#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dzr s SER 2 N 0.00 5.37 0.01 1.61 1.04 -1.26 -5.05 113.70 115.42 2dzr s SER 2 Ca 0.00 0.29 -0.05 0.00 0.48 0.00 0.00 55.95 56.66 2dzr s SER 2 Cb 0.00 -1.23 -0.02 0.00 0.10 0.00 0.00 66.02 64.87 2dzr s SER 2 CO 0.00 -1.11 -0.11 -0.24 0.98 0.00 0.00 173.24 172.76 2dzr n SER 3 N -2.44 1.34 0.00 7.02 2.88 -1.26 -5.02 113.62 116.15 2dzr n SER 3 Ca 0.06 0.19 0.00 0.00 -1.33 0.00 0.00 58.87 57.79 2dzr n SER 3 Cb 0.59 -0.45 0.00 0.00 -0.75 0.00 0.00 64.21 63.59 2dzr n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dzr n GLY 4 N 2.87 4.70 2.93 0.46 0.00 -1.26 -4.77 105.19 110.11 2dzr n GLY 4 Ca -0.05 -0.79 -0.31 0.00 0.00 0.00 0.00 46.02 44.88 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 0.00 4.48 0.51 1.61 0.01 -1.26 -5.04 113.70 114.01 2dzr s SER 5 Ca 0.00 -2.16 0.00 0.00 1.31 0.00 0.00 55.95 55.10 2dzr s SER 5 Cb 0.00 -1.41 0.00 0.00 0.21 0.00 0.00 66.02 64.82 2dzr s SER 5 CO 0.00 -0.37 0.00 -1.20 0.41 0.00 0.00 173.24 172.08 2dzr n SER 6 N 4.22 -7.87 -1.34 2.44 7.64 -1.26 -5.03 113.62 112.43 2dzr n SER 6 Ca 0.03 1.12 0.00 0.00 1.01 0.00 0.00 58.87 61.03 2dzr n SER 6 Cb 0.40 -4.50 0.00 0.00 -1.01 0.00 0.00 64.21 59.11 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 -4.21 -2.17 0.00 0.23 0.00 -1.26 -4.51 105.19 93.28 2dzr n GLY 7 Ca -0.06 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.08 0.00 -0.32 0.99 4.77 -1.26 0.17 117.00 121.26 2dzr n LEU 8 Ca 0.00 0.92 0.13 0.00 -0.03 0.00 0.00 56.01 57.03 2dzr n LEU 8 Cb 0.00 -0.42 0.26 0.00 -2.33 0.00 0.00 43.42 40.94 2dzr n LEU 8 CO 0.00 -0.42 0.73 -1.14 -1.33 0.00 0.00 177.39 175.24 2dzr n ARG 9 N -2.56 -0.08 -0.10 3.23 0.63 -1.26 0.18 116.66 116.70 2dzr n ARG 9 Ca 0.00 1.40 -0.07 0.00 -0.92 0.00 0.00 57.85 58.27 2dzr n ARG 9 Cb 0.00 -2.22 0.01 0.00 0.45 0.00 0.00 32.46 30.70 2dzr n ARG 9 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 2dzr h GLU 10 N 0.00 0.29 0.41 -0.14 4.39 -0.92 0.55 114.58 119.16 2dzr h GLU 10 Ca 0.56 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 60.23 2dzr h GLU 10 Cb 1.13 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 29.69 2dzr h GLU 10 CO -0.89 0.19 -0.50 1.96 -1.16 0.00 0.00 179.01 178.62 2dzr h GLN 11 N 0.29 -0.90 0.27 2.33 4.20 0.61 0.62 