#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dzr h SER 2 N 0.00 -1.22 -3.83 1.61 0.87 -2.06 -3.43 113.55 105.47 2dzr h SER 2 Ca 0.00 0.10 -0.66 0.00 -1.23 0.00 0.00 61.79 60.00 2dzr h SER 2 Cb 0.00 0.41 -0.21 0.00 -0.44 0.00 0.00 62.40 62.15 2dzr h SER 2 CO 0.00 -0.61 -0.85 -0.44 -0.53 0.00 0.00 176.83 174.40 2dzr s SER 3 N -4.45 3.18 0.55 6.23 0.01 -1.26 -5.06 113.70 112.90 2dzr s SER 3 Ca -0.18 -0.76 0.00 0.00 1.31 0.00 0.00 55.95 56.32 2dzr s SER 3 Cb 0.05 -0.21 0.00 0.00 0.21 0.00 0.00 66.02 66.07 2dzr s SER 3 CO 0.62 0.14 0.00 0.61 0.41 0.00 0.00 173.24 175.02 2dzr n GLY 4 N 0.82 -2.93 3.15 3.44 0.00 -1.26 -4.99 105.19 103.41 2dzr n GLY 4 Ca -0.17 -0.87 0.04 0.00 0.00 0.00 0.00 46.02 45.02 2dzr n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dzr s SER 5 N -6.98 -1.34 0.51 1.61 0.01 -1.26 -4.88 113.70 101.36 2dzr s SER 5 Ca 0.00 0.31 0.00 0.00 1.31 0.00 0.00 55.95 57.57 2dzr s SER 5 Cb 0.00 1.92 0.00 0.00 0.21 0.00 0.00 66.02 68.15 2dzr s SER 5 CO 0.00 -0.25 0.00 -1.20 0.41 0.00 0.00 173.24 172.20 2dzr n SER 6 N 5.38 -6.77 -2.64 2.44 7.64 -1.26 -4.78 113.62 113.63 2dzr n SER 6 Ca 0.04 1.17 -0.05 0.00 1.01 0.00 0.00 58.87 61.04 2dzr n SER 6 Cb 0.54 -4.16 -0.04 0.00 -1.01 0.00 0.00 64.21 59.53 2dzr n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dzr n GLY 7 N -4.00 -4.74 0.02 0.23 0.00 -1.26 -3.55 105.19 91.90 2dzr n GLY 7 Ca -0.07 1.57 -0.01 0.00 0.00 0.00 0.00 46.02 47.51 2dzr n GLY 7 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2dzr h LEU 8 N 4.26 -0.10 -1.56 0.99 3.38 -1.98 1.66 115.31 121.95 2dzr h LEU 8 Ca -0.49 0.01 0.33 0.00 0.09 0.00 0.00 57.88 57.83 2dzr h LEU 8 Cb 1.11 0.04 -0.09 0.00 0.09 0.00 0.00 40.66 41.81 2dzr h LEU 8 CO 0.01 -0.02 0.79 0.03 0.09 0.00 0.00 178.44 179.34 2dzr h ARG 9 N -0.01 0.20 -0.07 1.13 3.08 -1.96 1.47 114.38 118.22 2dzr h ARG 9 Ca 0.01 -0.01 -0.16 0.00 0.07 0.00 0.00 59.98 59.89 2dzr h ARG 9 Cb 0.02 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.02 2dzr h ARG 9 CO -0.04 0.13 -0.64 0.93 -1.07 0.00 0.00 179.97 179.28 2dzr h GLU 10 N 0.21 0.26 0.60 0.04 4.39 0.06 -1.20 114.58 118.94 2dzr h GLU 10 Ca 0.65 -0.19 -0.03 0.00 0.34 0.00 0.00 59.36 60.13 2dzr h GLU 10 Cb 2.02 0.03 0.01 0.00 -0.10 0.00 0.00 28.75 30.71 2dzr h GLU 10 CO -0.24 0.82 -0.29 1.96 -1.16 0.00 0.00 179.01 180.10 2dzr h GLN 11 N 0.19 -0.78 -0.57 2.33 4.20 1.32 -2.58 115.11 119.22 2dzr h GLN 11 Ca -0.01 0.05 0.07 0.00 0.06 0.00 0.00 58.65 58.82 2dzr h GLN 11 Cb 1.17 0.18 -0.06 0.00 0.30 0.00 0.00 27.48 29.07 2dzr h GLN 11 CO 0.10 -0.52 0.25 0.28 -0.67 0.00 0.00 178.83 178.27 2dzr h VAL 12 N -1.01 0.86 -0.96 -0.54 2.07 -1.36 0.22 116.25 115.53 2dzr h VAL 12 Ca -0.08 -0.16 0.28 0.00 0.82 0.00 0.00 66.70 67.56 2dzr h VAL 12 Cb 0.62 0.35 -0.04 0.00 -1.52 0.00 0.00 31.29 30.70 2dzr h VAL 12 CO 0.14 0.08 0.74 1.56 0.02 0.00 0.00 177.57 180.11 2dzr h GLN 13 N 0.46 0.00 0.14 1.57 4.20 -1.21 0.48 115.11 120.76 2dzr h GLN 13 Ca 0.27 0.00 -0.35 0.00 0.06 0.00 0.00 58.65 58.63 2dzr h GLN 13 Cb 0.27 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.04 2dzr h GLN 13 CO -0.24 0.00 -1.84 0.22 -0.67 0.00 0.00 178.83 176.30 2dzr h ASP 14 N 0.00 0.47 0.00 1.46 1.82 -0.25 -3.26 116.42 116.66 