.23 0.00 0.00 176.91 178.23 2kzc h GLY 15 N -0.35 0.98 0.97 1.39 0.00 -0.85 -1.54 103.07 103.67 2kzc h GLY 15 Ca -0.02 -0.22 -0.10 0.00 0.00 0.00 0.00 47.33 46.98 2kzc h GLY 15 CO 0.03 0.01 -0.20 1.41 0.00 0.00 0.00 176.54 177.79 2kzc h LEU 16 N 0.48 0.76 -0.43 3.11 3.38 -1.14 0.15 115.31 121.62 2kzc h LEU 16 Ca 0.46 -0.42 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2kzc h LEU 16 Cb 1.04 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.55 2kzc h LEU 16 CO -0.19 1.02 0.28 -0.25 0.09 0.00 0.00 178.44 179.39 2kzc h TRP 17 N 0.50 0.54 -0.10 1.13 7.01 -1.14 -1.91 115.95 121.98 2kzc h TRP 17 Ca 0.07 0.01 -0.00 0.00 2.11 0.00 0.00 58.89 61.08 2kzc h TRP 17 Cb 0.75 -0.18 -0.00 0.00 -2.10 0.00 0.00 29.16 27.62 2kzc h TRP 17 CO 0.06 0.34 0.04 0.28 -2.79 0.00 0.00 178.44 176.38 2kzc h VAL 18 N 0.58 1.13 -0.70 2.65 2.07 -1.21 -1.24 116.25 119.53 2kzc h VAL 18 Ca 0.16 -0.39 0.10 0.00 0.82 0.00 0.00 66.70 67.38 2kzc h VAL 18 Cb -0.06 1.21 -0.07 0.00 -1.52 0.00 0.00 31.29 30.84 2kzc h VAL 18 CO -0.03 0.12 0.33 0.00 0.02 0.00 0.00 177.57 178.01 2kzc h ALA 19 N 0.90 0.96 -0.72 1.67 0.00 -0.59 0.12 119.26 121.59 2kzc h ALA 19 Ca 0.03 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 2kzc h ALA 19 Cb 0.15 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 2kzc h ALA 19 CO -0.00 -0.08 0.41 1.49 0.00 0.00 0.00 179.25 181.07 2kzc h GLU 20 N 0.57 1.00 -0.38 0.00 4.81 -1.09 0.10 114.58 119.58 2kzc h GLU 20 Ca 0.35 -0.11 -0.05 0.00 -0.13 0.00 0.00 59.36 59.42 2kzc h GLU 20 Cb 0.38 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.54 2kzc h GLU 20 CO -0.28 0.73 0.01 0.28 -0.73 0.00 0.00 179.01 179.02 2kzc h VAL 21 N 0.99 1.21 0.00 0.32 2.07 -0.03 -1.81 116.25 119.00 2kzc h VAL 21 Ca 0.26 -0.83 0.00 0.00 0.82 0.00 0.00 66.70 66.95 2kzc h VAL 21 Cb 0.01 0.90 0.00 0.00 -1.52 0.00 0.00 31.29 30.68 2kzc h VAL 21 CO -0.04 0.29 0.00 0.18 0.02 0.00 0.00 177.57 178.01 2kzc n LEU 22 N -4.27 0.00 0.00 2.57 4.32 0.29 -4.91 117.00 115.00 2kzc n LEU 22 Ca 0.02 0.40 0.00 0.00 -0.02 0.00 0.00 56.01 56.41 2kzc n LEU 22 Cb 0.25 -0.40 0.00 0.00 -1.62 0.00 0.00 43.42 41.65 2kzc n LEU 22 CO 0.39 -0.06 0.00 0.61 -1.22 0.00 0.00 177.39 177.11 2kzc n GLY 23 N 0.95 0.37 3.74 -0.72 0.00 -0.45 -5.01 105.19 104.07 2kzc n GLY 23 Ca 0.09 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.66 2.73 