#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kzc h MET 2 N 0.00 -0.29 0.00 1.61 1.85 -2.03 -0.84 114.93 115.22 2kzc h MET 2 Ca 0.00 0.02 0.00 0.00 -0.61 0.00 0.00 59.70 59.11 2kzc h MET 2 Cb 0.00 0.07 0.00 0.00 0.43 0.00 0.00 31.60 32.10 2kzc h MET 2 CO 0.00 -0.20 0.00 1.04 -0.40 0.00 0.00 176.91 177.35 2kzc n GLN 3 N -5.37 0.20 0.00 0.39 3.00 -1.26 -0.50 117.38 113.85 2kzc n GLN 3 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.98 2kzc n GLN 3 Cb 0.33 -1.23 0.00 0.00 0.00 0.00 0.00 30.24 29.35 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 -0.73 0.00 0.23 1.08 3.01 -0.86 -4.44 117.46 115.76 2kzc n PHE 4 Ca 0.02 0.00 -0.15 0.00 1.01 0.00 0.00 57.45 58.33 2kzc n PHE 4 Cb 0.01 0.05 -0.08 0.00 -0.01 0.00 0.00 39.48 39.45 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 -0.51 -0.31 -1.08 1.79 -0.71 -0.56 116.57 115.20 2kzc h LYS 5 Ca 0.00 0.03 0.04 0.00 -2.18 0.00 0.00 60.65 58.54 2kzc h LYS 5 Cb 0.67 0.12 -0.04 0.00 -1.58 0.00 0.00 32.23 31.40 2kzc h LYS 5 CO 0.00 -0.33 0.08 0.00 -1.08 0.00 0.00 179.45 178.13 2kzc h ALA 6 N 0.06 0.34 0.09 3.86 0.00 -1.02 -1.80 119.26 120.78 2kzc h ALA 6 Ca -0.05 0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.92 2kzc h ALA 6 Cb 0.42 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 2kzc h ALA 6 CO 0.09 -0.32 -0.47 0.93 0.00 0.00 0.00 179.25 179.47 2kzc h GLU 7 N 0.20 -0.64 -0.34 0.00 4.39 -1.70 0.24 114.58 116.74 2kzc h GLU 7 Ca 0.14 0.04 0.06 0.00 0.34 0.00 0.00 59.36 59.95 2kzc h GLU 7 Cb 0.14 0.15 -0.06 0.00 -0.10 0.00 0.00 28.75 28.88 2kzc h GLU 7 CO -0.17 -0.43 -0.01 0.00 -1.16 0.00 0.00 179.01 177.25 2kzc h ALA 8 N -0.64 0.30 -0.10 3.43 0.00 -0.93 0.40 119.26 121.72 2kzc h ALA 8 Ca -0.00 0.10 -0.10 0.00 0.00 0.00 0.00 54.91 54.91 2kzc h ALA 8 Cb 0.67 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 2kzc h ALA 8 CO -0.27 -0.41 -0.37 -0.09 0.00 0.00 0.00 179.25 178.12 2kzc h ARG 9 N 0.09 0.21 0.45 0.00 9.65 -1.08 0.11 114.38 123.82 2kzc h ARG 9 Ca 0.16 -0.09 -0.02 0.00 -1.10 0.00 0.00 59.98 58.93 2kzc h ARG 9 Cb 0.23 -0.01 0.00 0.00 -1.39 0.00 0.00 29.97 28.80 2kzc h ARG 9 CO -0.28 0.56 -0.22 -0.09 2.80 0.00 0.00 179.97 182.74 2kzc h ARG 10 N 0.18 -0.59 -0.54 0.20 1.12 0.97 0.29 114.38 116.01 2kzc h ARG 10 Ca 0.02 0.04 -0.09 0.00 -1.11 0.00 0.00 59.98 58.84 2kzc h ARG 10 Cb 0.74 0.13 -0.02 0.00 -0.01 0.00 0.00 29.97 30.82 2kzc h ARG 10 CO 0.06 -0.33 -0.01 -0.91 -3.11 0.00 0.00 179.97 175.66 2kzc h ASN 11 N -0.74 0.90 0.29 -3.80 2.35 -0.94 -2.51 115.58 111.15 2kzc h ASN 11 Ca -0.06 -0.25 -0.01 0.00 -0.55 0.00 0.00 56.30 55.43 2kzc h ASN 11 Cb 0.53 -0.24 -0.00 0.00 0.05 0.00 0.00 38.32 38.65 2kzc h ASN 11 CO 0.10 0.97 -0.18 0.50 -1.65 0.00 0.00 177.43 177.18 2kzc h LYS 12 N 0.85 -0.44 -0.38 0.81 3.64 -0.66 -2.92 116.57 117.48 2kzc h LYS 12 Ca 0.16 