2dzr h ASP 14 Ca 0.46 -0.85 0.00 0.00 -0.39 0.00 0.00 57.03 56.25 2dzr h ASP 14 Cb 1.94 -0.15 0.00 0.00 0.68 0.00 0.00 39.33 41.80 2dzr h ASP 14 CO -0.00 1.74 0.00 -0.11 -1.61 0.00 0.00 179.24 179.26 2dzr n LEU 15 N -3.50 0.00 -0.44 2.28 7.94 0.15 0.16 117.00 123.60 2dzr n LEU 15 Ca -0.27 0.92 0.37 0.00 -1.11 0.00 0.00 56.01 55.92 2dzr n LEU 15 Cb 1.06 -0.42 0.69 0.00 0.53 0.00 0.00 43.42 45.28 2dzr n LEU 15 CO 0.47 -0.42 1.31 -0.26 -1.11 0.00 0.00 177.39 177.39 2dzr h PHE 16 N 0.00 0.27 0.21 1.96 -1.00 -1.33 0.90 116.94 117.96 2dzr h PHE 16 Ca 0.00 0.01 -0.01 0.00 2.81 0.00 0.00 57.97 60.78 2dzr h PHE 16 Cb 0.00 -0.07 0.00 0.00 3.61 0.00 0.00 35.95 39.49 2dzr h PHE 16 CO -0.10 -0.05 -0.10 -0.91 -1.61 0.00 0.00 178.31 175.53 2dzr h ASN 17 N 0.10 -0.24 0.27 2.17 -0.26 -1.37 -2.63 115.58 113.61 2dzr h ASN 17 Ca 0.72 -0.28 -0.00 0.00 -0.56 0.00 0.00 56.30 56.17 2dzr h ASN 17 Cb 2.52 0.06 -0.01 0.00 -1.06 0.00 0.00 38.32 39.83 2dzr h ASN 17 CO -0.18 0.26 -0.20 0.50 -1.06 0.00 0.00 177.43 176.74 2dzr h LYS 18 N -0.86 -0.46 -0.88 0.81 3.11 0.53 -2.46 116.57 116.36 2dzr h LYS 18 Ca -0.03 0.03 0.16 0.00 -2.81 0.00 0.00 60.65 58.00 2dzr h LYS 18 Cb 0.51 0.10 -0.16 0.00 -1.00 0.00 0.00 32.23 31.69 2dzr h LYS 18 CO 0.05 -0.31 -0.29 0.87 -2.81 0.00 0.00 179.45 176.96 2dzr h LYS 19 N -0.48 -0.03 -0.66 1.90 1.79 0.51 0.21 116.57 119.82 2dzr h LYS 19 Ca -0.02 0.00 0.09 0.00 -2.18 0.00 0.00 60.65 58.55 2dzr h LYS 19 Cb 0.42 0.01 -0.11 0.00 -1.58 0.00 0.00 32.23 30.96 2dzr h LYS 19 CO -0.01 -0.02 -0.44 -0.92 -1.08 0.00 0.00 179.45 176.98 2dzr h TYR 20 N -0.03 -1.31 -1.32 -1.35 3.20 -1.04 0.50 116.97 115.62 2dzr h TYR 20 Ca 0.37 0.09 0.46 0.00 3.14 0.00 0.00 58.73 62.79 2dzr h TYR 20 Cb 0.62 0.67 -0.14 0.00 1.54 0.00 0.00 36.73 39.42 2dzr h TYR 20 CO -0.75 -0.42 0.84 0.41 -1.64 0.00 0.00 178.16 176.61 2dzr n GLY 21 N -1.40 -0.82 0.16 1.82 0.00 0.73 0.58 105.19 106.27 2dzr n GLY 21 Ca 0.03 0.75 -0.11 0.00 0.00 0.00 0.00 46.02 46.68 2dzr n GLY 21 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2dzr h GLU 22 N 0.00 -0.30 -0.66 1.61 5.08 0.06 1.71 114.58 122.08 2dzr h GLU 22 Ca 0.86 0.02 0.19 0.00 -1.00 0.00 0.00 59.36 59.43 2dzr h GLU 22 Cb 2.73 0.07 -0.03 0.00 0.50 0.00 0.00 28.75 32.02 2dzr h GLU 22 CO -0.48 0.07 0.78 0.00 -1.00 0.00 0.00 179.01 178.38 2dzr h ALA 23 N -0.42 2.45 0.00 3.43 0.00 0.61 1.20 119.26 126.53 2dzr h ALA 23 Ca -0.03 -0.02 -0.32 0.00 0.00 0.00 0.00 54.91 54.53 2dzr h ALA 23 Cb 0.51 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.28 2dzr h ALA 23 CO 0.05 -1.12 -2.29 1.28 0.00 0.00 0.00 179.25 177.17 2dzr n LEU 24 N -3.46 0.00 0.00 0.00 4.77 -0.35 -4.61 117.00 113.35 2dzr n LEU 24 Ca 0.14 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.12 2dzr n LEU 24 Cb 1.01 0.43 0.00 0.00 -2.33 0.00 0.00 43.42 42.53 2dzr n LEU 24 CO 0.25 0.43 0.00 0.61 -1.33 0.00 0.00 177.39 177.35 2dzr n GLY 25 N 1.76 2.92 3.13 -0.72 0.00 0.51 -3.39 105.19 109.40 2dzr n GLY 25 Ca -0.29 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.37 2dzr n GLY 25 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2dzr n ILE 26 N -1.60 0.00 -0.07 -0.61 5.41 0.26 -4.59 119.36 118.16 2dzr n ILE 26 Ca 0.00 -0.23 -0.08 0.00 1.00 0.00 