115.11 122.54 2dzr h GLN 11 Ca 0.15 0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.93 2dzr h GLN 11 Cb 0.11 0.20 -0.02 0.00 0.30 0.00 0.00 27.48 28.07 2dzr h GLN 11 CO -0.14 -0.60 -0.31 0.28 -0.67 0.00 0.00 178.83 177.39 2dzr h VAL 12 N -0.93 0.35 -1.09 -0.54 2.07 -1.01 0.61 116.25 115.72 2dzr h VAL 12 Ca -0.04 0.00 0.37 0.00 0.82 0.00 0.00 66.70 67.84 2dzr h VAL 12 Cb 0.83 0.35 -0.15 0.00 -1.52 0.00 0.00 31.29 30.81 2dzr h VAL 12 CO -0.11 0.00 0.65 1.56 0.02 0.00 0.00 177.57 179.68 2dzr h GLN 13 N -0.62 0.20 0.15 1.57 4.20 0.33 1.46 115.11 122.39 2dzr h GLN 13 Ca -0.00 -0.01 -0.28 0.00 0.06 0.00 0.00 58.65 58.41 2dzr h GLN 13 Cb 0.58 -0.05 0.01 0.00 0.30 0.00 0.00 27.48 28.33 2dzr h GLN 13 CO -0.09 0.13 -1.27 0.22 -0.67 0.00 0.00 178.83 177.15 2dzr h ASP 14 N 0.21 0.54 0.00 1.46 3.58 0.39 -3.20 116.42 119.39 2dzr h ASP 14 Ca 0.77 -0.56 0.00 0.00 0.42 0.00 0.00 57.03 57.66 2dzr h ASP 14 Cb 2.01 -0.17 0.00 0.00 1.72 0.00 0.00 39.33 42.88 2dzr h ASP 14 CO -0.57 1.43 0.00 -0.11 -2.88 0.00 0.00 179.24 177.11 2dzr n LEU 15 N -3.60 0.00 -0.47 2.28 7.94 0.48 0.18 117.00 123.81 2dzr n LEU 15 Ca -0.10 0.91 0.39 0.00 -1.11 0.00 0.00 56.01 56.10 2dzr n LEU 15 Cb 1.03 -0.41 0.68 0.00 0.53 0.00 0.00 43.42 45.24 2dzr n LEU 15 CO 0.55 -0.41 1.27 -0.26 -1.11 0.00 0.00 177.39 177.43 2dzr h PHE 16 N 0.00 0.44 0.38 1.96 -1.00 -1.19 0.78 116.94 118.31 2dzr h PHE 16 Ca 0.00 0.02 -0.02 0.00 2.81 0.00 0.00 57.97 60.78 2dzr h PHE 16 Cb 0.00 -0.11 0.00 0.00 3.61 0.00 0.00 35.95 39.46 2dzr h PHE 16 CO -0.08 -0.18 -0.18 -0.91 -1.61 0.00 0.00 178.31 175.35 2dzr h ASN 17 N 0.07 -0.43 0.06 2.17 2.35 -1.35 -2.63 115.58 115.81 2dzr h ASN 17 Ca 0.83 0.01 0.02 0.00 -0.55 0.00 0.00 56.30 56.61 2dzr h ASN 17 Cb 2.73 0.11 -0.05 0.00 0.05 0.00 0.00 38.32 41.16 2dzr h ASN 17 CO -0.36 0.00 -0.47 0.50 -1.65 0.00 0.00 177.43 175.46 2dzr h LYS 18 N -1.14 -0.63 -0.93 0.81 3.11 0.50 -0.87 116.57 117.43 2dzr h LYS 18 Ca -0.05 0.04 0.20 0.00 -2.81 0.00 0.00 60.65 58.03 2dzr h LYS 18 Cb 0.40 0.14 -0.18 0.00 -1.00 0.00 0.00 32.23 31.60 2dzr h LYS 18 CO 0.09 -0.42 -0.18 0.87 -2.81 0.00 0.00 179.45 177.00 2dzr h LYS 19 N -0.66 0.01 -0.97 1.90 1.79 0.26 0.32 116.57 119.23 2dzr h LYS 19 Ca 0.02 -0.00 0.15 0.00 -2.18 0.00 0.00 60.65 58.64 2dzr