0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.58 2kzc h LYS 12 Cb 0.53 0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.42 2kzc h LYS 12 CO 0.03 -0.29 0.26 -0.07 -2.27 0.00 0.00 179.45 177.10 2kzc h LEU 13 N -0.45 0.39 0.06 5.20 3.38 -0.79 -2.61 115.31 120.49 2kzc h LEU 13 Ca -0.03 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 57.96 2kzc h LEU 13 Cb 0.37 -0.09 -0.05 0.00 0.09 0.00 0.00 40.66 40.98 2kzc h LEU 13 CO 0.03 0.27 -0.43 -0.03 0.09 0.00 0.00 178.44 178.37 2kzc h MET 14 N 0.45 -0.61 -0.54 1.13 4.05 -1.25 -2.69 114.93 115.48 2kzc h MET 14 Ca 0.15 0.04 0.13 0.00 -0.28 0.00 0.00 59.70 59.74 2kzc h MET 14 Cb 0.04 0.14 -0.03 0.00 -0.80 0.00 0.00 31.60 30.95 2kzc h MET 14 CO -0.03 -0.40 0.38 0.78 0.23 0.00 0.00 176.91 177.86 2kzc h GLY 15 N -0.63 0.21 0.92 1.39 0.00 -1.47 -1.48 103.07 102.02 2kzc h GLY 15 Ca 0.03 -0.06 -0.02 0.00 0.00 0.00 0.00 47.33 47.28 2kzc h GLY 15 CO -0.29 0.03 0.13 1.41 0.00 0.00 0.00 176.54 177.82 2kzc h LEU 16 N 0.13 0.48 -0.19 3.11 -0.00 -1.47 0.11 115.31 117.49 2kzc h LEU 16 Ca 0.26 -0.18 0.01 0.00 -0.00 0.00 0.00 57.88 57.97 2kzc h LEU 16 Cb 0.83 -0.12 -0.02 0.00 -0.00 0.00 0.00 40.66 41.35 2kzc h LEU 16 CO -0.03 0.53 0.09 -0.25 -0.00 0.00 0.00 178.44 178.77 2kzc h TRP 17 N 0.40 0.16 -0.33 1.13 7.01 -1.25 -2.95 115.95 120.13 2kzc h TRP 17 Ca 0.11 0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.11 2kzc h TRP 17 Cb 0.21 -0.05 -0.02 0.00 -2.10 0.00 0.00 29.16 27.20 2kzc h TRP 17 CO -0.00 0.09 0.16 0.28 -2.79 0.00 0.00 178.44 176.18 2kzc h VAL 18 N 0.19 1.16 -0.69 2.65 2.07 -1.22 -2.18 116.25 118.24 2kzc h VAL 18 Ca 0.08 -0.47 0.08 0.00 0.82 0.00 0.00 66.70 67.21 2kzc h VAL 18 Cb 0.02 0.86 -0.07 0.00 -1.52 0.00 0.00 31.29 30.59 2kzc h VAL 18 CO -0.06 0.17 0.35 0.00 0.02 0.00 0.00 177.57 178.06 2kzc h ALA 19 N 1.01 0.95 -0.77 1.67 0.00 -0.73 0.16 119.26 121.55 2kzc h ALA 19 Ca 0.11 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 2kzc h ALA 19 Cb 0.13 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 2kzc h ALA 19 CO -0.01 -0.03 0.39 1.49 0.00 0.00 0.00 179.25 181.09 2kzc h GLU 20 N 0.62 1.09 0.00 0.00 4.81 -1.33 0.14 114.58 119.91 2kzc h GLU 20 Ca 0.33 -0.15 -0.02 0.00 -0.13 0.00 0.00 59.36 59.40 2kzc h GLU 20 Cb 0.32 -0.20 -0.00 0.00 0.63 0.00 0.00 28.75 29.49 2kzc h GLU 20 CO -0.25 0.83 -0.09 0.28 -0.73 0.00 0.00 179.01 179.06 2kzc h VAL 21 N 1.07 0.38 -0.01 0.32 2.07 -0.51 -1.99 116.25 117.57 2kzc h VAL 21 Ca 0.27 -0.51 0.00 0.00 0.82 0.00 0.00 66.70 67.27 2kzc h VAL 21 Cb 0.09 1.37 0.00 0.00 -1.52 0.00 0.00 31.29 31.23 2kzc h VAL 21 CO -0.04 0.09 -0.17 0.18 0.02 0.00 0.00 177.57 177.65 2kzc n LEU 22 N -3.43 1.61 -1.52 2.57 4.32 -0.10 -4.96 117.00 115.49 2kzc n LEU 22 Ca -0.01 -0.52 -0.19 0.00 -0.02 0.00 0.00 56.01 55.27 2kzc n LEU 22 Cb 0.25 -0.05 -0.07 0.00 -1.62 