0.17 1.61 1.02 0.23 -4.96 119.74 119.87 2kzc s LYS 24 Ca 0.00 1.95 -0.12 0.00 0.02 0.00 0.00 55.97 57.83 2kzc s LYS 24 Cb 0.00 -1.88 0.00 0.00 -0.52 0.00 0.00 37.83 35.43 2kzc s LYS 24 CO 0.00 -1.43 0.35 -1.12 -0.92 0.00 0.00 175.35 172.23 2kzc s SER 25 N -1.49 -0.05 1.03 2.83 0.01 -1.26 -4.23 113.70 110.54 2kzc s SER 25 Ca 0.80 -0.73 0.00 0.00 1.31 0.00 0.00 55.95 57.33 2kzc s SER 25 Cb -0.34 0.47 0.00 0.00 0.21 0.00 0.00 66.02 66.36 2kzc s SER 25 CO 0.37 -0.93 0.00 0.61 0.41 0.00 0.00 173.24 173.70 2kzc n GLY 26 N -0.24 2.95 0.22 3.44 0.00 -1.26 -2.90 105.19 107.41 2kzc n GLY 26 Ca -0.09 -0.12 0.13 0.00 0.00 0.00 0.00 46.02 45.94 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 1.52 0.00 -0.68 1.61 3.32 -2.00 -2.10 116.42 118.09 2kzc h ASP 27 Ca 0.00 0.00 0.09 0.00 0.02 0.00 0.00 57.03 57.14 2kzc h ASP 27 Cb 0.00 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.48 2kzc h ASP 27 CO 0.00 0.00 0.32 -0.33 -1.72 0.00 0.00 179.24 177.51 2kzc h GLU 28 N 0.00 0.53 0.00 3.56 4.39 -1.94 0.12 114.58 121.24 2kzc h GLU 28 Ca 0.00 -0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.66 2kzc h GLU 28 Cb 0.85 -0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 29.38 2kzc h GLU 28 CO 0.00 0.35 -0.03 0.00 -1.16 0.00 0.00 179.01 178.17 2kzc h ALA 29 N 1.42 1.03 0.04 3.43 0.00 -1.43 0.30 119.26 124.05 2kzc h ALA 29 Ca 0.34 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.13 2kzc h ALA 29 Cb 0.37 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2kzc h ALA 29 CO -0.28 0.04 -0.41 -0.91 0.00 0.00 0.00 179.25 177.70 2kzc h ASN 30 N 0.00 0.12 -0.03 0.00 2.35 -1.35 -3.12 115.58 113.56 2kzc h ASN 30 Ca -0.00 -0.92 0.03 0.00 -0.55 0.00 0.00 56.30 54.86 2kzc h ASN 30 Cb 0.42 -0.04 -0.04 0.00 0.05 0.00 0.00 38.32 38.71 2kzc h ASN 30 CO 0.00 1.18 -0.18 0.00 -1.65 0.00 0.00 177.43 176.78 2kzc h ALA 31 N -0.05 -0.20 -0.70 -0.83 0.00 -0.38 -2.26 119.26 114.85 2kzc h ALA 31 Ca -0.09 0.02 0.05 0.00 0.00 0.00 0.00 54.91 54.89 2kzc h ALA 31 Cb 1.22 0.33 -0.05 0.00 0.00 0.00 0.00 17.79 19.28 2kzc h ALA 31 CO 0.01 -0.66 0.41 -0.92 0.00 0.00 0.00 179.25 178.09 2kzc h TYR 32 N -0.28 0.76 0.00 0.00 3.20 -1.11 -0.35 116.97 119.19 2kzc h TYR 32 Ca 0.07 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.96 2kzc h TYR 32 Cb 0.36 -0.24 0.00 0.00 1.54 0.00 0.00 36.73 38.40 2kzc h TYR 32 