#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dzr n SER 2 N 0.00 -4.76 -3.78 1.61 2.88 -1.26 -5.00 113.62 103.32 2dzr n SER 2 Ca 0.00 1.55 -0.14 0.00 -1.33 0.00 0.00 58.87 58.95 2dzr n SER 2 Cb 0.00 -4.84 -0.15 0.00 -0.75 0.00 0.00 64.21 58.47 2dzr n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2dzr s SER 3 N -0.56 -0.03 0.27 -3.46 0.15 -1.26 -5.09 113.70 103.72 2dzr s SER 3 Ca -0.13 0.16 0.00 0.00 0.70 0.00 0.00 55.95 56.67 2dzr s SER 3 Cb 0.01 0.07 0.00 0.00 -1.71 0.00 0.00 66.02 64.39 2dzr s SER 3 CO 0.36 -0.11 0.00 0.61 1.20 0.00 0.00 173.24 175.30 2dzr n GLY 4 N 3.90 -3.73 3.64 9.45 0.00 -1.26 -5.10 105.19 112.09 2dzr n GLY 4 Ca -0.23 -0.96 -0.05 0.00 0.00 0.00 0.00 46.02 44.77 2dzr n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dzr s SER 5 N -3.06 -0.18 0.00 1.61 1.04 -1.26 -5.18 113.70 106.67 2dzr s SER 5 Ca 0.00 0.35 -0.24 0.00 0.48 0.00 0.00 55.95 56.54 2dzr s SER 5 Cb 0.00 0.35 0.05 0.00 0.10 0.00 0.00 66.02 66.52 2dzr s SER 5 CO 0.00 -0.06 0.54 -0.55 0.98 0.00 0.00 173.24 174.14 2dzr s SER 6 N 0.05 -0.47 0.00 7.02 0.15 -1.26 -5.04 113.70 114.15 2dzr s SER 6 Ca 0.06 0.35 0.00 0.00 0.70 0.00 0.00 55.95 57.06 2dzr s SER 6 Cb -0.05 0.48 0.00 0.00 -1.71 0.00 0.00 66.02 64.74 2dzr s SER 6 CO -0.12 -0.63 0.00 0.61 1.20 0.00 0.00 173.24 174.29 2dzr n GLY 7 N 0.73 2.30 0.00 9.45 0.00 -1.26 -4.60 105.19 111.81 2dzr n GLY 7 Ca -0.19 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.66 2dzr n GLY 7 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2dzr n LEU 8 N 0.00 0.00 -0.32 0.99 4.77 -1.26 0.11 117.00 121.28 2dzr n LEU 8 Ca 0.00 0.96 0.28 0.00 -0.03 0.00 0.00 56.01 57.23 2dzr n LEU 8 Cb 0.00 -0.46 0.53 0.00 -2.33 0.00 0.00 43.42 41.16 2dzr n LEU 8 CO 0.00 -0.46 1.04 -0.09 -1.33 0.00 0.00 177.39 176.54 2dzr h ARG 9 N 0.00 0.05 -0.35 3.23 1.12 -1.95 1.45 114.38 117.93 2dzr h ARG 9 Ca 0.00 -0.00 -0.06 0.00 -1.11 0.00 0.00 59.98 58.81 2dzr h ARG 9 Cb 0.00 -0.01 -0.01 0.00 -0.01 0.00 0.00 29.97 29.94 2dzr h ARG 9 CO 0.00 0.03 -0.01 0.93 -3.11 0.00 0.00 179.97 177.82 2dzr h GLU 10 N 0.05 0.63 0.37 0.20 5.08 0.21 0.70 114.58 121.82 2dzr h GLU 10 Ca 0.80 -0.20 -0.00 0.00 -1.00 0.00 0.00 59.36 58.95 2dzr h GLU 10 Cb 2.02 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 31.19 2dzr h GLU 10 CO -0.76 0.75 -0.52 1.96 -1.00 0.00 0.00 179.01 179.44 2dzr h GLN 11 N 0.44 -0.89 0.04 2.33 4.20 0.93 0.96 115.11 123.12 2dzr h GLN 11 Ca 0.10 0.06 0.01 0.00 0.06 0.00 0.00 58.65 58.88 2dzr h GLN 11 Cb 0.47 0.20 -0.02 0.00 0.30 0.00 0.00 27.48 28.43 2dzr h GLN 11 CO 0.02 -0.59 -0.12 0.28 -0.67 0.00 0.00 178.83 177.75 2dzr h VAL 12 N -0.92 0.71 -1.18 -0.54 2.07 -1.27 0.65 116.25 115.78 2dzr h VAL 12 Ca -0.04 0.00 0.34 0.00 0.82 0.00 0.00 66.70 67.82 2dzr h VAL 12 Cb 0.84 0.71 -0.05 0.00 -1.52 0.00 0.00 31.29 31.27 2dzr h VAL 12 CO -0.15 0.00 0.87 1.56 0.02 0.00 0.00 177.57 179.87 2dzr h GLN 13 N -0.22 0.00 0.05 1.57 4.20 -0.54 0.95 115.11 121.12 2dzr h GLN 13 Ca 0.03 0.00 -0.32 0.00 0.06 0.00 0.00 58.65 58.42 2dzr h GLN 13 Cb 0.25 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.00 2dzr h GLN 13 CO -0.09 0.00 -1.78 0.22 -0.67 0.00 0.00 178.83 176.51 