0.00 0.00 43.42 41.93 2kzc n LEU 22 CO 0.28 0.28 -0.19 0.61 -1.22 0.00 0.00 177.39 177.16 2kzc n GLY 23 N 1.30 1.53 3.74 -0.72 0.00 -0.48 -5.00 105.19 105.56 2kzc n GLY 23 Ca 0.14 -0.12 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 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 -3.75 2.09 0.22 1.61 1.02 -0.08 -4.99 119.74 115.85 2kzc s LYS 24 Ca 0.00 1.36 -0.07 0.00 0.02 0.00 0.00 55.97 57.27 2kzc s LYS 24 Cb 0.00 -1.86 -0.02 0.00 -0.52 0.00 0.00 37.83 35.43 2kzc s LYS 24 CO 0.00 -1.80 0.31 -1.12 -0.92 0.00 0.00 175.35 171.82 2kzc s SER 25 N -2.94 0.03 1.51 2.83 0.01 -1.26 -4.28 113.70 109.60 2kzc s SER 25 Ca 0.65 -1.11 0.00 0.00 1.31 0.00 0.00 55.95 56.80 2kzc s SER 25 Cb -0.20 0.48 0.00 0.00 0.21 0.00 0.00 66.02 66.51 2kzc s SER 25 CO 0.52 -0.98 0.00 0.61 0.41 0.00 0.00 173.24 173.80 2kzc n GLY 26 N -0.31 3.31 0.16 3.44 0.00 -1.26 -1.77 105.19 108.75 2kzc n GLY 26 Ca -0.01 -0.13 -0.01 0.00 0.00 0.00 0.00 46.02 45.87 2kzc n GLY 26 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2kzc h ASP 27 N 1.50 0.05 0.04 1.61 3.58 -1.99 -2.63 116.42 118.58 2kzc h ASP 27 Ca 0.00 -0.03 0.02 0.00 0.42 0.00 0.00 57.03 57.45 2kzc h ASP 27 Cb 0.00 -0.01 -0.03 0.00 1.72 0.00 0.00 39.33 41.00 2kzc h ASP 27 CO 0.00 0.58 -0.19 -0.33 -2.88 0.00 0.00 179.24 176.42 2kzc h GLU 28 N 0.04 -0.32 0.00 0.28 4.39 -1.88 0.18 114.58 117.26 2kzc h GLU 28 Ca -0.00 0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.72 2kzc h GLU 28 Cb 0.97 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.69 2kzc h GLU 28 CO 0.07 -0.22 0.00 0.00 -1.16 0.00 0.00 179.01 177.71 2kzc n ALA 29 N -2.53 1.27 -0.04 3.43 0.00 -0.73 -1.35 120.51 120.57 2kzc n ALA 29 Ca -0.06 -0.02 -0.00 0.00 0.00 0.00 0.00 53.44 53.36 2kzc n ALA 29 Cb 0.24 -1.09 -0.12 0.00 0.00 0.00 0.00 19.45 18.49 2kzc n ALA 29 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2kzc n ASN 30 N -1.46 1.50 -0.05 0.00 3.02 -0.71 -4.40 115.26 113.15 2kzc n ASN 30 Ca 0.01 0.00 -0.12 0.00 -0.03 0.00 0.00 54.58 54.45 2kzc n ASN 30 Cb 0.06 1.24 -0.06 0.00 -0.61 0.00 0.00 39.78 40.41 2kzc n ASN 30 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2kzc h ALA 31 N 1.02 0.22 -0.96 5.41 0.00 0.61 -3.21 119.26 122.35 2kzc h ALA 31 Ca -0.21 -0.22 0.10 0.00 0.00 0.00 0.00 54.91 54.58 2kzc h ALA 31 Cb 1.34 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 18.99 2kzc h ALA 31 CO 0.01 -0.04 0.61 -0.92 0.00 0.00 0.00 179.25 178.91 2kzc h TYR 32 N 0.01 1.07 -0.73 0.00 3.20 -1.57 -1.75 116.97 117.21 2kzc h TYR 32 Ca 0.04 0.03 0.06 0.00 3.14 0.00 0.00 58.73 62.00 2kzc h TYR 32 Cb 0.44 -0.34 -0.04 0.00 1.54 0.00 0.00 36.73 38.32 2kzc h TYR 32 CO 0.05 0.47 0.48 0.00 -1.64 0.00 0.00 178.16 177.52 2kzc h ALA 33 N 1.53 1.67 -0.27 1.82 0.00 -1.76 -1.77 119.26 120.48 2kzc h ALA 33 Ca 0.45 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.29 