0.00 62.75 63.43 2dzr n ILE 26 Cb 0.00 -0.23 -0.09 0.00 -0.71 0.00 0.00 39.64 38.61 2dzr n ILE 26 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 2dzr n LYS 27 N 0.83 1.33 -2.28 0.38 5.02 -1.26 -4.35 118.16 117.83 2dzr n LYS 27 Ca -0.00 0.03 -0.28 0.00 -2.02 0.00 0.00 58.31 56.04 2dzr n LYS 27 Cb 0.64 -1.32 0.03 0.00 -0.02 0.00 0.00 35.03 34.35 2dzr n LYS 27 CO 0.00 0.00 0.00 1.52 -0.52 0.00 0.00 177.40 178.40 2dzr s TYR 28 N -2.31 3.36 -0.36 2.13 -0.85 -1.26 -5.00 117.35 113.06 2dzr s TYR 28 Ca -0.12 0.82 -0.29 0.00 -0.52 0.00 0.00 57.07 56.96 2dzr s TYR 28 Cb 0.04 -2.73 0.00 0.00 0.38 0.00 0.00 41.96 39.66 2dzr s TYR 28 CO 0.46 -0.78 1.38 -1.25 -1.52 0.00 0.00 175.55 173.83 2dzr s PRO 29 N -5.04 3.71 0.34 -3.49 0.04 -1.26 -4.67 135.00 124.63 2dzr s PRO 29 Ca 0.54 1.09 0.03 0.00 0.04 0.00 0.00 61.00 62.70 2dzr s PRO 29 Cb -0.11 -3.97 -0.02 0.00 0.04 0.00 0.00 34.50 30.44 2dzr s PRO 29 CO 0.47 -1.39 0.51 0.08 0.04 0.00 0.00 177.00 176.71 2dzr s VAL 30 N 5.03 4.57 0.40 -0.36 1.01 -1.26 -5.00 120.40 124.78 2dzr s VAL 30 Ca 0.60 -0.77 -0.04 0.00 0.00 0.00 0.00 61.98 61.77 2dzr s VAL 30 Cb -0.15 -3.63 -0.04 0.00 0.00 0.00 0.00 36.38 32.55 2dzr s VAL 30 CO 0.29 -0.32 0.67 0.00 0.00 0.00 0.00 175.10 175.74 2dzr s GLN 31 N -4.24 3.58 -0.21 2.72 1.03 -1.26 -4.46 119.66 116.81 2dzr s GLN 31 Ca 0.42 0.05 -0.05 0.00 0.04 0.00 0.00 55.36 55.82 2dzr s GLN 31 Cb -0.10 -2.51 -0.02 0.00 0.03 0.00 0.00 33.01 30.42 2dzr s GLN 31 CO 0.33 -0.00 -0.01 0.08 -2.54 0.00 0.00 175.29 173.15 2dzr s VAL 32 N -2.44 3.78 -1.19 3.63 1.01 -1.26 -5.00 120.40 118.93 2dzr s VAL 32 Ca 0.45 -0.36 -0.21 0.00 0.00 0.00 0.00 61.98 61.86 2dzr s VAL 32 Cb -0.10 -2.72 -0.01 0.00 0.00 0.00 0.00 36.38 33.55 2dzr s VAL 32 CO 0.38 0.42 1.81 -2.16 0.00 0.00 0.00 175.10 175.54 2dzr s PRO 33 N 1.23 3.22 0.13 2.72 0.04 -1.26 -4.77 135.00 136.30 2dzr s PRO 33 Ca 0.03 -1.41 -0.19 0.00 0.04 0.00 0.00 61.00 59.47 2dzr s PRO 33 Cb -0.15 -5.36 -0.05 0.00 0.04 0.00 0.00 34.50 28.99 2dzr s PRO 33 CO 0.01 -3.05 1.78 1.88 0.04 0.00 0.00 177.00 177.66 2dzr h TYR 34 N 9.02 0.31 0.01 0.56 0.05 -1.96 0.27 116.97 125.24 2dzr h TYR 34 Ca 0.30 0.01 0.01 0.00 0.05 0.00 0.00 58.73 59.09 2dzr h TYR 34 Cb 0.93 -0.10 -0.03 0.00 1.01 0.00 0.00 36.73 38.53 2dzr h TYR 34 CO 1.31 0.21 -0.26 -0.22 -1.05 0.00 0.00 178.16 178.14 2dzr h LYS 35 N 0.33 -0.33 -0.61 4.88 3.64 -1.99 0.99 116.57 123.48 2dzr h LYS 35 Ca 0.09 0.02 0.18 0.00 -1.27 0.00 0.00 60.65 59.67 2dzr h LYS 35 Cb -0.03 0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.84 2dzr h LYS 35 CO -0.02 -0.22 0.45 0.00 -2.27 0.00 0.00 179.45 177.40 2dzr h ARG 36 N -0.34 0.00 0.00 1.90 3.08 -1.91 1.30 114.38 118.41 2dzr h ARG 36 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.03 2dzr h ARG 36 Cb 0.36 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.40 2dzr h ARG 36 CO -0.17 0.00 -0.13 0.82 -1.07 0.00 0.00 179.97 179.43 2dzr h ILE 37 N 0.00 0.25 0.00 2.04 2.04 0.14 -0.60 117.51 121.37 2dzr h ILE 37 Ca 0.29 -1.12 -0.04 0.00 1.00 0.00 0.00 64.86 64.99 2dzr h ILE 37 Cb 1.20 1.92 -0.01 0.00 -0.74 0.00 0.00 36.82 39.19 2dzr h ILE 37 CO -0.00 0.12 -0.39 0.50 0.00 0.00 0.00 178.15 178.38 2dzr h LYS 38 N 0.00 0.00 -0.97 2.37 