2dzr h ASP 14 N 0.00 0.18 0.00 1.46 3.58 0.99 -3.26 116.42 119.37 2dzr h ASP 14 Ca 0.56 -0.38 0.00 0.00 0.42 0.00 0.00 57.03 57.63 2dzr h ASP 14 Cb 2.29 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 43.28 2dzr h ASP 14 CO -0.01 1.34 0.00 -0.11 -2.88 0.00 0.00 179.24 177.58 2dzr n LEU 15 N -3.24 0.00 -0.30 2.28 7.94 0.32 0.19 117.00 124.19 2dzr n LEU 15 Ca -0.22 0.91 0.30 0.00 -1.11 0.00 0.00 56.01 55.90 2dzr n LEU 15 Cb 1.05 -0.41 0.67 0.00 0.53 0.00 0.00 43.42 45.26 2dzr n LEU 15 CO 0.45 -0.41 1.28 -0.26 -1.11 0.00 0.00 177.39 177.34 2dzr h PHE 16 N 0.00 0.20 0.50 1.96 0.04 -1.42 0.64 116.94 118.86 2dzr h PHE 16 Ca 0.00 0.01 -0.02 0.00 2.80 0.00 0.00 57.97 60.75 2dzr h PHE 16 Cb 0.00 -0.06 0.00 0.00 2.20 0.00 0.00 35.95 38.10 2dzr h PHE 16 CO -0.04 0.02 -0.24 -0.91 -0.60 0.00 0.00 178.31 176.53 2dzr h ASN 17 N 0.12 -0.57 0.12 2.17 2.35 -1.45 -2.74 115.58 115.58 2dzr h ASN 17 Ca 0.55 0.02 0.02 0.00 -0.55 0.00 0.00 56.30 56.34 2dzr h ASN 17 Cb 1.94 0.15 -0.04 0.00 0.05 0.00 0.00 38.32 40.42 2dzr h ASN 17 CO -0.10 -0.16 -0.31 0.50 -1.65 0.00 0.00 177.43 175.72 2dzr h LYS 18 N -1.18 -0.51 -1.00 0.81 3.64 0.36 -0.91 116.57 117.79 2dzr h LYS 18 Ca -0.07 0.03 0.34 0.00 -1.27 0.00 0.00 60.65 59.68 2dzr h LYS 18 Cb 0.52 0.12 -0.18 0.00 -0.41 0.00 0.00 32.23 32.28 2dzr h LYS 18 CO 0.11 -0.34 0.25 0.87 -2.27 0.00 0.00 179.45 178.08 2dzr h LYS 19 N -0.53 0.01 -0.31 1.90 1.79 0.11 0.43 116.57 119.97 2dzr h LYS 19 Ca 0.03 -0.00 0.05 0.00 -2.18 0.00 0.00 60.65 58.55 2dzr h LYS 19 Cb 0.56 -0.00 -0.08 0.00 -1.58 0.00 0.00 32.23 31.12 2dzr h LYS 19 CO -0.18 0.01 -0.47 -0.92 -1.08 0.00 0.00 179.45 176.81 2dzr h TYR 20 N 0.01 -1.38 -1.33 -1.35 3.20 -0.83 0.20 116.97 115.49 2dzr h TYR 20 Ca 0.71 0.07 0.46 0.00 3.14 0.00 0.00 58.73 63.10 2dzr h TYR 20 Cb 1.67 0.64 -0.13 0.00 1.54 0.00 0.00 36.73 40.45 2dzr h TYR 20 CO -0.29 -0.47 0.85 0.41 -1.64 0.00 0.00 178.16 177.02 2dzr n GLY 21 N -1.42 -0.81 0.12 1.82 0.00 0.15 0.43 105.19 105.48 2dzr n GLY 21 Ca -0.03 0.73 -0.09 0.00 0.00 0.00 0.00 46.02 46.64 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 -0.16 -1.32 1.61 5.08 -0.64 1.52 114.58 120.66 2dzr h GLU 22 Ca 0.85 0.01 0.38 0.00 -1.00 0.00 0.00 59.36 59.60 2dzr h GLU 22 Cb 2.73 0.04 -0.07 0.00 0.50 0.00 0.00 28.75 31.95 2dzr h GLU 22 CO -0.45 0.24 0.93 0.00 -1.00 0.00 0.00 179.01 178.73 2dzr h ALA 23 N -0.49 3.09 0.00 3.43 0.00 0.98 1.23 119.26 127.49 2dzr h ALA 23 Ca -0.02 -0.01 -0.30 0.00 0.00 0.00 0.00 54.91 54.58 2dzr h ALA 23 Cb 0.48 0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.32 2dzr h ALA 23 CO 0.03 -1.51 -1.97 1.28 0.00 0.00 0.00 179.25 177.08 2dzr n LEU 24 N -4.26 0.48 0.00 0.00 4.77 0.18 -4.68 117.00 113.48 2dzr n LEU 24 Ca 0.30 0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.51 2dzr n LEU 24 Cb 1.35 0.29 0.00 0.00 -2.33 0.00 0.00 43.42 42.73 2dzr n LEU 24 CO 0.37 0.39 0.00 0.61 -1.33 0.00 0.00 177.39 177.43 2dzr n GLY 25 N 1.60 1.42 3.17 -0.72 0.00 0.42 -5.06 105.19 106.02 2dzr n GLY 25 Ca -0.22 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.45 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 -1.76 0.00 -0.07 -0.61 5.41 0.44 -4.81 119.36 