2kzc h ALA 33 Cb 0.41 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2kzc h ALA 33 CO -0.21 0.22 -0.06 0.00 0.00 0.00 0.00 179.25 179.20 2kzc h ALA 34 N 1.60 1.40 0.60 0.00 0.00 -1.41 -1.06 119.26 120.39 2kzc h ALA 34 Ca 0.31 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 2kzc h ALA 34 Cb 0.22 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 17.89 2kzc h ALA 34 CO -0.10 0.42 -0.29 0.93 0.00 0.00 0.00 179.25 180.21 2kzc h GLU 35 N 0.41 -0.78 -0.12 0.00 5.08 -1.42 -3.16 114.58 114.60 2kzc h GLU 35 Ca 0.09 0.05 0.04 0.00 -1.00 0.00 0.00 59.36 58.53 2kzc h GLU 35 Cb 0.37 0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.79 2kzc h GLU 35 CO 0.02 -0.47 0.11 0.28 -1.00 0.00 0.00 179.01 177.95 2kzc h VAL 36 N -0.98 0.66 0.00 3.13 2.07 -1.15 -0.61 116.25 119.37 2kzc h VAL 36 Ca -0.08 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.32 2kzc h VAL 36 Cb 0.67 0.92 -0.02 0.00 -1.52 0.00 0.00 31.29 31.34 2kzc h VAL 36 CO 0.14 0.00 -0.56 0.58 0.02 0.00 0.00 177.57 177.75 2kzc h VAL 37 N 0.00 1.40 -3.05 2.57 2.07 -1.17 -3.37 116.25 114.69 2kzc h VAL 37 Ca 0.06 -1.91 -0.56 0.00 0.82 0.00 0.00 66.70 65.11 2kzc h VAL 37 Cb 0.28 2.03 -0.08 0.00 -1.52 0.00 0.00 31.29 32.00 2kzc h VAL 37 CO -0.00 0.54 0.94 -0.75 0.02 0.00 0.00 177.57 178.33 2kzc s LYS 38 N -3.76 3.44 0.00 1.57 2.20 -0.24 -4.30 119.74 118.65 2kzc s LYS 38 Ca -0.02 0.10 0.00 0.00 -0.36 0.00 0.00 55.97 55.70 2kzc s LYS 38 Cb 0.13 -4.05 0.00 0.00 -1.51 0.00 0.00 37.83 32.40 2kzc s LYS 38 CO 0.75 -1.74 0.00 0.00 -0.36 0.00 0.00 175.35 174.00 2kzc n ALA 39 N 8.48 0.00 0.24 3.13 0.00 -1.26 -4.93 120.51 126.18 2kzc n ALA 39 Ca 0.07 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.64 2kzc n ALA 39 Cb 0.49 0.00 0.69 0.00 0.00 0.00 0.00 19.45 20.62 2kzc n ALA 39 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 2kzc h ASP 40 N 0.00 0.00 0.00 0.00 2.03 -1.85 -1.37 116.42 115.23 2kzc h ASP 40 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 2kzc h ASP 40 Cb 0.00 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.50 2kzc h ASP 40 CO 0.00 0.00 0.00 2.22 -1.03 0.00 0.00 179.24 180.43 2kzc n PHE 41 N -2.50 0.00 -0.05 4.15 1.16 -1.26 -4.83 117.46 114.13 2kzc n PHE 41 Ca -0.02 -0.28 -0.02 0.00 -1.87 0.00 0.00 57.45 55.27 2kzc n PHE 41 Cb 0.22 -0.03 -0.01 0.00 -1.61 0.00 0.00 39.48 38.06 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 0.00 0.00 -2.93 3.97 4.39 -1.62 -3.49 114.58 114.90 2kzc h GLU 42 Ca 0.00 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 59.57 2kzc h GLU 42 Cb 0.43 0.00 -0.24 0.00 -0.10 0.00 0.00 28.75 28.84 2kzc h GLU 42 CO 0.00 0.00 -0.30 -2.00 -1.16 0.00 0.00 179.01 175.55 2kzc s GLU 43 N -1.68 0.46 0.77 2.33 2.12 -1.25 -5.12 118.70 116.33 2kzc s GLU 43 Ca -0.06 0.34 0.00 0.00 0.36 0.00 0.00 54.97 