h LYS 19 Cb 0.70 -0.00 -0.15 0.00 -1.58 0.00 0.00 32.23 31.20 2dzr h LYS 19 CO -0.30 0.00 -0.39 0.98 -1.08 0.00 0.00 179.45 178.66 2dzr n TYR 20 N -5.56 -0.00 -0.54 -1.35 9.36 -0.34 0.16 117.16 118.89 2dzr n TYR 20 Ca 0.16 1.19 0.43 0.00 3.32 0.00 0.00 57.90 63.00 2dzr n TYR 20 Cb 0.52 -0.84 0.69 0.00 -0.63 0.00 0.00 39.34 39.07 2dzr n TYR 20 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2dzr n GLY 21 N -1.44 -0.84 0.12 2.98 0.00 0.11 0.12 105.19 106.23 2dzr n GLY 21 Ca 0.09 0.68 -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 -0.16 -0.72 1.61 5.08 0.14 1.09 114.58 121.62 2dzr h GLU 22 Ca 0.84 0.01 0.15 0.00 -1.00 0.00 0.00 59.36 59.36 2dzr h GLU 22 Cb 3.02 0.04 -0.13 0.00 0.50 0.00 0.00 28.75 32.17 2dzr h GLU 22 CO -0.24 0.30 -0.12 0.00 -1.00 0.00 0.00 179.01 177.95 2dzr h ALA 23 N -0.26 0.56 0.00 3.43 0.00 0.99 0.87 119.26 124.85 2dzr h ALA 23 Ca -0.02 0.27 -0.09 0.00 0.00 0.00 0.00 54.91 55.07 2dzr h ALA 23 Cb 0.54 0.50 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 2dzr h ALA 23 CO 0.03 -0.42 -0.43 -0.07 0.00 0.00 0.00 179.25 178.36 2dzr h LEU 24 N 0.03 0.00 0.00 0.00 3.38 -1.26 -3.45 115.31 114.01 2dzr h LEU 24 Ca 0.36 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.33 2dzr h LEU 24 Cb 0.58 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.33 2dzr h LEU 24 CO -0.71 0.43 0.00 0.61 0.09 0.00 0.00 178.44 178.86 2dzr n GLY 25 N 1.06 1.38 3.11 0.83 0.00 0.30 -4.16 105.19 107.70 2dzr n GLY 25 Ca 0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.00 0.00 -0.08 -0.61 5.41 0.31 -4.80 119.36 117.59 2dzr n ILE 26 Ca 0.00 -0.24 -0.10 0.00 1.00 0.00 0.00 62.75 63.41 2dzr n ILE 26 Cb 0.00 -0.20 -0.10 0.00 -0.71 0.00 0.00 39.64 38.63 2dzr n ILE 26 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.55 177.72 2dzr n LYS 27 N 1.09 1.01 -2.26 0.38 4.81 -1.26 -4.42 118.16 117.51 2dzr n LYS 27 Ca -0.00 0.05 -0.28 0.00 -0.87 0.00 0.00 58.31 57.21 2dzr n LYS 27 Cb 0.64 -1.38 0.03 0.00 0.02 0.00 0.00 35.03 34.34 2dzr n LYS 27 CO 0.00 0.00 0.00 1.52 1.17 0.00 0.00 177.40 180.09 2dzr s TYR 28 N -2.37 3.33 -0.30 5.64 -0.85 -1.26 -4.75 117.35 116.79 2dzr s TYR 28 Ca -0.17 0.81 -0.29 0.00 -0.52 0.00 0.00 57.07 56.90 2dzr s TYR 28 Cb 0.06 -2.78 -0.00 0.00 0.38 0.00 0.00 41.96 39.62 2dzr