117.97 2dzr n ILE 26 Ca 0.00 -0.24 -0.08 0.00 1.00 0.00 0.00 62.75 63.43 2dzr n ILE 26 Cb 0.00 -0.30 -0.09 0.00 -0.71 0.00 0.00 39.64 38.54 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 0.34 1.41 -2.33 0.38 4.76 -1.26 -4.38 118.16 117.09 2dzr n LYS 27 Ca 0.01 0.03 -0.27 0.00 -2.87 0.00 0.00 58.31 55.20 2dzr n LYS 27 Cb 0.63 -1.32 0.03 0.00 -1.84 0.00 0.00 35.03 32.53 2dzr n LYS 27 CO 0.00 0.00 0.00 1.52 -1.37 0.00 0.00 177.40 177.55 2dzr s TYR 28 N -2.31 3.28 -0.22 2.13 -0.85 -1.26 -5.01 117.35 113.11 2dzr s TYR 28 Ca -0.12 0.72 -0.29 0.00 -0.52 0.00 0.00 57.07 56.86 2dzr s TYR 28 Cb 0.04 -2.76 -0.01 0.00 0.38 0.00 0.00 41.96 39.61 2dzr s TYR 28 CO 0.46 -0.84 1.31 -1.25 -1.52 0.00 0.00 175.55 173.71 2dzr s PRO 29 N -5.03 4.08 0.28 -3.49 0.04 -1.26 -4.68 135.00 124.94 2dzr s PRO 29 Ca 0.54 1.51 0.08 0.00 0.04 0.00 0.00 61.00 63.17 2dzr s PRO 29 Cb -0.11 -3.83 -0.04 0.00 0.04 0.00 0.00 34.50 30.57 2dzr s PRO 29 CO 0.46 -0.90 0.16 0.08 0.04 0.00 0.00 177.00 176.84 2dzr s VAL 30 N 3.95 3.95 -0.13 -0.36 1.01 -1.26 -5.05 120.40 122.51 2dzr s VAL 30 Ca 0.57 -1.54 -0.03 0.00 0.00 0.00 0.00 61.98 60.97 2dzr s VAL 30 Cb -0.20 -3.21 -0.03 0.00 0.00 0.00 0.00 36.38 32.94 2dzr s VAL 30 CO 0.19 -0.31 -0.01 -1.10 0.00 0.00 0.00 175.10 173.86 2dzr s GLN 31 N -3.83 3.46 0.20 2.72 -0.21 -1.26 -4.21 119.66 116.53 2dzr s GLN 31 Ca 0.34 -0.46 -0.30 0.00 0.02 0.00 0.00 55.36 54.96 2dzr s GLN 31 Cb -0.07 -2.91 -0.08 0.00 1.00 0.00 0.00 33.01 30.95 2dzr s GLN 31 CO 0.24 0.41 1.17 0.08 -2.12 0.00 0.00 175.29 175.06 2dzr s VAL 32 N -0.08 3.60 -1.13 1.09 1.01 -1.26 -4.91 120.40 118.72 2dzr s VAL 32 Ca 0.03 1.39 -0.19 0.00 0.00 0.00 0.00 61.98 63.22 2dzr s VAL 32 Cb -0.13 -3.89 -0.05 0.00 0.00 0.00 0.00 36.38 32.31 2dzr s VAL 32 CO 0.02 0.24 2.01 -0.81 0.00 0.00 0.00 175.10 176.57 2dzr n PRO 33 N 2.26 2.21 0.06 2.72 -0.04 -1.26 -4.74 135.00 136.21 2dzr n PRO 33 Ca 0.03 -2.37 -0.12 0.00 -0.04 0.00 0.00 63.50 61.01 2dzr n PRO 33 Cb 0.45 -3.22 -0.05 0.00 -0.04 0.00 0.00 33.50 30.64 2dzr n PRO 33 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 2dzr h TYR 34 N 7.40 -0.74 -0.15 0.54 0.05 -1.96 0.40 116.97 122.50 2dzr h TYR 34 Ca 0.45 0.02 0.02 0.00 0.05 0.00 0.00 58.73 59.28 2dzr h TYR 34 Cb 0.72 0.33 -0.03 0.00 1.01 0.00 0.00 36.73 38.76 2dzr h TYR 34 CO 1.34 -0.37 -0.19 -0.22 -1.05 0.00 0.00 178.16 177.67 2dzr h LYS 35 N -0.42 -0.12 -0.71 4.88 3.64 -1.99 1.16 116.57 123.00 2dzr h LYS 35 Ca 0.06 0.01 0.19 0.00 -1.27 0.00 0.00 60.65 59.64 2dzr h LYS 35 Cb 0.50 0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.32 2dzr h LYS 35 CO -0.24 -0.08 0.50 0.00 -2.27 0.00 0.00 179.45 177.36 2dzr h ARG 36 N -0.13 0.11 0.00 1.90 3.08 -1.89 1.15 114.38 118.61 2dzr h ARG 36 Ca 0.03 -0.01 -0.05 0.00 0.07 0.00 0.00 59.98 60.02 2dzr h ARG 36 Cb 0.20 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.21 2dzr h ARG 36 CO -0.21 0.08 -0.23 0.82 -1.07 0.00 0.00 179.97 179.36 2dzr h ILE 37 N 0.12 0.53 0.05 2.04 2.04 0.43 0.18 117.51 122.90 2dzr h ILE 37 Ca 0.34 -1.17 -0.08 0.00 1.00 0.00 0.00 64.86 64.96 2dzr h ILE 37 Cb 1.19 1.81 0.01 0.00 -0.74 0.00 0.00 36.82 39.10 2dzr h ILE 37 CO -0.04 0.22 -0.34 