55.61 2kzc s GLU 43 Cb 0.01 0.22 0.00 0.00 0.26 0.00 0.00 34.13 34.62 2kzc s GLU 43 CO 0.08 -0.08 0.00 0.00 -0.54 0.00 0.00 175.26 174.73 2kzc n ALA 44 N 2.55 -2.62 -2.79 6.30 0.00 -1.26 -3.91 120.51 118.78 2kzc n ALA 44 Ca -0.15 0.31 -0.43 0.00 0.00 0.00 0.00 53.44 53.17 2kzc n ALA 44 Cb 0.57 -0.90 -0.03 0.00 0.00 0.00 0.00 19.45 19.10 2kzc n ALA 44 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2kzc s GLY 45 N -6.52 1.55 -0.49 0.00 0.00 -1.26 -4.46 107.32 96.14 2kzc s GLY 45 Ca 0.00 -2.32 0.00 0.00 0.00 0.00 0.00 44.72 42.40 2kzc s GLY 45 CO 0.00 2.24 0.00 1.42 0.00 0.00 0.00 173.10 176.76 2kzc n HIS 46 N 7.63 -1.04 -0.05 1.90 8.25 -1.26 -4.81 115.22 125.83 2kzc n HIS 46 Ca 0.18 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.50 2kzc n HIS 46 Cb 0.49 -1.61 -0.12 0.00 1.12 0.00 0.00 29.99 29.86 2kzc n HIS 46 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 2kzc h GLU 47 N 0.00 0.02 -0.94 -0.41 4.57 -1.78 -2.77 114.58 113.27 2kzc h GLU 47 Ca -0.10 -0.02 0.05 0.00 -1.18 0.00 0.00 59.36 58.11 2kzc h GLU 47 Cb 0.53 0.01 -0.06 0.00 -0.16 0.00 0.00 28.75 29.07 2kzc h GLU 47 CO 0.14 0.84 0.61 0.22 -1.18 0.00 0.00 179.01 179.64 2kzc h ASP 48 N -0.80 0.98 -0.07 1.04 3.58 -1.87 -0.07 116.42 119.22 2kzc h ASP 48 Ca -0.00 -0.00 0.03 0.00 0.42 0.00 0.00 57.03 57.47 2kzc h ASP 48 Cb 0.85 -0.21 -0.03 0.00 1.72 0.00 0.00 39.33 41.65 2kzc h ASP 48 CO 0.01 0.65 -0.12 0.58 -2.88 0.00 0.00 179.24 177.48 2kzc h VAL 49 N 1.12 0.69 -0.12 2.25 2.07 -1.78 0.13 116.25 120.61 2kzc h VAL 49 Ca 0.39 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.90 2kzc h VAL 49 Cb 0.11 0.69 -0.00 0.00 -1.52 0.00 0.00 31.29 30.56 2kzc h VAL 49 CO -0.14 0.00 0.02 0.24 0.02 0.00 0.00 177.57 177.71 2kzc h MET 50 N -0.17 0.20 -0.52 1.57 2.86 -0.96 -2.55 114.93 115.36 2kzc h MET 50 Ca 0.07 -0.05 0.04 0.00 -2.06 0.00 0.00 59.70 57.69 2kzc h MET 50 Cb 0.26 -0.02 -0.04 0.00 0.06 0.00 0.00 31.60 31.85 2kzc h MET 50 CO -0.17 0.40 0.28 -0.09 1.06 0.00 0.00 176.91 178.39 2kzc h ARG 51 N -0.02 0.52 0.34 1.72 2.43 -0.88 -0.43 114.38 118.05 2kzc h ARG 51 Ca 0.04 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2kzc h ARG 51 Cb 0.29 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.69 2kzc h ARG 51 CO 0.00 0.35 -0.51 -0.22 -1.51 0.00 0.00 179.97 178.08 2kzc h LYS 52 N 0.54 -0.86 0.00 0.20 3.11 -0.63 0.68 116.57 119.61 2kzc h LYS 52 Ca 0.22 0.06 -0.09 0.00 -2.81 0.00 0.00 60.65 58.03 2kzc h LYS 52 Cb 0.11 0.20 -0.01 0.00 -1.00 0.00 0.00 32.23 31.52 2kzc h LYS 52 CO -0.14 -0.58 -0.45 -0.24 -2.81 0.00 0.00 179.45 175.24 2kzc h VAL 53 N -0.90 1.06 -0.01 2.00 3.04 -1.28 -0.84 116.25 119.32 2kzc h VAL 53 Ca -0.04 -1.68 -0.11 0.00 -1.01 0.00 0.00 66.70 63.86 2kzc h VAL 53 Cb 0.82 1.98 0.01 0.00 -2.01 0.00 0.00 31.29 32.09 2kzc h VAL 53 CO -0.16 0.44 -0.42 -0.07 -1.01 