s TYR 28 CO 0.52 -0.85 1.35 -1.25 -1.52 0.00 0.00 175.55 173.80 2dzr s PRO 29 N -5.07 3.88 0.25 -3.49 0.04 -1.26 -4.67 135.00 124.67 2dzr s PRO 29 Ca 0.54 1.28 0.06 0.00 0.04 0.00 0.00 61.00 62.92 2dzr s PRO 29 Cb -0.11 -3.91 -0.03 0.00 0.04 0.00 0.00 34.50 30.49 2dzr s PRO 29 CO 0.47 -1.17 0.31 0.08 0.04 0.00 0.00 177.00 176.73 2dzr s VAL 30 N 4.56 4.94 -0.16 -0.36 1.01 -1.26 -5.01 120.40 124.12 2dzr s VAL 30 Ca 0.59 -1.13 -0.05 0.00 0.00 0.00 0.00 61.98 61.39 2dzr s VAL 30 Cb -0.18 -3.69 -0.03 0.00 0.00 0.00 0.00 36.38 32.48 2dzr s VAL 30 CO 0.25 -0.33 0.01 -1.10 0.00 0.00 0.00 175.10 173.92 2dzr s GLN 31 N -3.94 3.72 0.18 2.72 -0.21 -1.26 -3.95 119.66 116.92 2dzr s GLN 31 Ca 0.34 -0.43 -0.30 0.00 0.02 0.00 0.00 55.36 54.99 2dzr s GLN 31 Cb -0.09 -3.02 -0.08 0.00 1.00 0.00 0.00 33.01 30.82 2dzr s GLN 31 CO 0.28 0.31 1.26 0.08 -2.12 0.00 0.00 175.29 175.09 2dzr s VAL 32 N 0.21 3.42 -1.13 1.09 1.01 -1.26 -4.90 120.40 118.84 2dzr s VAL 32 Ca 0.01 1.17 -0.19 0.00 0.00 0.00 0.00 61.98 62.97 2dzr s VAL 32 Cb -0.13 -3.75 -0.05 0.00 0.00 0.00 0.00 36.38 32.45 2dzr s VAL 32 CO 0.02 0.17 2.01 -0.81 0.00 0.00 0.00 175.10 176.49 2dzr n PRO 33 N 2.69 2.20 -0.12 2.72 -0.04 -1.26 -4.72 135.00 136.47 2dzr n PRO 33 Ca 0.06 -2.37 -0.05 0.00 -0.04 0.00 0.00 63.50 61.10 2dzr n PRO 33 Cb 0.44 -3.22 0.03 0.00 -0.04 0.00 0.00 33.50 30.71 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 0.10 0.10 0.54 0.05 -1.96 0.39 116.97 123.60 2dzr h TYR 34 Ca 0.45 0.02 0.01 0.00 0.05 0.00 0.00 58.73 59.27 2dzr h TYR 34 Cb 0.72 0.01 -0.03 0.00 1.01 0.00 0.00 36.73 38.44 2dzr h TYR 34 CO 1.34 -0.00 -0.37 0.87 -1.05 0.00 0.00 178.16 178.95 2dzr h LYS 35 N 0.19 -0.52 -0.42 4.88 1.57 -1.99 0.94 116.57 121.22 2dzr h LYS 35 Ca 0.19 0.04 0.12 0.00 -1.87 0.00 0.00 60.65 59.13 2dzr h LYS 35 Cb 0.24 0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.65 2dzr h LYS 35 CO -0.26 -0.34 0.30 0.00 -0.57 0.00 0.00 179.45 178.57 2dzr h ARG 36 N -0.54 0.02 0.00 3.15 3.08 -1.85 0.61 114.38 118.84 2dzr h ARG 36 Ca -0.01 -0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.94 2dzr h ARG 36 Cb 0.53 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.56 2dzr h ARG 36 CO -0.19 0.01 -0.46 0.82 -1.07 0.00 0.00 179.97 179.08 2dzr h ILE 37 N 0.02 1.03 