3.64 0.93 -3.34 116.57 119.19 2dzr h LYS 38 Ca -0.00 0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.42 2dzr h LYS 38 Cb 0.91 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 32.67 2dzr h LYS 38 CO 0.02 0.39 0.63 0.77 -2.27 0.00 0.00 179.45 178.99 2dzr h SER 39 N -1.00 1.05 -3.59 4.20 0.02 -0.78 -3.37 113.55 110.08 2dzr h SER 39 Ca -0.07 -0.01 -0.67 0.00 -0.84 0.00 0.00 61.79 60.21 2dzr h SER 39 Cb 0.59 -0.24 -0.36 0.00 0.14 0.00 0.00 62.40 62.53 2dzr h SER 39 CO -0.04 0.72 -0.82 0.21 -1.14 0.00 0.00 176.83 175.75 2dzr s ASN 40 N -5.97 3.98 0.42 3.07 3.84 -0.23 -4.97 114.94 115.07 2dzr s ASN 40 Ca -0.13 -1.13 0.27 0.00 0.21 0.00 0.00 52.86 52.08 2dzr s ASN 40 Cb 0.19 -1.52 0.88 0.00 -0.55 0.00 0.00 41.25 40.25 2dzr s ASN 40 CO 0.81 -0.13 1.79 1.55 -2.79 0.00 0.00 177.10 178.33 2dzr h PRO 41 N 7.83 0.00 -1.40 0.43 0.13 -1.74 -3.18 132.00 134.07 2dzr h PRO 41 Ca -0.28 0.00 -0.36 0.00 -0.87 0.00 0.00 66.00 64.49 2dzr h PRO 41 Cb 1.08 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.05 2dzr h PRO 41 CO 0.52 0.00 0.46 0.41 -0.23 0.00 0.00 178.00 179.16 2dzr n GLY 42 N 0.58 4.20 0.00 1.56 0.00 -1.26 -4.43 105.19 105.85 2dzr n GLY 42 Ca 0.03 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 44.88 2dzr n GLY 42 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dzr n SER 43 N 0.12 0.00 -4.09 1.61 7.64 -1.20 -4.88 113.62 112.82 2dzr n SER 43 Ca 0.34 0.03 -0.32 0.00 1.01 0.00 0.00 58.87 59.93 2dzr n SER 43 Cb 0.65 -0.18 -0.16 0.00 -1.01 0.00 0.00 64.21 63.52 2dzr n SER 43 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2dzr s VAL 44 N -0.35 1.86 -0.15 0.44 1.01 -1.26 -4.10 120.40 117.85 2dzr s VAL 44 Ca 0.00 -0.83 -0.20 0.00 0.00 0.00 0.00 61.98 60.95 2dzr s VAL 44 Cb 0.00 -1.70 -0.03 0.00 0.00 0.00 0.00 36.38 34.65 2dzr s VAL 44 CO 0.00 0.51 0.60 -0.63 0.00 0.00 0.00 175.10 175.57 2dzr s ILE 45 N 1.27 5.08 -0.21 2.22 -1.09 -1.16 -4.82 121.20 122.50 2dzr s ILE 45 Ca 0.03 1.16 -0.03 0.00 -2.23 0.00 0.00 60.65 59.58 2dzr s ILE 45 Cb -0.13 -3.92 -0.01 0.00 -1.58 0.00 0.00 42.46 36.81 2dzr s ILE 45 CO -0.10 0.20 -0.06 -0.63 -1.23 0.00 0.00 174.94 173.12 2dzr s ILE 46 N 1.34 3.31 0.16 2.92 1.01 -1.25 -0.80 121.20 127.88 2dzr s ILE 46 Ca 0.29 -0.52 0.01 0.00 0.00 0.00 0.00 60.65 60.43 2dzr s ILE 46 Cb -0.16 -2.49 -0.04 0.00 0.01 0.00 0.00 42.46 39.78 2dzr s ILE 46 CO 0.12 0.44 0.01 -1.61 0.00 0.00 0.00 174.94 173.90 2dzr s GLU 47 N 1.30 1.05 0.00 2.79 0.41 -0.01 -4.70 118.70 119.53 2dzr s GLU 47 Ca 0.04 -1.50 0.00 0.00 -0.41 0.00 0.00 54.97 53.10 2dzr s GLU 47 Cb -0.14 -0.15 0.00 0.00 -1.78 0.00 0.00 34.13 32.06 2dzr s GLU 47 CO -0.03 -0.15 0.00 0.41 -0.49 0.00 0.00 175.26 175.00 2dzr n GLY 48 N -0.20 1.14 3.28 -1.39 0.00 -1.26 0.19 105.19 106.95 2dzr n GLY 48 Ca -0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.62 2dzr n GLY 48 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2dzr n LEU 49 N 0.00 -1.96 -4.79 0.99 4.77 -1.26 -3.90 117.00 110.85 2dzr n LEU 49 Ca 0.00 0.12 -0.29 0.00 -0.03 0.00 0.00 56.01 55.81 2dzr n LEU 49 Cb 0.00 -1.00 0.13 0.00 -2.33 0.00 0.00 43.42 40.22 2dzr n LEU 49 CO 0.00 -3.66 0.71 -2.16 -1.33 0.00 0.00 177.39 170.96 2dzr s PRO 50 N -3.21 1.28 -0.08 3.23 0.04 -1.26 -4.94 135.00 130.06 2dzr s PRO 50 Ca 0.52 0.34 -0.30 0.00 0.04 0.00 0.00 61.00 61.61 2dzr s PRO 50 Cb -0.15 -1.85 -0.03 0.00 0.04 0.00 0.00 34.50 32.52 2dzr s PRO 50 CO 0.69 -2.11 1.23 -1.25 0.04 0.00 0.00 177.00 175.60 2dzr s PRO 51 N -5.26 4.31 0.00 0.56 0.04 -1.26 -2.53 135.00 130.87 2dzr s PRO 51 Ca 0.63 1.69 0.00 0.00 0.04 0.00 0.00 61.00 63.37 2dzr s PRO 51 Cb -0.15 -3.62 0.00 0.00 0.04 0.00 0.00 34.50 30.77 2dzr s PRO 51 CO 0.53 -0.53 0.00 0.41 0.04 0.00 0.00 177.00 177.45 2dzr n GLY 52 N 3.46 0.17 3.03 0.56 0.00 -1.26 -5.03 105.19 106.11 2dzr n GLY 52 Ca 0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 2dzr n GLY 52 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dzr s ILE 53 N -2.00 2.30 1.09 -0.61 1.01 -1.05 -5.11 121.20 116.83 2dzr s ILE 53 Ca 0.00 -2.28 -0.18 0.00 0.00 0.00 0.00 60.65 58.19 2dzr s ILE 53 Cb 0.00 -2.67 0.25 0.00 0.01 0.00 0.00 42.46 40.05 2dzr s ILE 53 CO 0.00 -0.55 1.22 -2.16 0.00 0.00 0.00 174.94 173.45 2dzr s PRO 54 N 0.92 -0.37 -0.96 2.79 0.04 -1.26 -4.23 135.00 131.92 2dzr s PRO 54 Ca 0.09 -0.28 -0.22 0.00 0.04 0.00 0.00 61.00 60.63 2dzr s PRO 54 Cb -0.19 -1.71 0.07 0.00 0.04 0.00 0.00 34.50 32.70 2dzr s PRO 54 CO -0.08 -3.11 1.34 0.12 0.04 0.00 0.00 177.00 175.32 2dzr s PHE 55 N -3.47 2.65 0.34 0.56 5.36 -1.26 -4.91 117.98 117.25 2dzr s PHE 55 Ca 0.73 -0.88 -0.04 0.00 -0.96 0.00 0.00 56.93 55.78 2dzr s PHE 55 Cb -0.06 -4.59 0.02 0.00 -0.34 0.00 0.00 43.02 38.05 2dzr s PHE 55 CO 0.55 -1.84 0.52 0.54 -1.46 0.00 0.00 175.22 173.52 2dzr n ARG 56 N 8.36 0.75 -1.61 10.12 3.00 -1.26 -4.99 116.66 131.03 2dzr n ARG 56 Ca 0.27 -2.54 -0.45 0.00 -0.01 0.00 0.00 57.85 55.12 2dzr n ARG 56 Cb 0.50 2.57 -0.02 0.00 0.00 0.00 0.00 32.46 35.51 2dzr n ARG 56 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 2dzr n LYS 57 N -0.54 1.49 0.06 5.56 5.02 -1.26 -4.92 118.16 123.57 2dzr n LYS 57 Ca -0.01 0.52 -0.07 0.00 -2.02 0.00 0.00 58.31 56.73 2dzr n LYS 57 Cb 0.56 -1.95 -0.05 0.00 -0.02 0.00 0.00 35.03 33.57 2dzr n LYS 57 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 2dzr h PRO 58 N 2.28 -0.24 -0.11 1.97 0.13 -1.96 -3.16 132.00 130.90 2dzr h PRO 58 Ca -0.41 0.02 0.03 0.00 -0.87 0.00 0.00 66.00 64.77 2dzr h PRO 58 Cb 1.33 0.06 -0.00 0.00 0.13 0.00 0.00 31.00 32.51 2dzr h PRO 58 CO 0.62 0.03 0.28 0.00 -0.23 0.00 0.00 178.00 178.71 2dzr n THR 60 N -3.23 0.79 -3.90 0.00 -1.04 -1.20 -4.72 114.28 100.98 2dzr n THR 60 Ca 0.00 0.20 -0.22 0.00 -2.04 0.00 0.00 64.05 61.99 2dzr n THR 60 Cb 0.37 -0.95 -0.05 0.00 -1.82 0.00 0.00 70.33 67.89 2dzr n THR 60 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 2dzr s PHE 61 N -2.79 2.81 0.58 -1.42 0.08 0.38 -5.02 117.98 112.60 2dzr s PHE 61 Ca 0.11 -0.36 -0.11 0.00 0.12 0.00 0.00 56.93 56.69 2dzr s PHE 61 Cb 0.10 -1.78 -0.04 0.00 -0.57 0.00 0.00 43.02 40.72 2dzr s PHE 61 CO 0.25 0.21 0.98 0.20 -0.10 0.00 0.00 175.22 176.76 2dzr s GLY 62 N -3.95 1.68 0.22 4.36 0.00 -1.26 -4.81 107.32 103.56 2dzr s GLY 62 Ca 0.40 -0.13 -0.16 0.00 0.00 0.00 0.00 44.72 44.84 2dzr s GLY 62 CO 0.25 0.12 1.59 1.48 0.00 0.00 0.00 173.10 176.54 2dzr h SER 63 N -0.07 -1.00 -0.45 1.64 4.64 -1.96 0.32 113.55 116.68 2dzr h SER 63 Ca -0.45 0.24 0.09 0.00 -0.47 0.00 0.00 61.79 