CO -0.24 0.39 0.00 0.00 -1.64 0.00 0.00 178.16 176.66 2kzc n ALA 33 N -2.34 1.34 0.10 1.82 0.00 -0.89 -1.06 120.51 119.48 2kzc n ALA 33 Ca 0.09 -0.01 -0.18 0.00 0.00 0.00 0.00 53.44 53.34 2kzc n ALA 33 Cb 0.15 -1.14 -0.14 0.00 0.00 0.00 0.00 19.45 18.31 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 2.25 0.12 -0.91 0.00 0.00 -0.64 -3.35 119.26 116.73 2kzc h ALA 34 Ca 0.00 -0.96 -0.01 0.00 0.00 0.00 0.00 54.91 53.93 2kzc h ALA 34 Cb 0.13 0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 2kzc h ALA 34 CO 0.00 0.99 0.52 0.93 0.00 0.00 0.00 179.25 181.70 2kzc h GLU 35 N 0.08 1.25 0.00 0.00 5.08 -1.02 -2.45 114.58 117.52 2kzc h GLU 35 Ca -0.19 -0.13 -0.03 0.00 -1.00 0.00 0.00 59.36 58.01 2kzc h GLU 35 Cb 2.02 -0.25 -0.00 0.00 0.50 0.00 0.00 28.75 31.01 2kzc h GLU 35 CO 0.20 0.89 -0.14 0.28 -1.00 0.00 0.00 179.01 179.24 2kzc h VAL 36 N 1.26 0.49 0.00 3.13 2.07 -1.66 -0.10 116.25 121.44 2kzc h VAL 36 Ca 0.32 -0.70 0.00 0.00 0.82 0.00 0.00 66.70 67.14 2kzc h VAL 36 Cb -0.01 1.48 0.00 0.00 -1.52 0.00 0.00 31.29 31.24 2kzc h VAL 36 CO -0.06 0.14 0.00 0.52 0.02 0.00 0.00 177.57 178.19 2kzc n VAL 37 N -3.48 0.79 -3.50 2.57 0.31 -0.92 -4.10 118.33 109.98 2kzc n VAL 37 Ca -0.01 0.15 -0.37 0.00 -0.01 0.00 0.00 64.34 64.10 2kzc n VAL 37 Cb 0.30 -1.02 -0.05 0.00 -0.91 0.00 0.00 33.84 32.16 2kzc n VAL 37 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2kzc n LYS 38 N -2.07 2.96 0.00 5.55 5.02 -0.05 -4.45 118.16 125.11 2kzc n LYS 38 Ca 0.03 -4.51 0.00 0.00 -2.02 0.00 0.00 58.31 51.81 2kzc n LYS 38 Cb 0.25 -2.42 0.00 0.00 -0.02 0.00 0.00 35.03 32.84 2kzc n LYS 38 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2kzc n ALA 39 N 2.03 0.00 -0.22 7.82 0.00 -1.26 -4.97 120.51 123.92 2kzc n ALA 39 Ca 0.24 0.00 0.31 0.00 0.00 0.00 0.00 53.44 53.98 2kzc n ALA 39 Cb 0.37 0.00 0.73 0.00 0.00 0.00 0.00 19.45 20.55 2kzc n ALA 39 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 2kzc h ASP 40 N 0.00 0.00 -0.01 0.00 1.82 -1.80 -1.80 116.42 114.63 2kzc h ASP 40 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 2kzc h ASP 40 Cb 0.00 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.01 2kzc h ASP 40 CO 0.00 0.00 -0.13 2.22 -1.61 0.00 0.00 179.24 179.72 2kzc n PHE 41 N -4.07 0.00 0.01 0.28 1.16 -1.26 -4.68 117.46 108.90 2kzc n PHE 41 Ca 0.21 0.00 -0.18 0.00 -1.87 0.00 0.00 