0.00 0.00 177.57 176.34 2kzc h LEU 54 N 0.00 0.40 -0.37 3.16 3.38 -0.91 -2.45 115.31 118.52 2kzc h LEU 54 Ca -0.00 -0.74 -0.01 0.00 0.09 0.00 0.00 57.88 57.21 2kzc h LEU 54 Cb 0.94 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.55 2kzc h LEU 54 CO 0.06 1.09 0.19 1.23 0.09 0.00 0.00 178.44 181.10 2kzc h GLY 55 N -0.25 0.55 2.00 0.83 0.00 -0.73 -1.63 103.07 103.84 2kzc h GLY 55 Ca -0.05 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.02 2kzc h GLY 55 CO 0.08 0.25 0.00 1.22 0.00 0.00 0.00 176.54 178.09 2kzc n ASP 56 N -4.75 0.15 0.13 0.19 8.00 -0.33 -1.49 116.55 118.46 2kzc n ASP 56 Ca -0.00 0.55 0.04 0.00 0.71 0.00 0.00 54.79 56.08 2kzc n ASP 56 Cb 0.09 -0.58 0.03 0.00 -0.02 0.00 0.00 41.12 40.64 2kzc n ASP 56 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 2kzc h LEU 57 N 0.00 0.00 2.08 0.64 3.38 -0.79 -3.48 115.31 117.13 2kzc h LEU 57 Ca 0.00 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.63 2kzc h LEU 57 Cb 0.20 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.88 2kzc h LEU 57 CO 0.00 0.41 -0.39 -0.67 0.09 0.00 0.00 178.44 177.88 2kzc n ASP 58 N -3.12 -4.79 -0.18 -0.43 2.03 -0.55 -0.88 116.55 108.64 2kzc n ASP 58 Ca 0.00 0.22 0.00 0.00 0.52 0.00 0.00 54.79 55.53 2kzc n ASP 58 Cb 0.71 -4.13 0.00 0.00 -0.72 0.00 0.00 41.12 36.98 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 -0.67 0.64 0.13 0.27 0.00 -1.26 -5.00 105.19 99.29 2kzc n GLY 59 Ca -0.19 -0.77 0.01 0.00 0.00 0.00 0.00 46.02 45.07 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 -2.54 1.61 1.57 -1.36 -3.47 116.57 112.39 2kzc h LYS 60 Ca 0.00 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.69 2kzc h LYS 60 Cb 0.95 0.00 -0.21 0.00 0.08 0.00 0.00 32.23 33.06 2kzc h LYS 60 CO 0.00 0.59 -0.08 1.03 -0.57 0.00 0.00 179.45 180.42 2kzc s ARG 61 N -3.04 0.76 0.55 3.15 1.81 -1.26 -5.12 118.95 115.80 2kzc s ARG 61 Ca 0.02 0.25 -0.20 0.00 -1.72 0.00 0.00 55.73 54.08 2kzc s ARG 61 Cb 0.09 0.36 -0.05 0.00 -0.45 0.00 0.00 34.95 34.90 2kzc s ARG 61 CO 0.75 -0.19 1.23 -1.25 -0.68 0.00 0.00 175.30 175.16 2kzc s PRO 62 N -0.74 3.18 0.24 3.54 0.04 -1.26 -4.86 135.00 135.14 2kzc s PRO 62 Ca -0.08 1.91 -0.05 0.00 0.04 0.00 0.00 61.00 62.81 2kzc s PRO 62 Cb -0.03 -2.11 0.41 0.00 0.04 0.00 0.00 34.50 32.82 2kzc s PRO 62 CO 0.05 -1.06 1.74 1.49 0.04 0.00 0.00 177.00 179.26 2kzc h GLU 63 N 1.27 0.47 -0.96 4.56 4.81 -2.01 -1.86 114.58 120.85 2kzc h GLU 63 Ca -0.50 -0.03 0.02 0.00 -0.13 0.00 0.00 59.36 58.72 2kzc h GLU 63 Cb 1.29 -0.11 -0.05 0.00 0.63 0.00 0.00 28.75 30.51 2kzc h GLU 63 CO 0.57 0.31 0.64 0.00 -0.73 0.00 0.00 179.01 179.79 2kzc h ALA 64 N 1.51 1.34 -0.63 2.92 0.00 -1.99 0.14 119.26 122.53 2kzc h ALA 64 Ca 0.39 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 55.15 2kzc h ALA 64 Cb 0.54 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2kzc