61.21 2dzr h SER 63 Cb 1.19 0.56 -0.09 0.00 -0.31 0.00 0.00 62.40 63.75 2dzr h SER 63 CO 0.62 -0.28 -0.20 1.56 -0.87 0.00 0.00 176.83 177.66 2dzr h GLN 64 N -0.06 -0.10 -0.89 4.77 7.50 -1.99 0.53 115.11 124.87 2dzr h GLN 64 Ca 0.32 0.01 0.04 0.00 0.50 0.00 0.00 58.65 59.52 2dzr h GLN 64 Cb 0.57 0.02 -0.05 0.00 0.05 0.00 0.00 27.48 28.07 2dzr h GLN 64 CO -0.79 -0.07 0.59 -0.91 -1.50 0.00 0.00 178.83 176.15 2dzr h ASN 65 N -0.10 0.95 0.54 1.46 4.21 -0.90 -2.38 115.58 119.35 2dzr h ASN 65 Ca 0.21 -0.01 -0.03 0.00 1.21 0.00 0.00 56.30 57.69 2dzr h ASN 65 Cb 0.44 -0.21 0.01 0.00 -1.12 0.00 0.00 38.32 37.43 2dzr h ASN 65 CO -0.51 0.64 -0.26 -0.07 -1.29 0.00 0.00 177.43 175.94 2dzr h LEU 66 N 1.09 -0.61 -1.60 1.61 3.38 0.26 -1.31 115.31 118.12 2dzr h LEU 66 Ca 0.36 0.02 0.50 0.00 0.09 0.00 0.00 57.88 58.85 2dzr h LEU 66 Cb 0.06 0.16 -0.10 0.00 0.09 0.00 0.00 40.66 40.87 2dzr h LEU 66 CO -0.11 -0.40 1.11 -0.62 0.09 0.00 0.00 178.44 178.50 2dzr n GLU 67 N -4.16 -0.02 -0.03 1.13 1.02 0.15 0.19 120.64 118.92 2dzr n GLU 67 Ca -0.09 1.10 -0.13 0.00 -0.02 0.00 0.00 57.16 58.01 2dzr n GLU 67 Cb 0.28 -2.34 -0.11 0.00 -0.02 0.00 0.00 31.44 29.25 2dzr n GLU 67 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2dzr h ARG 68 N 0.00 -0.00 0.03 3.49 3.08 -1.02 -2.88 114.38 117.08 2dzr h ARG 68 Ca 0.86 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.91 2dzr h ARG 68 Cb 3.15 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 33.19 2dzr h ARG 68 CO -0.21 0.67 -0.10 0.82 -1.07 0.00 0.00 179.97 180.07 2dzr h ILE 69 N -0.68 0.00 -1.05 2.04 2.04 0.32 0.23 117.51 120.42 2dzr h ILE 69 Ca -0.00 0.00 0.30 0.00 1.00 0.00 0.00 64.86 66.16 2dzr h ILE 69 Cb 0.67 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 36.71 2dzr h ILE 69 CO 0.00 0.00 1.01 -0.07 0.00 0.00 0.00 178.15 179.09 2dzr h LEU 70 N -0.15 0.00 0.52 1.44 3.38 -1.43 0.85 115.31 119.93 2dzr h LEU 70 Ca -0.00 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 2dzr h LEU 70 Cb 0.14 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.90 2dzr h LEU 70 CO -0.05 0.00 -0.25 0.00 0.09 0.00 0.00 178.44 178.23 2dzr h ALA 71 N 0.96 -0.70 -0.36 1.53 0.00 -0.36 -2.89 119.26 117.44 2dzr h ALA 71 Ca 0.50 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 55.18 2dzr h ALA 71 Cb 2.51 0.27 -0.02 0.00 0.00 0.00 0.00 17.79 20.56 2dzr h ALA 71 CO -0.01 -0.76 0.04 1.33 0.00 0.00 0.00 179.25 179.86 2dzr n VAL 72 N -5.29 1.69 -0.31 0.00 0.24 0.21 -4.37 118.33 110.50 2dzr n VAL 72 Ca -0.11 -0.85 0.35 0.00 -2.04 0.00 0.00 64.34 61.69 2dzr n VAL 72 Cb 0.32 -0.40 0.72 0.00 -1.47 0.00 0.00 33.84 33.01 2dzr n VAL 72 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2dzr h ALA 73 N 3.01 3.08 -0.11 2.33 0.00 0.59 1.30 119.26 129.46 2dzr h ALA 73 Ca 0.04 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 2dzr h ALA 73 Cb 1.44 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.32 2dzr h ALA 73 CO 0.32 -1.54 -0.38 0.38 0.00 0.00 0.00 179.25 178.04 2dzr h ASP 74 N 0.00 0.52 0.13 0.00 2.03 -1.83 -3.26 116.42 114.01 2dzr h ASP 74 Ca 0.56 -0.61 -0.00 0.00 -0.73 0.00 0.00 57.03 56.24 2dzr h ASP 74 Cb 2.42 -0.15 -0.00 0.00 -0.83 0.00 0.00 39.33 40.77 2dzr h ASP 74 CO -0.01 1.04 -0.07 0.11 -1.03 