57.45 55.60 2kzc n PHE 41 Cb 1.10 0.00 -0.10 0.00 -1.61 0.00 0.00 39.48 38.86 2kzc n PHE 41 CO 0.00 0.00 0.00 0.93 -1.87 0.00 0.00 176.76 175.82 2kzc h GLU 42 N 2.16 0.56 -4.88 3.97 4.39 -1.70 -3.48 114.58 115.59 2kzc h GLU 42 Ca 0.00 -0.58 -0.45 0.00 0.34 0.00 0.00 59.36 58.67 2kzc h GLU 42 Cb 0.52 0.16 -0.13 0.00 -0.10 0.00 0.00 28.75 29.20 2kzc h GLU 42 CO 0.00 1.20 -0.51 -2.00 -1.16 0.00 0.00 179.01 176.54 2kzc s GLU 43 N -3.33 1.70 -0.34 2.33 -6.30 -1.26 -5.09 118.70 106.42 2kzc s GLU 43 Ca -0.12 -1.99 -0.28 0.00 -2.50 0.00 0.00 54.97 50.09 2kzc s GLU 43 Cb 0.05 0.22 -0.04 0.00 0.00 0.00 0.00 34.13 34.36 2kzc s GLU 43 CO 0.87 -0.60 2.12 0.00 0.02 0.00 0.00 175.26 177.67 2kzc s ALA 44 N -3.51 2.48 0.21 6.30 0.00 -1.26 -4.83 121.76 121.15 2kzc s ALA 44 Ca 0.39 0.36 0.00 0.00 0.00 0.00 0.00 51.96 52.71 2kzc s ALA 44 Cb 0.03 -4.14 0.00 0.00 0.00 0.00 0.00 23.12 19.01 2kzc s ALA 44 CO 0.24 -3.20 0.00 0.41 0.00 0.00 0.00 175.76 173.21 2kzc n GLY 45 N 5.72 -2.03 1.09 0.00 0.00 -1.26 -4.26 105.19 104.44 2kzc n GLY 45 Ca 0.29 -1.32 0.00 0.00 0.00 0.00 0.00 46.02 44.98 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 -3.10 0.00 0.08 1.61 1.44 -1.26 -3.25 115.22 110.74 2kzc n HIS 46 Ca -0.01 -0.51 -0.14 0.00 -2.01 0.00 0.00 57.72 55.04 2kzc n HIS 46 Cb 0.33 -0.27 -0.14 0.00 0.12 0.00 0.00 29.99 30.03 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 0.39 0.21 -0.22 -1.40 5.08 -1.95 -3.35 114.58 113.34 2kzc h GLU 47 Ca 0.00 -0.35 -0.08 0.00 -1.00 0.00 0.00 59.36 57.92 2kzc h GLU 47 Cb 0.89 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.26 2kzc h GLU 47 CO 0.00 1.12 -0.22 0.22 -1.00 0.00 0.00 179.01 179.13 2kzc h ASP 48 N 0.06 0.39 -0.83 1.42 3.58 -1.80 0.93 116.42 120.16 2kzc h ASP 48 Ca -0.15 -0.12 0.13 0.00 0.42 0.00 0.00 57.03 57.32 2kzc h ASP 48 Cb 1.95 -0.10 -0.06 0.00 1.72 0.00 0.00 39.33 42.84 2kzc h ASP 48 CO 0.17 0.62 0.54 0.58 -2.88 0.00 0.00 179.24 178.28 2kzc h VAL 49 N 0.35 0.85 -0.10 2.25 2.07 -1.77 -1.88 116.25 118.04 2kzc h VAL 49 Ca 0.06 -0.22 -0.10 0.00 0.82 0.00 0.00 66.70 67.26 2kzc h VAL 49 Cb 0.59 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.53 2kzc h VAL 49 CO 0.04 0.12 -0.33 0.24 0.02 0.00 0.00 177.57 177.65 2kzc h MET 50 N 0.64 0.40 -0.90 1.57 2.86 -0.96 -2.17 114.93 116.37 2kzc h MET 50 Ca 0.41 -0.30 0.02 0.00 -2.06 0.00 0.00 