h ALA 64 CO -0.36 0.59 0.05 1.49 0.00 0.00 0.00 179.25 181.03 2kzc h GLU 65 N 1.27 1.08 0.17 0.00 4.81 -1.72 -1.46 114.58 118.73 2kzc h GLU 65 Ca 0.37 -0.31 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 2kzc h GLU 65 Cb -0.09 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.18 2kzc h GLU 65 CO -0.09 1.02 -0.08 0.28 -0.73 0.00 0.00 179.01 179.40 2kzc h VAL 66 N 1.00 0.91 -0.43 0.32 2.07 -0.83 -1.67 116.25 117.63 2kzc h VAL 66 Ca 0.19 -0.37 -0.01 0.00 0.82 0.00 0.00 66.70 67.32 2kzc h VAL 66 Cb 0.50 1.14 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 2kzc h VAL 66 CO 0.02 0.09 0.22 0.03 0.02 0.00 0.00 177.57 177.94 2kzc h ARG 67 N -0.41 0.61 -0.26 1.57 3.08 -0.75 -2.18 114.38 116.05 2kzc h ARG 67 Ca -0.02 -0.08 0.05 0.00 0.07 0.00 0.00 59.98 60.00 2kzc h ARG 67 Cb 0.32 -0.11 -0.05 0.00 0.08 0.00 0.00 29.97 30.20 2kzc h ARG 67 CO 0.04 0.52 -0.08 0.00 -1.07 0.00 0.00 179.97 179.37 2kzc h ALA 68 N 1.06 0.15 -0.50 0.04 0.00 -1.22 0.36 119.26 119.14 2kzc h ALA 68 Ca 0.15 0.10 0.06 0.00 0.00 0.00 0.00 54.91 55.21 2kzc h ALA 68 Cb 0.10 0.23 -0.09 0.00 0.00 0.00 0.00 17.79 18.03 2kzc h ALA 68 CO -0.02 -0.49 -0.55 -0.22 0.00 0.00 0.00 179.25 177.97 2kzc h LYS 69 N -0.03 -0.31 -0.05 0.00 1.63 -1.08 -0.78 116.57 115.95 2kzc h LYS 69 Ca 0.13 0.02 -0.02 0.00 -0.85 0.00 0.00 60.65 59.93 2kzc h LYS 69 Cb 0.22 0.07 -0.00 0.00 -0.60 0.00 0.00 32.23 31.92 2kzc h LYS 69 CO -0.28 -0.21 -0.03 -0.92 -3.45 0.00 0.00 179.45 174.56 2kzc h TYR 70 N -0.32 0.12 -0.02 1.91 3.20 -0.68 -1.92 116.97 119.26 2kzc h TYR 70 Ca 0.09 -0.03 0.01 0.00 3.14 0.00 0.00 58.73 61.93 2kzc h TYR 70 Cb 0.55 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.79 2kzc h TYR 70 CO -0.78 0.51 -0.01 0.93 -1.64 0.00 0.00 178.16 177.17 2kzc h GLU 71 N -0.30 -0.01 0.00 1.82 4.39 -0.99 -2.27 114.58 117.22 2kzc h GLU 71 Ca 0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.71 2kzc h GLU 71 Cb 0.48 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.13 2kzc h GLU 71 CO 0.01 -0.01 0.00 0.78 -1.16 0.00 0.00 179.01 178.63 2kzc h GLY 72 N -0.01 0.00 2.00 -3.84 0.00 -1.06 -3.10 103.07 97.07 2kzc h GLY 72 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 2kzc h GLY 72 CO -0.03 0.00 0.00 -0.10 0.00 0.00 0.00 176.54 176.41 2kzc n LEU 73 N -2.95 0.19 -0.17 3.11 7.94 -0.73 -3.84 117.00 120.55 2kzc n LEU 73 Ca -0.01 0.53 -0.07 0.00 -1.11 0.00 0.00 56.01 55.34 2kzc n LEU 73 Cb 0.16 -0.47 0.02 0.00 0.53 0.00 0.00 43.42 43.66 2kzc n LEU 73 CO 0.22 -0.12 1.04 -0.03 -1.11 0.00 0.00 177.39 177.38 2kzc h MET 74 N 0.00 0.68 0.00 1.96 4.05 -1.66 0.25 114.93 120.22 2kzc h MET 74 Ca 0.00 -0.07 -0.02 0.00 -0.28 0.00 0.00 59.70 59.33 2kzc h MET 74 Cb 0.48 -0.14 -0.00 0.00 -0.80 0.00 0.00 31.60 31.14 2kzc h MET 74 CO 0.00 0.51 -0.09 0.00 0.23 0.00 0.00 176.91 177.57 