0.00 0.00 179.24 179.29 2dzr h LYS 75 N 0.03 -0.17 -6.01 4.15 1.79 0.13 -3.42 116.57 113.06 2dzr h LYS 75 Ca -0.02 0.01 -0.86 0.00 -2.18 0.00 0.00 60.65 57.61 2dzr h LYS 75 Cb 1.00 0.04 0.01 0.00 -1.58 0.00 0.00 32.23 31.71 2dzr h LYS 75 CO 0.08 -0.12 0.64 -0.89 -1.08 0.00 0.00 179.45 178.09 2dzr n ILE 76 N -5.17 0.02 -4.42 1.86 5.41 -0.01 -4.21 119.36 112.84 2dzr n ILE 76 Ca -0.08 -0.00 -0.23 0.00 1.00 0.00 0.00 62.75 63.44 2dzr n ILE 76 Cb 0.10 -0.51 -0.16 0.00 -0.71 0.00 0.00 39.64 38.36 2dzr n ILE 76 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 2dzr s LYS 77 N 2.73 1.34 0.08 0.38 2.20 0.51 -4.93 119.74 122.04 2dzr s LYS 77 Ca 1.03 -0.29 0.01 0.00 -0.36 0.00 0.00 55.97 56.37 2dzr s LYS 77 Cb -1.44 -1.16 -0.04 0.00 -1.51 0.00 0.00 37.83 33.68 2dzr s LYS 77 CO 0.78 -0.01 0.17 -0.06 -0.36 0.00 0.00 175.35 175.86 2dzr s PHE 78 N 0.75 3.39 -0.00 4.03 0.40 -1.25 -0.83 117.98 124.46 2dzr s PHE 78 Ca -0.13 0.17 0.06 0.00 -0.60 0.00 0.00 56.93 56.43 2dzr s PHE 78 Cb -0.15 -1.69 -0.02 0.00 0.51 0.00 0.00 43.02 41.67 2dzr s PHE 78 CO 0.02 0.56 -0.20 0.99 0.70 0.00 0.00 175.22 177.29 2dzr s THR 79 N -1.49 1.57 -0.31 0.64 2.01 0.02 -4.73 115.64 113.33 2dzr s THR 79 Ca 0.33 -0.91 0.02 0.00 0.31 0.00 0.00 61.69 61.44 2dzr s THR 79 Cb -0.12 -1.31 0.09 0.00 0.01 0.00 0.00 72.50 71.17 2dzr s THR 79 CO 0.26 0.39 0.05 -0.69 -0.69 0.00 0.00 174.62 173.94 2dzr s VAL 80 N -0.53 1.63 0.06 3.82 1.01 -1.26 -2.96 120.40 122.17 2dzr s VAL 80 Ca 0.07 -1.83 -0.13 0.00 0.00 0.00 0.00 61.98 60.10 2dzr s VAL 80 Cb -0.08 -2.17 -0.04 0.00 0.00 0.00 0.00 36.38 34.09 2dzr s VAL 80 CO -0.00 -0.56 1.22 0.71 0.00 0.00 0.00 175.10 176.47 2dzr h THR 81 N 6.57 0.00 -1.92 3.92 1.35 -1.90 -3.42 112.91 117.51 2dzr h THR 81 Ca -0.10 0.00 -0.53 0.00 -0.55 0.00 0.00 66.41 65.24 2dzr h THR 81 Cb 1.02 0.00 0.24 0.00 -1.73 0.00 0.00 68.15 67.69 2dzr h THR 81 CO 0.49 0.00 -1.91 0.54 -0.25 0.00 0.00 175.52 174.39 2dzr n ARG 82 N -3.85 -0.12 -2.52 4.72 1.74 -1.26 -4.87 116.66 110.51 2dzr n ARG 82 Ca -0.00 -0.03 -0.39 0.00 -0.77 0.00 0.00 57.85 56.66 2dzr n ARG 82 Cb 0.12 -1.13 -0.04 0.00 -1.02 0.00 0.00 32.46 30.39 2dzr n ARG 82 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2dzr s PRO 83 N -2.26 4.46 0.25 5.56 0.04 -1.26 -5.05 135.00 136.73 2dzr s PRO 83 Ca 0.42 1.67 -0.01 0.00 0.04 0.00 0.00 61.00 63.12 2dzr s PRO 83 Cb -0.11 -2.93 -0.03 0.00 0.04 0.00 0.00 34.50 31.47 2dzr s PRO 83 CO 0.76 0.08 0.24 -0.59 0.04 0.00 0.00 177.00 177.53 2dzr s PHE 84 N -1.36 1.20 0.31 0.56 -0.12 -1.26 -5.13 117.98 112.18 2dzr s PHE 84 Ca 0.50 -1.36 0.09 0.00 -0.05 0.00 0.00 56.93 56.10 2dzr s PHE 84 Cb -0.28 -0.47 -0.05 0.00 -0.63 0.00 0.00 43.02 41.60 2dzr s PHE 84 CO 0.35 -0.78 0.04 -0.65 -0.05 0.00 0.00 175.22 174.13 2dzr s GLN 85 N -3.88 2.23 -0.11 1.99 1.11 -1.22 -5.08 119.66 114.71 2dzr s GLN 85 Ca 0.37 -1.57 -0.01 0.00 0.01 0.00 0.00 55.36 54.15 2dzr s GLN 85 Cb 0.04 -2.08 0.03 0.00 -1.01 0.00 0.00 33.01 30.00 2dzr s GLN 85 CO 0.16 0.21 -0.01 0.20 0.01 0.00 0.00 175.29 175.86 2dzr s GLY 86 N -3.74 0.62 0.61 3.09 0.00 -1.26 -3.84 107.32 102.80 2dzr s GLY 86 Ca 0.34 -0.37 0.03 0.00 0.00 0.00 0.00 44.72 44.73 2dzr s GLY 86 CO 0.20 1.13 0.85 1.08 0.00 0.00 0.00 