59.70 57.77 2kzc h MET 50 Cb 0.68 0.05 -0.05 0.00 0.06 0.00 0.00 31.60 32.34 2kzc h MET 50 CO -0.17 0.92 0.59 0.00 1.06 0.00 0.00 176.91 179.31 2kzc h ARG 51 N -0.04 1.13 0.35 1.72 3.08 -1.08 0.88 114.38 120.41 2kzc h ARG 51 Ca -0.01 -0.07 -0.00 0.00 0.07 0.00 0.00 59.98 59.97 2kzc h ARG 51 Cb 0.96 -0.25 -0.03 0.00 0.08 0.00 0.00 29.97 30.73 2kzc h ARG 51 CO 0.07 0.74 -0.44 -0.22 -1.07 0.00 0.00 179.97 179.05 2kzc h LYS 52 N 1.16 -0.80 -0.41 0.04 3.11 -1.31 -0.67 116.57 117.69 2kzc h LYS 52 Ca 0.35 0.05 -0.15 0.00 -2.81 0.00 0.00 60.65 58.09 2kzc h LYS 52 Cb -0.05 0.18 -0.01 0.00 -1.00 0.00 0.00 32.23 31.35 2kzc h LYS 52 CO -0.10 -0.53 -0.32 -0.24 -2.81 0.00 0.00 179.45 175.44 2kzc h VAL 53 N -0.83 1.27 -0.51 2.00 3.04 -1.01 -1.70 116.25 118.51 2kzc h VAL 53 Ca -0.03 -1.49 -0.08 0.00 -1.01 0.00 0.00 66.70 64.09 2kzc h VAL 53 Cb 0.76 1.30 -0.02 0.00 -2.01 0.00 0.00 31.29 31.32 2kzc h VAL 53 CO -0.12 0.50 -0.00 -0.07 -1.01 0.00 0.00 177.57 176.87 2kzc h LEU 54 N 0.77 0.82 -0.22 3.16 -0.00 -0.75 0.18 115.31 119.28 2kzc h LEU 54 Ca 0.08 -0.21 -0.05 0.00 -0.00 0.00 0.00 57.88 57.70 2kzc h LEU 54 Cb 0.90 -0.22 -0.01 0.00 -0.00 0.00 0.00 40.66 41.34 2kzc h LEU 54 CO 0.08 0.89 -0.04 1.23 -0.00 0.00 0.00 178.44 180.60 2kzc h GLY 55 N 0.99 0.45 2.00 0.83 0.00 -0.97 -1.60 103.07 104.76 2kzc h GLY 55 Ca 0.15 -0.36 -0.02 0.00 0.00 0.00 0.00 47.33 47.10 2kzc h GLY 55 CO 0.02 0.33 -0.08 -0.55 0.00 0.00 0.00 176.54 176.27 2kzc h ASP 56 N 0.15 0.00 0.64 0.19 3.32 -1.09 -2.70 116.42 116.93 2kzc h ASP 56 Ca 0.06 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 56.94 2kzc h ASP 56 Cb 0.49 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.02 2kzc h ASP 56 CO 0.02 0.08 -0.77 -0.07 -1.72 0.00 0.00 179.24 176.77 2kzc h LEU 57 N 0.00 0.13 1.62 1.55 3.38 -0.48 -3.48 115.31 118.02 2kzc h LEU 57 Ca -0.00 -0.09 -0.41 0.00 0.09 0.00 0.00 57.88 57.47 2kzc h LEU 57 Cb 0.72 -0.04 -0.11 0.00 0.09 0.00 0.00 40.66 41.32 2kzc h LEU 57 CO 0.01 0.85 -0.42 -0.67 0.09 0.00 0.00 178.44 178.29 2kzc n ASP 58 N -3.68 -5.53 0.00 -0.43 2.03 -0.62 -0.65 116.55 107.67 2kzc n ASP 58 Ca -0.02 0.32 0.00 0.00 0.52 0.00 0.00 54.79 55.61 2kzc n ASP 58 Cb 0.74 -4.72 0.00 0.00 -0.72 0.00 0.00 41.12 36.42 2kzc n ASP 58 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2kzc n GLY 59 N -0.68 0.79 0.22 0.27 0.00 -1.26 -5.00 105.19 99.53 2kzc n GLY 59 Ca -0.21 0.00 0.09 0.00 0.00 0.00 0.00 46.02 45.89 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 4.36 0.00 -3.14 1.61 1.57 -1.24 -3.44 116.57 116.30 2kzc h LYS 60 Ca 0.00 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.64 2kzc h LYS 60 Cb 0.00 0.00 -0.22 0.00 0.08 0.00 0.00 32.23 32.09 2kzc h LYS 60 CO 0.00 0.26 -0.36 1.03 -0.57 0.00 0.00 179.45 179.81 2kzc s ARG 61 N -3.78 0.51 0.42 3.15 1.81 -1.26 -5.10 118.95 114.68 2kzc s ARG 61 Ca -0.01 -0.02 -0.26 0.00 -1.72 0.00 0.00 55.73 53.72 2kzc s ARG 61 Cb 0.11 0.23 -0.09 0.00 -0.45 0.00 0.00 34.95 34.76 2kzc s ARG 61 CO 0.65 -0.12 1.33 -1.25 -0.68 0.00 0.00 175.30 175.23 2kzc s PRO 62 N -0.81 3.91 0.40 3.54 0.04 -1.26 -4.90 135.00 135.92 2kzc s PRO 62 Ca -0.09 2.21 0.15 0.00 0.04 0.00 0.00 61.00 63.31 2kzc s PRO 62 Cb -0.05 -2.73 1.02 0.00 0.04 0.00 0.00 34.50 32.78 2kzc s PRO 62 CO 0.02 -0.56 1.87 1.49 0.04 0.00 0.00 177.00 179.86 2kzc h GLU 63 N 2.60 0.46 -0.28 4.56 4.81 -2.00 -1.92 114.58 122.81 2kzc h GLU 63 Ca -0.50 -0.03 0.06 0.00 -0.13 0.00 0.00 59.36 58.77 2kzc h GLU 63 Cb 1.25 -0.10 -0.07 0.00 0.63 0.00 0.00 28.75 30.46 2kzc h GLU 63 CO 0.62 0.30 -0.16 0.00 -0.73 0.00 0.00 179.01 179.04 2kzc h ALA 64 N 1.62 0.05 -0.36 2.92 0.00 -2.00 0.21 119.26 121.70 2kzc h ALA 64 Ca 0.45 0.10 -0.11 0.00 0.00 0.00 0.00 54.91 55.35 2kzc h ALA 64 Cb 1.02 0.37 -0.01 0.00 0.00 0.00 0.00 17.79 19.17 2kzc h ALA 64 CO -0.18 -0.56 -0.25 1.49 0.00 0.00 0.00 179.25 179.75 2kzc h GLU 65 N -0.13 0.72 0.05 0.00 4.81 -1.74 -3.08 114.58 115.21 2kzc h GLU 65 Ca 0.15 -0.30 -0.00 0.00 -0.13 0.00 0.00 59.36 59.08 2kzc h GLU 65 Cb 0.36 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.71 2kzc h GLU 65 CO -0.36 0.90 -0.02 0.28 -0.73 0.00 0.00 179.01 179.07 2kzc h VAL 66 N 0.63 1.29 -0.93 0.32 2.07 -1.03 -2.69 116.25 115.90 2kzc h VAL 66 Ca 0.08 -1.30 0.00 0.00 0.82 0.00 0.00 66.70 66.31 2kzc h VAL 66 Cb 0.74 2.13 -0.05 0.00 -1.52 0.00 0.00 31.29 32.60 2kzc h VAL 66 CO 0.06 0.32 0.60 0.08 0.02 0.00 0.00 177.57 178.65 2kzc h ARG 67 N -0.66 1.24 -0.36 1.57 0.11 -0.69 -2.50 114.38 113.08 2kzc h ARG 67 Ca -0.01 -0.09 0.03 0.00 0.10 0.00 0.00 59.98 60.01 2kzc h ARG 67 Cb 0.57 -0.27 -0.03 0.00 1.11 0.00 0.00 29.97 31.35 2kzc h ARG 67 CO 0.01 0.83 0.18 0.00 0.10 0.00 0.00 179.97 181.10 2kzc h ALA 68 N 