0.50 0.00 0.00 0.00 178.15 178.49 2dzr h LYS 38 N 0.00 0.14 -0.36 2.37 3.64 0.97 -3.30 116.57 120.02 2dzr h LYS 38 Ca -0.00 -0.22 -0.07 0.00 -1.27 0.00 0.00 60.65 59.09 2dzr h LYS 38 Cb 0.79 0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.68 2dzr h LYS 38 CO 0.03 1.08 -0.05 0.77 -2.27 0.00 0.00 179.45 179.01 2dzr h SER 39 N -0.69 0.67 -3.60 4.20 0.02 -1.05 -3.40 113.55 109.70 2dzr h SER 39 Ca -0.06 -0.34 -0.67 0.00 -0.84 0.00 0.00 61.79 59.89 2dzr h SER 39 Cb 1.24 -0.18 -0.36 0.00 0.14 0.00 0.00 62.40 63.23 2dzr h SER 39 CO 0.06 0.85 -0.82 0.20 -1.14 0.00 0.00 176.83 175.99 2dzr s ASN 40 N -6.23 3.99 0.43 3.07 0.01 0.63 -4.97 114.94 111.87 2dzr s ASN 40 Ca -0.13 -1.14 0.24 0.00 -0.71 0.00 0.00 52.86 51.11 2dzr s ASN 40 Cb 0.09 -1.52 0.69 0.00 0.41 0.00 0.00 41.25 40.93 2dzr s ASN 40 CO 0.79 -0.13 1.73 1.55 -1.51 0.00 0.00 177.10 179.53 2dzr h PRO 41 N 7.83 0.00 -1.78 -0.60 0.13 -1.79 -3.24 132.00 132.55 2dzr h PRO 41 Ca -0.28 0.00 -0.27 0.00 -0.87 0.00 0.00 66.00 64.58 2dzr h PRO 41 Cb 1.07 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.10 2dzr h PRO 41 CO 0.52 0.19 0.22 0.41 -0.23 0.00 0.00 178.00 179.11 2dzr n GLY 42 N 0.57 3.67 0.10 1.56 0.00 -1.26 -4.29 105.19 105.54 2dzr n GLY 42 Ca 0.01 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 45.00 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 0.98 0.00 -4.10 1.61 7.64 -1.22 -4.99 113.62 113.53 2dzr n SER 43 Ca 0.29 0.00 -0.32 0.00 1.01 0.00 0.00 58.87 59.85 2dzr n SER 43 Cb 0.60 -0.33 -0.16 0.00 -1.01 0.00 0.00 64.21 63.31 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 -0.76 1.95 -0.01 0.44 1.01 -1.26 -4.45 120.40 117.32 2dzr s VAL 44 Ca 0.00 -0.88 -0.21 0.00 0.00 0.00 0.00 61.98 60.89 2dzr s VAL 44 Cb 0.00 -1.77 -0.05 0.00 0.00 0.00 0.00 36.38 34.56 2dzr s VAL 44 CO 0.00 0.52 0.62 -0.63 0.00 0.00 0.00 175.10 175.62 2dzr s ILE 45 N 1.29 4.92 -0.11 2.22 1.01 -1.08 -4.81 121.20 124.64 2dzr s ILE 45 Ca 0.04 1.30 0.04 0.00 0.00 0.00 0.00 60.65 62.03 2dzr s ILE 45 Cb -0.13 -3.96 0.00 0.00 0.01 0.00 0.00 42.46 38.38 2dzr s ILE 45 CO -0.12 0.39 -0.23 -0.63 0.00 0.00 0.00 174.94 174.35 2dzr s ILE 46 N -0.02 2.05 0.09 2.92 1.01 -1.26 0.29 121.20 126.28 2dzr s ILE 46 Ca 0.32 -1.00 -0.03 0.00 0.00 0.00 0.00 60.65 59.94 2dzr s ILE 46 Cb -0.18 -1.78 -0.03 0.00 0.01 0.00 0.00 42.46 40.48 2dzr s ILE 46 CO 0.18 0.55 0.06 -1.61 0.00 0.00 0.00 174.94 174.12 2dzr s GLU 47 N 0.47 0.78 0.00 2.79 0.41 -0.34 -4.77 118.70 118.04 2dzr s GLU 47 Ca -0.16 -1.24 0.00 0.00 -0.41 0.00 0.00 54.97 53.17 2dzr s GLU 47 Cb -0.17 0.25 0.00 0.00 -1.78 0.00 0.00 34.13 32.43 2dzr s GLU 47 CO 0.06 -0.20 0.00 0.41 -0.49 0.00 0.00 175.26 175.04 2dzr n GLY 48 N -0.00 0.94 3.22 -1.39 0.00 -1.26 0.20 105.19 106.89 2dzr n GLY 48 Ca -0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.56 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 -2.53 -4.79 0.99 4.77 -1.26 -3.87 117.00 110.30 2dzr n LEU 49 Ca 0.00 0.10 -0.29 0.00 -0.03 0.00 0.00 56.01 55.79 2dzr n LEU 49 Cb 0.00 -0.91 0.13 0.00 -2.33 0.00 0.00 43.42 40.30 2dzr n LEU 49 CO 0.00 -3.75 0.71 -2.16 -1.33 0.00 0.00 177.39 170.86 2dzr s PRO 50 N -2.96 1.35 -0.12 3.23 0.04 -1.26 -4.93 135.00 130.35 2dzr s PRO 50 Ca 0.50 0.37 -0.29 0.00 0.04 0.00 0.00 61.00 61.61 2dzr s PRO 50 Cb -0.12 -1.86 -0.02 0.00 0.04 0.00 0.00 34.50 32.54 2dzr s PRO 50 CO 0.70 -2.07 1.25 -1.25 0.04 0.00 0.00 177.00 175.68 2dzr s PRO 51 N -5.25 4.27 0.00 0.56 0.04 -1.26 -2.47 135.00 130.89 2dzr s PRO 51 Ca 0.63 1.68 0.00 0.00 0.04 0.00 0.00 61.00 63.35 2dzr s PRO 51 Cb -0.15 -3.69 0.00 0.00 0.04 0.00 0.00 34.50 30.70 2dzr s PRO 51 CO 0.53 -0.62 0.00 0.41 0.04 0.00 0.00 177.00 177.37 2dzr n GLY 52 N 3.54 0.30 3.03 0.56 0.00 -1.26 -5.04 105.19 106.32 2dzr n GLY 52 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 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 2.28 1.01 -0.61 1.01 -1.03 -5.11 121.20 116.75 2dzr s ILE 53 Ca 0.00 -2.20 -0.16 0.00 0.00 0.00 0.00 60.65 58.30 2dzr s ILE 53 Cb 0.00 -2.62 0.20 0.00 0.01 0.00 0.00 42.46 40.05 2dzr s ILE 53 CO 0.00 -0.49 1.19 -2.16 0.00 0.00 0.00 174.94 173.48 2dzr s PRO 54 N 0.95 0.27 -1.18 2.79 0.04 -1.26 -4.25 135.00 132.35 2dzr s PRO 54 Ca 0.07 -0.04 -0.20 0.00 0.04 0.00 0.00 61.00 60.87 2dzr s PRO 54 Cb -0.19 -1.77 0.05 0.00 0.04 0.00 0.00 34.50 32.63 2dzr s PRO 54 CO -0.07 -2.72 1.65 0.12 0.04 0.00 0.00 177.00 176.01 2dzr s PHE 55 N -3.39 2.63 0.34 0.56 5.36 -1.26 -4.88 117.98 117.34 2dzr s PHE 55 Ca 0.69 -1.21 0.03 0.00 -0.96 0.00 0.00 56.93 55.49 2dzr s PHE 55 Cb -0.10 -4.69 -0.01 0.00 -0.34 0.00 0.00 43.02 37.88 2dzr s PHE 55 CO 0.54 -1.83 0.39 0.54 -1.46 0.00 0.00 175.22 173.39 2dzr n ARG 56 N 8.58 0.56 -2.18 10.12 5.12 -1.26 -4.99 116.66 132.61 2dzr n ARG 56 Ca 0.43 -3.11 -0.35 0.00 -1.93 0.00 0.00 57.85 52.89 2dzr n ARG 56 Cb 0.48 2.75 0.01 0.00 -1.16 0.00 0.00 32.46 34.54 2dzr n ARG 56 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 2dzr s LYS 57 N -3.10 3.24 0.07 5.56 1.02 -1.26 -4.91 119.74 120.37 2dzr s LYS 57 Ca 0.35 1.69 0.23 0.00 0.02 0.00 0.00 55.97 58.26 2dzr s LYS 57 Cb 0.01 -1.99 0.92 0.00 -0.52 0.00 0.00 37.83 36.25 2dzr s LYS 57 CO 0.25 -0.96 1.72 -0.35 -0.92 0.00 0.00 175.35 175.09 2dzr n PRO 58 N -1.37 0.07 -0.18 -1.68 -0.04 -1.26 -2.98 135.00 127.56 2dzr n PRO 58 Ca 0.12 0.18 -0.08 0.00 -0.04 0.00 0.00 63.50 63.68 2dzr n PRO 58 Cb 0.50 -1.60 0.01 0.00 -0.04 0.00 0.00 33.50 32.37 2dzr n PRO 58 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2dzr n THR 60 N -4.56 0.09 -4.02 0.00 -2.24 -1.16 -4.76 114.28 97.62 2dzr n THR 60 Ca 0.02 0.02 -0.27 0.00 -2.27 0.00 0.00 64.05 61.56 2dzr n THR 60 Cb 0.14 -0.62 -0.05 0.00 -2.10 0.00 0.00 70.33 67.70 2dzr n THR 60 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 2dzr s PHE 61 N -2.22 3.29 0.33 4.78 0.08 -0.10 -5.10 117.98 119.03 2dzr s PHE 61 Ca 0.32 0.05 0.07 0.00 0.12 0.00 0.00 56.93 57.49 2dzr s PHE 61 Cb 0.17 -1.59 -0.01 0.00 -0.57 0.00 0.00 43.02 41.02 2dzr s PHE 61 CO 0.32 0.52 0.43 0.20 -0.10 0.00 0.00 175.22 176.59 2dzr s GLY 62 N -3.07 1.60 0.36 4.36 0.00 -1.26 -4.87 107.32 104.44 2dzr s GLY 62 Ca 0.32 -1.48 0.16 0.00 0.00 0.00 0.00 44.72 43.72 2dzr s GLY 62 CO 0.25 -1.40 1.68 1.48 0.00 0.00 0.00 173.10 175.11 2dzr h SER 63 N 0.98 0.51 0.36 1.64 4.64 -1.98 0.72 113.55 120.42 2dzr h SER 63 Ca -0.46 0.16 -0.02 0.00 -0.47 0.00 0.00 