173.10 176.36 2dzr s LEU 87 N 1.88 3.15 0.30 0.66 2.01 -1.26 -5.07 118.68 120.34 2dzr s LEU 87 Ca 0.03 -0.42 -0.28 0.00 0.01 0.00 0.00 54.13 53.47 2dzr s LEU 87 Cb -0.13 -2.15 -0.09 0.00 0.01 0.00 0.00 46.19 43.82 2dzr s LEU 87 CO -0.06 -1.45 1.02 -0.63 1.01 0.00 0.00 176.35 176.23 2dzr s ILE 88 N -2.85 3.83 1.10 -0.59 1.09 -1.26 -5.05 121.20 117.47 2dzr s ILE 88 Ca 0.62 1.70 -0.18 0.00 -1.10 0.00 0.00 60.65 61.68 2dzr s ILE 88 Cb -0.07 -4.02 0.25 0.00 -1.06 0.00 0.00 42.46 37.56 2dzr s ILE 88 CO 0.40 0.29 1.23 -2.16 -0.10 0.00 0.00 174.94 174.61 2dzr s PRO 89 N -1.68 -0.44 -0.34 2.79 0.04 -1.26 -5.07 135.00 129.04 2dzr s PRO 89 Ca 0.47 -0.31 -0.00 0.00 0.04 0.00 0.00 61.00 61.20 2dzr s PRO 89 Cb -0.26 -1.71 0.13 0.00 0.04 0.00 0.00 34.50 32.70 2dzr s PRO 89 CO 0.33 -3.15 0.20 0.21 0.04 0.00 0.00 177.00 174.62 2dzr s LYS 90 N -5.70 0.52 0.49 4.56 2.47 -1.26 -5.13 119.74 115.69 2dzr s LYS 90 Ca 0.74 -1.23 -0.20 0.00 -1.56 0.00 0.00 55.97 53.71 2dzr s LYS 90 Cb -0.06 -1.31 -0.08 0.00 -1.46 0.00 0.00 37.83 34.92 2dzr s LYS 90 CO 0.55 -1.18 1.04 -1.25 0.16 0.00 0.00 175.35 174.66 2dzr s PRO 91 N 1.20 3.79 0.33 4.03 0.04 -1.26 -5.06 135.00 138.07 2dzr s PRO 91 Ca 0.17 1.35 -0.11 0.00 0.04 0.00 0.00 61.00 62.44 2dzr s PRO 91 Cb -0.22 -2.09 0.02 0.00 0.04 0.00 0.00 34.50 32.25 2dzr s PRO 91 CO -0.04 -0.44 0.62 0.34 0.04 0.00 0.00 177.00 177.51 2dzr s ASP 92 N -2.02 0.26 0.27 6.66 2.15 -1.26 -5.18 116.67 117.55 2dzr s ASP 92 Ca 0.67 -1.16 0.10 0.00 0.43 0.00 0.00 52.55 52.59 2dzr s ASP 92 Cb -0.16 0.73 -0.05 0.00 -0.30 0.00 0.00 42.92 43.14 2dzr s ASP 92 CO 0.21 -1.42 -0.06 -1.83 -0.17 0.00 0.00 175.17 171.89 2dzr s GLU 93 N -3.06 2.11 0.16 4.34 -1.05 -1.26 -5.15 118.70 114.79 2dzr s GLU 93 Ca 0.21 -1.53 -0.03 0.00 -0.15 0.00 0.00 54.97 53.48 2dzr s GLU 93 Cb -0.03 -2.04 -0.03 0.00 -0.44 0.00 0.00 34.13 31.59 2dzr s GLU 93 CO 0.13 0.35 0.13 -1.12 0.95 0.00 0.00 175.26 175.71 2dzr s SER 94 N -3.62 0.20 0.43 0.83 0.01 -1.26 -5.18 113.70 105.11 2dzr s SER 94 Ca 0.31 -1.18 0.06 0.00 1.31 0.00 0.00 55.95 56.45 2dzr s SER 94 Cb -0.06 0.35 -0.06 0.00 0.21 0.00 0.00 66.02 66.46 2dzr s SER 94 CO 0.18 -0.80 0.02 -0.83 0.41 0.00 0.00 173.24 172.22 2dzr s GLY 95 N -3.06 2.61 1.00 3.44 0.00 -1.26 -5.15 107.32 104.90 2dzr s GLY 95 Ca 0.26 -1.87 -0.15 0.00 0.00 0.00 0.00 44.72 42.96 2dzr s GLY 95 CO 0.04 -2.11 1.18 2.56 0.00 0.00 0.00 173.10 174.78 2dzr s PRO 96 N -3.77 0.42 -0.30 2.90 0.04 -1.26 -5.08 135.00 127.95 2dzr s PRO 96 Ca 0.29 0.01 -0.17 0.00 0.04 0.00 0.00 61.00 61.18 2dzr s PRO 96 Cb 0.08 -1.78 0.18 0.00 0.04 0.00 0.00 34.50 33.01 2dzr s PRO 96 CO 0.15 -2.63 1.20 0.45 0.04 0.00 0.00 177.00 176.20 2dzr s SER 97 N -4.23 -0.10 -0.17 6.66 0.15 -1.26 -5.08 113.70 109.68 2dzr s SER 97 Ca 0.68 0.04 -0.16 0.00 0.70 0.00 0.00 55.95 57.20 2dzr s SER 97 Cb -0.11 1.07 -0.06 0.00 -1.71 0.00 0.00 66.02 65.21 2dzr s SER 97 CO 0.54 -0.02 -0.33 -0.24 1.20 0.00 0.00 173.24 174.39 2dzr n SER 98 N 5.27 1.88 0.00 5.45 2.88 -1.26 -5.29 113.62 122.56 2dzr n SER 98 Ca 0.00 0.32 0.00 0.00 -1.33 0.00 0.00 58.87 57.86 2dzr n SER 98 Cb 0.57 -0.72 0.00 0.00 -0.75 0.00 0.00 64.21 63.31 2dzr n SER 98 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42