1.33 0.44 -0.43 0.08 0.00 -1.57 -0.61 119.26 118.50 2kzc h ALA 68 Ca 0.34 0.01 0.08 0.00 0.00 0.00 0.00 54.91 55.35 2kzc h ALA 68 Cb -0.12 -0.06 -0.10 0.00 0.00 0.00 0.00 17.79 17.52 2kzc h ALA 68 CO -0.07 -0.19 -0.32 -0.22 0.00 0.00 0.00 179.25 178.45 2kzc h LYS 69 N 0.37 -0.22 0.31 0.00 1.63 -1.10 -0.93 116.57 116.62 2kzc h LYS 69 Ca 0.15 0.02 -0.02 0.00 -0.85 0.00 0.00 60.65 59.95 2kzc h LYS 69 Cb 0.06 0.05 0.00 0.00 -0.60 0.00 0.00 32.23 31.74 2kzc h LYS 69 CO -0.10 -0.15 -0.15 -0.92 -3.45 0.00 0.00 179.45 174.68 2kzc h TYR 70 N -0.23 -0.39 -0.86 1.91 3.20 -1.16 -3.04 116.97 116.40 2kzc h TYR 70 Ca 0.18 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.10 2kzc h TYR 70 Cb 0.54 0.13 -0.05 0.00 1.54 0.00 0.00 36.73 38.88 2kzc h TYR 70 CO -0.55 -0.05 0.56 0.93 -1.64 0.00 0.00 178.16 177.41 2kzc h GLU 71 N -0.79 0.98 0.00 1.82 4.39 -1.11 -0.94 114.58 118.93 2kzc h GLU 71 Ca -0.04 -0.06 -0.06 0.00 0.34 0.00 0.00 59.36 59.54 2kzc h GLU 71 Cb 0.51 -0.22 -0.01 0.00 -0.10 0.00 0.00 28.75 28.93 2kzc h GLU 71 CO 0.07 0.65 -0.29 0.78 -1.16 0.00 0.00 179.01 179.06 2kzc h GLY 72 N 1.01 0.00 2.00 -3.84 0.00 -1.20 -3.33 103.07 97.71 2kzc h GLY 72 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.69 2kzc h GLY 72 CO -0.12 0.00 0.00 -0.10 0.00 0.00 0.00 176.54 176.32 2kzc n LEU 73 N -3.69 0.77 -0.09 3.11 7.94 -0.36 -3.56 117.00 121.12 2kzc n LEU 73 Ca -0.01 0.64 -0.06 0.00 -1.11 0.00 0.00 56.01 55.47 2kzc n LEU 73 Cb 0.40 -0.48 0.00 0.00 0.53 0.00 0.00 43.42 43.87 2kzc n LEU 73 CO 0.35 -0.44 0.78 -0.03 -1.11 0.00 0.00 177.39 176.95 2kzc h MET 74 N 0.00 -0.03 0.04 1.96 4.05 -1.70 0.20 114.93 119.44 2kzc h MET 74 Ca 0.00 0.00 -0.22 0.00 -0.28 0.00 0.00 59.70 59.20 2kzc h MET 74 Cb 0.51 0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 31.31 2kzc h MET 74 CO 0.00 -0.02 -1.01 0.00 0.23 0.00 0.00 176.91 176.11 2kzc h ALA 75 N 1.27 0.36 0.18 0.39 0.00 -1.88 -2.57 119.26 117.01 2kzc h ALA 75 Ca 0.16 -0.81 -0.00 0.00 0.00 0.00 0.00 54.91 54.26 2kzc h ALA 75 Cb 0.28 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2kzc h ALA 75 CO -0.36 1.00 -0.12 0.28 0.00 0.00 0.00 179.25 180.05 2kzc h VAL 76 N 0.08 0.73 -0.69 0.00 2.07 -1.57 -0.33 116.25 116.55 2kzc h VAL 76 Ca -0.06 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.49 2kzc h VAL 76 Cb 1.69 0.73 -0.05 0.00 -1.52 0.00 