61.79 61.00 2dzr h SER 63 Cb 1.25 0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.45 2dzr h SER 63 CO 0.54 -0.07 -0.17 1.56 -0.87 0.00 0.00 176.83 177.81 2dzr h GLN 64 N 0.35 -0.47 -0.90 4.77 4.20 -1.99 0.50 115.11 121.57 2dzr h GLN 64 Ca 0.71 0.03 -0.00 0.00 0.06 0.00 0.00 58.65 59.45 2dzr h GLN 64 Cb 1.68 0.11 -0.04 0.00 0.30 0.00 0.00 27.48 29.52 2dzr h GLN 64 CO -0.52 -0.25 0.56 -0.91 -0.67 0.00 0.00 178.83 177.04 2dzr h ASN 65 N -0.60 1.07 0.63 1.46 4.21 -0.95 -2.73 115.58 118.66 2dzr h ASN 65 Ca -0.05 -0.05 -0.03 0.00 1.21 0.00 0.00 56.30 57.38 2dzr h ASN 65 Cb 0.44 -0.27 0.01 0.00 -1.12 0.00 0.00 38.32 37.38 2dzr h ASN 65 CO 0.08 0.80 -0.30 -0.07 -1.29 0.00 0.00 177.43 176.65 2dzr h LEU 66 N 1.24 -0.71 -1.35 1.61 3.38 0.53 -1.37 115.31 118.64 2dzr h LEU 66 Ca 0.33 0.02 0.44 0.00 0.09 0.00 0.00 57.88 58.76 2dzr h LEU 66 Cb -0.08 0.18 -0.10 0.00 0.09 0.00 0.00 40.66 40.75 2dzr h LEU 66 CO -0.06 -0.47 0.91 -0.62 0.09 0.00 0.00 178.44 178.28 2dzr n GLU 67 N -4.48 -0.02 0.04 1.13 1.02 0.17 0.15 120.64 118.65 2dzr n GLU 67 Ca -0.10 1.02 -0.10 0.00 -0.02 0.00 0.00 57.16 57.96 2dzr n GLU 67 Cb 0.33 -2.12 -0.07 0.00 -0.02 0.00 0.00 31.44 29.56 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 -0.18 -0.18 3.49 3.08 -1.15 -2.92 114.38 116.52 2dzr h ARG 68 Ca 0.77 0.01 0.02 0.00 0.07 0.00 0.00 59.98 60.85 2dzr h ARG 68 Cb 2.69 0.04 -0.03 0.00 0.08 0.00 0.00 29.97 32.75 2dzr h ARG 68 CO -0.27 0.25 -0.19 0.82 -1.07 0.00 0.00 179.97 179.51 2dzr h ILE 69 N -0.90 0.00 -1.11 2.04 2.04 0.25 1.19 117.51 121.03 2dzr h ILE 69 Ca -0.02 0.00 0.32 0.00 1.00 0.00 0.00 64.86 66.16 2dzr h ILE 69 Cb 0.52 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 36.55 2dzr h ILE 69 CO 0.03 0.00 0.92 -0.07 0.00 0.00 0.00 178.15 179.03 2dzr h LEU 70 N -0.11 0.00 0.24 1.44 3.38 -1.44 1.20 115.31 120.02 2dzr h LEU 70 Ca 0.03 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 2dzr h LEU 70 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 2dzr h LEU 70 CO -0.22 0.00 -0.11 0.00 0.09 0.00 0.00 178.44 178.19 2dzr h ALA 71 N 1.22 -0.32 -0.35 1.53 0.00 0.15 -2.91 119.26 118.58 2dzr h ALA 71 Ca 0.53 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 55.24 2dzr h ALA 71 Cb 2.35 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 20.26 2dzr h ALA 71 CO -0.01 -0.49 0.01 1.33 0.00 0.00 0.00 179.25 180.09 2dzr n VAL 72 N -5.07 1.66 -0.12 0.00 0.24 0.19 -4.34 118.33 110.89 2dzr n VAL 72 Ca -0.09 -0.84 0.27 0.00 -2.04 0.00 0.00 64.34 61.65 2dzr n VAL 72 Cb 0.25 -0.38 0.68 0.00 -1.47 0.00 0.00 33.84 32.93 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 3.16 2.66 -0.05 2.33 0.00 0.13 1.35 119.26 128.84 2dzr h ALA 73 Ca 0.01 -0.03 -0.24 0.00 0.00 0.00 0.00 54.91 54.65 2dzr h ALA 73 Cb 1.40 0.06 0.02 0.00 0.00 0.00 0.00 17.79 19.27 2dzr h ALA 73 CO 0.30 -1.18 -0.89 0.22 0.00 0.00 0.00 179.25 177.70 2dzr h ASP 74 N 0.00 0.88 0.00 0.00 3.58 -1.83 -3.27 116.42 115.78 2dzr h ASP 74 Ca 0.39 -0.70 -0.00 0.00 0.42 0.00 0.00 57.03 57.14 2dzr h ASP 74 Cb 1.90 -0.26 0.00 0.00 1.72 0.00 0.00 39.33 42.69 2dzr h ASP 74 CO -0.00 1.45 -0.00 0.11 -2.88 0.00 0.00 179.24 177.92 2dzr h LYS 75 N 0.38 -0.00 -6.10 0.28 1.79 0.14 -3.43 116.57 109.63 2dzr h LYS 75 Ca -0.10 0.00 -0.75 0.00 -2.18 0.00 0.00 60.65 57.62 2dzr h LYS 75 Cb 1.54 0.00 0.05 0.00 -1.58 0.00 0.00 32.23 32.24 2dzr h LYS 75 CO 0.18 0.11 0.21 -0.89 -1.08 0.00 0.00 179.45 177.98 2dzr n ILE 76 N -5.04 0.00 -3.69 1.86 5.41 -0.12 -4.19 119.36 113.59 2dzr n ILE 76 Ca -0.07 -0.00 -0.22 0.00 1.00 0.00 0.00 62.75 63.46 2dzr n ILE 76 Cb 0.08 -0.30 -0.18 0.00 -0.71 0.00 0.00 39.64 38.53 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 0.18 0.16 0.26 0.38 2.20 0.54 -4.93 119.74 118.52 2dzr s LYS 77 Ca 0.89 0.19 -0.08 0.00 -0.36 0.00 0.00 55.97 56.60 2dzr s LYS 77 Cb -1.15 -0.93 -0.07 0.00 -1.51 0.00 0.00 37.83 34.17 2dzr s LYS 77 CO 0.53 -0.39 0.56 -0.06 -0.36 0.00 0.00 175.35 175.63 2dzr s PHE 78 N 2.10 3.44 -0.10 4.03 0.40 -1.25 -1.20 117.98 125.39 2dzr s PHE 78 Ca 0.04 0.82 0.02 0.00 -0.60 0.00 0.00 56.93 57.22 2dzr s PHE 78 Cb -0.13 -2.23 0.01 0.00 0.51 0.00 0.00 43.02 41.18 2dzr s PHE 78 CO -0.05 0.22 -0.17 0.99 0.70 0.00 0.00 175.22 176.91 2dzr s THR 79 N -1.92 1.60 -0.08 0.64 2.01 0.15 -4.85 115.64 113.18 2dzr s THR 79 Ca 0.47 -0.72 0.05 0.00 0.31 0.00 0.00 61.69 61.80 2dzr s THR 79 Cb -0.11 -1.43 -0.01 0.00 0.01 0.00 0.00 72.50 70.96 2dzr s THR 79 CO 0.24 0.46 -0.25 -0.69 -0.69 0.00 0.00 174.62 173.69 2dzr s VAL 80 N 0.78 2.06 -0.23 3.82 1.01 -1.26 -2.63 120.40 123.94 2dzr s VAL 80 Ca -0.11 -1.04 -0.16 0.00 0.00 0.00 0.00 61.98 60.67 2dzr s VAL 80 Cb -0.16 -1.76 -0.10 0.00 0.00 0.00 0.00 36.38 34.36 2dzr s VAL 80 CO 0.02 0.57 -0.30 0.35 0.00 0.00 0.00 175.10 175.73 2dzr n THR 81 N 3.20 1.51 -1.42 3.92 -2.24 -1.26 -5.06 114.28 112.94 2dzr n THR 81 Ca -0.18 -0.15 0.16 0.00 -2.27 0.00 0.00 64.05 61.60 2dzr n THR 81 Cb 0.52 -2.08 -0.09 0.00 -2.10 0.00 0.00 70.33 66.59 2dzr n THR 81 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2dzr n ARG 82 N -4.35 -3.34 -1.53 -0.78 5.12 -1.26 -4.92 116.66 105.60 2dzr n ARG 82 Ca -0.37 2.72 -0.29 0.00 -1.93 0.00 0.00 57.85 57.98 2dzr n ARG 82 Cb 0.72 -3.83 0.16 0.00 -1.16 0.00 0.00 32.46 28.35 2dzr n ARG 82 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 2dzr s PRO 83 N -4.39 0.64 -0.35 5.56 0.04 -1.26 -4.99 135.00 130.24 2dzr s PRO 83 Ca 0.00 0.10 -0.25 0.00 0.04 0.00 0.00 61.00 60.89 2dzr s PRO 83 Cb 0.00 -1.80 0.01 0.00 0.04 0.00 0.00 34.50 32.75 2dzr s PRO 83 CO 0.00 -2.50 0.87 -0.06 0.04 0.00 0.00 177.00 175.35 2dzr s PHE 84 N -3.35 3.12 0.17 0.56 0.08 -1.26 -4.79 117.98 112.51 2dzr s PHE 84 Ca 0.67 0.76 0.00 0.00 0.12 0.00 0.00 56.93 58.48 2dzr s PHE 84 Cb -0.12 -3.51 0.00 0.00 -0.57 0.00 0.00 43.02 38.83 2dzr s PHE 84 CO 0.54 -0.75 0.00 0.94 -0.10 0.00 0.00 175.22 175.85 2dzr n GLN 85 N 6.58 0.00 -1.93 0.44 7.27 -1.26 -5.14 117.38 123.35 2dzr n GLN 85 Ca 0.06 0.00 -0.02 0.00 0.07 0.00 0.00 57.00 57.11 2dzr n GLN 85 Cb 0.48 -0.15 -0.00 0.00 2.41 0.00 0.00 30.24 32.97 2dzr n GLN 85 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2dzr n GLY 86 N 2.07 3.60 3.20 1.69 0.00 -1.26 -5.11 105.19 109.38 2dzr n GLY 86 Ca 0.00 -2.20 -0.34 0.00 0.00 0.00 0.00 46.02 43.48 2dzr n GLY 86 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2dzr n LEU 87 N 0.00 -2.51 -4.65 0.99 -0.00 -1.26 -4.79 117.00 104.78 2dzr n LEU 87 Ca -0.01 0.00 -0.43 0.00 -0.00 0.00 0.00 56.01 55.58 2dzr n LEU 87 Cb 0.05 -0.86 -0.00 0.00 -0.00 0.00 0.00 43.42 42.60 2dzr n LEU 87 CO 0.03 -3.29 0.75 -0.38 -0.00 0.00 0.00 177.39 174.49 2dzr n ILE 88 N -3.89 2.11 -1.87 1.47 2.08 -1.26 -4.94 119.36 113.06 2dzr n ILE 88 Ca 0.01 -0.50 -0.32 0.00 0.56 0.00 0.00 62.75 62.50 2dzr n ILE 88 Cb 0.64 -1.33 0.02 0.00 -0.75 0.00 0.00 39.64 38.22 2dzr n ILE 88 CO 0.00 0.00 0.00 -2.16 0.56 0.00 0.00 176.55 174.95 2dzr s PRO 89 N -1.83 3.21 0.08 0.38 0.04 -1.26 -4.93 135.00 130.68 2dzr s PRO 89 Ca 0.58 1.08 -0.36 0.00 0.04 0.00 0.00 61.00 62.33 2dzr s PRO 89 Cb -0.60 -2.02 -0.16 0.00 0.04 0.00 0.00 34.50 31.76 2dzr s PRO 89 CO 0.60 -0.89 1.41 1.17 0.04 0.00 0.00 177.00 179.33 2dzr n LYS 90 N -2.47 1.34 -2.30 4.56 4.81 -1.26 -4.81 118.16 118.02 2dzr n LYS 90 Ca 0.08 0.48 -0.36 0.00 -0.87 0.00 0.00 58.31 57.64 2dzr n LYS 90 Cb 0.53 -2.15 -0.04 0.00 0.02 0.00 0.00 35.03 33.39 2dzr n LYS 90 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 2dzr s PRO 91 N 0.73 3.01 -0.26 1.64 0.04 -1.26 -4.93 135.00 133.97 2dzr s PRO 91 Ca 0.84 -0.34 -0.38 0.00 0.04 0.00 0.00 61.00 61.17 2dzr s PRO 91 Cb -0.91 -4.82 -0.14 0.00 0.04 0.00 0.00 34.50 28.67 2dzr s PRO 91 CO 0.46 -2.64 1.88 -0.25 0.04 0.00 0.00 177.00 176.49 2dzr n ASP 92 N 11.25 2.54 -4.72 6.66 9.92 -1.26 -4.89 116.55 136.05 2dzr n ASP 92 Ca 0.26 0.90 -0.41 0.00 -0.53 0.00 0.00 54.79 55.01 2dzr n ASP 92 Cb 0.50 -1.21 -0.04 0.00 -0.64 0.00 0.00 41.12 39.73 2dzr n ASP 92 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 2dzr s GLU 93 N 4.32 4.55 -0.49 -1.24 8.01 -1.26 -5.02 118.70 127.58 2dzr s GLU 93 Ca 1.00 1.27 0.03 0.00 0.01 0.00 0.00 54.97 57.29 2dzr s GLU 93 Cb -0.95 -3.43 0.13 0.00 -4.31 0.00 0.00 34.13 25.56 2dzr s GLU 93 CO 0.59 0.07 0.23 0.45 0.01 0.00 0.00 175.26 176.61 2dzr s SER 94 N 0.64 4.53 0.00 -0.19 0.15 -1.26 -5.05 113.70 112.51 2dzr s SER 94 Ca 0.46 -2.79 0.00 0.00 0.70 0.00 0.00 55.95 54.33 2dzr s SER 94 Cb -0.21 -1.66 0.00 0.00 -1.71 0.00 0.00 66.02 62.44 2dzr s SER 94 CO 0.26 -0.29 0.00 0.61 1.20 0.00 0.00 173.24 175.02 2dzr n GLY 95 N 3.43 5.23 3.80 9.45 0.00 -1.26 -5.15 105.19 120.69 2dzr n GLY 95 Ca 0.05 -1.34 -0.33 0.00 0.00 0.00 0.00 46.02 44.39 2dzr n GLY 95 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dzr s PRO 96 N 1.25 3.54 -0.29 1.61 0.04 -1.26 -5.06 135.00 134.83 2dzr s PRO 96 Ca 0.00 1.24 -0.14 0.00 0.04 0.00 0.00 61.00 62.14 2dzr s PRO 96 Cb 0.00 -2.06 0.13 0.00 0.04 0.00 0.00 34.50 32.61 2dzr s PRO 96 CO 0.00 -0.63 0.81 0.45 0.04 0.00 0.00 177.00 177.67 2dzr s SER 97 N -2.53 -0.83 -0.23 6.66 0.15 -1.26 -5.13 113.70 110.53 2dzr s SER 97 Ca 0.64 1.20 -0.04 0.00 0.70 0.00 0.00 55.95 58.46 2dzr s SER 97 Cb -0.16 1.76 0.08 0.00 -1.71 0.00 0.00 66.02 65.99 2dzr s SER 97 CO 0.30 -0.18 0.10 -0.94 1.20 0.00 0.00 173.24 173.72 2dzr s SER 98 N 2.26 2.99 0.00 5.45 1.04 -1.26 -4.97 113.70 119.22 2dzr s SER 98 Ca -0.06 -0.97 0.26 0.00 0.48 0.00 0.00 55.95 55.66 2dzr s SER 98 Cb -0.07 -0.39 1.53 0.00 0.10 0.00 0.00 66.02 67.18 2dzr s SER 98 CO -0.18 -0.38 1.88 0.61 0.98 0.00 0.00 173.24 176.15