2kzc h ALA 75 N 1.13 0.97 0.08 0.39 0.00 -1.85 -2.79 119.26 117.19 2kzc h ALA 75 Ca 0.18 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 2kzc h ALA 75 Cb 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2kzc h ALA 75 CO -0.03 0.11 -0.04 0.28 0.00 0.00 0.00 179.25 179.57 2kzc h VAL 76 N 0.00 1.15 -0.47 0.00 2.07 -1.55 -3.18 116.25 114.27 2kzc h VAL 76 Ca -0.00 -1.41 0.09 0.00 0.82 0.00 0.00 66.70 66.20 2kzc h VAL 76 Cb 0.85 1.98 -0.10 0.00 -1.52 0.00 0.00 31.29 32.50 2kzc h VAL 76 CO 0.01 0.32 -0.26 0.00 0.02 0.00 0.00 177.57 177.66 2kzc h ALA 77 N -0.08 0.04 -0.19 1.67 0.00 -0.44 0.88 119.26 121.14 2kzc h ALA 77 Ca -0.01 0.15 0.01 0.00 0.00 0.00 0.00 54.91 55.06 2kzc h ALA 77 Cb 0.60 0.60 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 2kzc h ALA 77 CO 0.02 -0.61 0.10 0.87 0.00 0.00 0.00 179.25 179.63 2kzc h LYS 78 N -0.16 0.21 -0.60 0.00 1.57 -1.64 0.10 116.57 116.05 2kzc h LYS 78 Ca 0.21 -0.01 0.02 0.00 -1.87 0.00 0.00 60.65 59.00 2kzc h LYS 78 Cb 0.49 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.72 2kzc h LYS 78 CO -0.56 0.14 0.38 0.00 -0.57 0.00 0.00 179.45 178.84 2kzc h ALA 79 N 1.09 0.78 -0.37 3.86 0.00 -1.22 -1.29 119.26 122.10 2kzc h ALA 79 Ca 0.07 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.84 2kzc h ALA 79 Cb 0.00 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2kzc h ALA 79 CO -0.04 0.14 -0.25 1.96 0.00 0.00 0.00 179.25 181.07 2kzc h GLN 80 N 0.76 0.74 -0.36 0.00 4.20 -0.50 -2.29 115.11 117.66 2kzc h GLN 80 Ca 0.23 -0.31 -0.10 0.00 0.06 0.00 0.00 58.65 58.53 2kzc h GLN 80 Cb -0.02 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.72 2kzc h GLN 80 CO -0.08 0.91 -0.18 1.37 -0.67 0.00 0.00 178.83 180.18 2kzc h LEU 81 N 0.64 0.78 -0.65 1.46 8.10 -0.50 0.48 115.31 125.62 2kzc h LEU 81 Ca 0.09 -0.41 0.02 0.00 0.11 0.00 0.00 57.88 57.69 2kzc h LEU 81 Cb 0.75 -0.22 -0.04 0.00 -0.44 0.00 0.00 40.66 40.72 2kzc h LEU 81 CO 0.06 1.02 0.41 0.24 -4.11 0.00 0.00 178.44 176.06 2kzc h MET 82 N 0.55 0.79 -0.00 0.17 2.86 -1.20 -2.41 114.93 115.68 2kzc h MET 82 Ca 0.08 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 2kzc h MET 82 Cb 0.73 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 32.21 2kzc h MET 82 CO 0.05 0.52 -0.11 -3.47 1.06 0.00 0.00 176.91 174.97 2kzc n ASP 83 N -4.68 0.29 -1.03 1.22 2.03 -0.87 -2.34 116.55 111.17 2kzc n ASP 83 Ca 0.06 -0.26 0.11 0.00 0.52 0.00 0.00 54.79 55.21 2kzc n ASP 83 Cb 0.06 -0.16 0.27 0.00 -0.72 0.00 0.00 41.12 40.57 2kzc n ASP 83 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2kzc n GLU 84 N -1.18 2.32 0.00 -0.67 1.02 0.14 -5.06 120.64 117.21 2kzc n GLU 84 Ca 0.12 -2.02 0.10 0.00 -0.02 0.00 0.00 57.16 55.34 2kzc n GLU 84 Cb 0.28 -1.47 0.08 0.00 -0.02 0.00 0.00 31.44 30.32 2kzc n GLU 84 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59