0.00 31.29 32.15 2kzc h VAL 76 CO 0.15 0.00 0.43 0.00 0.02 0.00 0.00 177.57 178.17 2kzc h ALA 77 N 0.50 0.91 -0.07 1.67 0.00 -0.66 -0.39 119.26 121.23 2kzc h ALA 77 Ca -0.01 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 2kzc h ALA 77 Cb 0.26 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2kzc h ALA 77 CO 0.01 0.18 -0.42 0.87 0.00 0.00 0.00 179.25 179.89 2kzc h LYS 78 N 0.82 0.15 0.03 0.00 1.57 -1.28 -2.00 116.57 115.87 2kzc h LYS 78 Ca 0.29 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.99 2kzc h LYS 78 Cb 0.05 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.36 2kzc h LYS 78 CO -0.12 0.55 -0.01 0.00 -0.57 0.00 0.00 179.45 179.29 2kzc h ALA 79 N 1.45 -0.04 -0.83 3.86 0.00 -0.11 -3.16 119.26 120.43 2kzc h ALA 79 Ca 0.01 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 54.86 2kzc h ALA 79 Cb 0.79 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.55 2kzc h ALA 79 CO 0.06 -0.42 0.54 1.96 0.00 0.00 0.00 179.25 181.39 2kzc h GLN 80 N -0.23 0.98 -0.33 0.00 4.20 -0.81 0.64 115.11 119.56 2kzc h GLN 80 Ca -0.00 -0.06 -0.07 0.00 0.06 0.00 0.00 58.65 58.58 2kzc h GLN 80 Cb 0.21 -0.22 -0.02 0.00 0.30 0.00 0.00 27.48 27.76 2kzc h GLN 80 CO 0.01 0.65 -0.08 -0.07 -0.67 0.00 0.00 178.83 178.67 2kzc h LEU 81 N 1.01 0.52 0.00 1.46 3.38 -1.40 0.21 115.31 120.49 2kzc h LEU 81 Ca 0.33 -0.12 -0.25 0.00 0.09 0.00 0.00 57.88 57.93 2kzc h LEU 81 Cb 0.06 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 2kzc h LEU 81 CO -0.10 0.65 -1.11 0.24 0.09 0.00 0.00 178.44 178.20 2kzc h MET 82 N 0.51 0.25 -0.33 1.13 2.86 -1.26 -3.22 114.93 114.87 2kzc h MET 82 Ca 0.10 -0.37 -0.09 0.00 -2.06 0.00 0.00 59.70 57.29 2kzc h MET 82 Cb 0.45 0.13 -0.02 0.00 0.06 0.00 0.00 31.60 32.22 2kzc h MET 82 CO 0.02 1.14 -0.15 0.22 1.06 0.00 0.00 176.91 179.20 2kzc h ASP 83 N 0.09 0.58 0.12 1.22 1.82 -0.41 -3.01 116.42 116.84 2kzc h ASP 83 Ca -0.10 -0.17 0.00 0.00 -0.39 0.00 0.00 57.03 56.37 2kzc h ASP 83 Cb 1.81 -0.16 0.00 0.00 0.68 0.00 0.00 39.33 41.67 2kzc h ASP 83 CO 0.18 0.76 -0.03 -0.62 -1.61 0.00 0.00 179.24 177.92 2kzc n GLU 84 N -4.17 1.05 0.00 0.28 -0.58 0.69 -5.07 120.64 112.84 2kzc n GLU 84 Ca 0.01 -0.28 0.07 0.00 -0.42 0.00 0.00 57.16 56.53 2kzc n GLU 84 Cb 0.36 -1.49 0.39 0.00 -0.57 0.00 0.00 31.44 30.12 2kzc n GLU 84 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93