0.03 2.04 2.04 0.19 0.43 117.51 123.29 2dzr h ILE 37 Ca 0.20 -1.79 -0.09 0.00 1.00 0.00 0.00 64.86 64.18 2dzr h ILE 37 Cb 0.78 2.06 0.01 0.00 -0.74 0.00 0.00 36.82 38.92 2dzr h ILE 37 CO -0.01 0.45 -0.39 0.50 0.00 0.00 0.00 178.15 178.71 2dzr h LYS 38 N 0.00 0.21 -0.28 2.37 3.64 0.63 -3.28 116.57 119.85 2dzr h LYS 38 Ca -0.00 -0.27 -0.12 0.00 -1.27 0.00 0.00 60.65 58.99 2dzr h LYS 38 Cb 1.02 0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.92 2dzr h LYS 38 CO 0.06 1.04 -0.29 0.77 -2.27 0.00 0.00 179.45 178.76 2dzr h SER 39 N -0.50 0.74 -3.59 4.20 0.02 -0.96 -3.41 113.55 110.06 2dzr h SER 39 Ca -0.06 -0.48 -0.67 0.00 -0.84 0.00 0.00 61.79 59.75 2dzr h SER 39 Cb 1.20 -0.21 -0.36 0.00 0.14 0.00 0.00 62.40 63.17 2dzr h SER 39 CO 0.08 1.06 -0.82 0.21 -1.14 0.00 0.00 176.83 176.22 2dzr s ASN 40 N -6.54 3.99 0.23 3.07 3.84 0.15 -4.98 114.94 114.70 2dzr s ASN 40 Ca -0.12 -1.14 0.10 0.00 0.21 0.00 0.00 52.86 51.90 2dzr s ASN 40 Cb 0.09 -1.52 0.18 0.00 -0.55 0.00 0.00 41.25 39.44 2dzr s ASN 40 CO 0.83 -0.13 1.51 1.55 -2.79 0.00 0.00 177.10 178.07 2dzr h PRO 41 N 7.83 0.00 -1.97 0.43 0.13 -1.80 -3.28 132.00 133.34 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 -0.10 0.00 0.13 0.00 0.00 31.00 32.10 2dzr h PRO 41 CO 0.52 0.73 -0.07 0.41 -0.23 0.00 0.00 178.00 179.36 2dzr n GLY 42 N 0.62 3.42 0.34 1.56 0.00 -1.26 -4.23 105.19 105.64 2dzr n GLY 42 Ca -0.01 -1.29 0.00 0.00 0.00 0.00 0.00 46.02 44.72 2dzr n GLY 42 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dzr n SER 43 N 1.80 0.00 -4.22 1.61 3.41 -1.24 -5.02 113.62 109.96 2dzr n SER 43 Ca 0.40 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.68 2dzr n SER 43 Cb 0.75 -0.24 -0.16 0.00 -0.26 0.00 0.00 64.21 64.30 2dzr n SER 43 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2dzr s VAL 44 N -0.81 2.26 -0.16 -3.33 1.01 -1.26 -4.19 120.40 113.92 2dzr s VAL 44 Ca 0.00 -0.92 -0.13 0.00 0.00 0.00 0.00 61.98 60.92 2dzr s VAL 44 Cb 0.00 -1.91 -0.05 0.00 0.00 0.00 0.00 36.38 34.43 2dzr s VAL 44 CO 0.00 0.54 0.28 -0.63 0.00 0.00 0.00 175.10 175.29 2dzr s ILE 45 N 0.68 5.31 -0.13 2.22 1.01 -0.99 -4.83 121.20 124.46 2dzr s ILE 45 Ca -0.10 0.52 -0.00 0.00 0.00 0.00 0.00 60.65 61.07 2dzr s ILE 45 Cb -0.16 -3.61 -0.01 0.00 0.01 0.00 0.00 42.46 38.68 2dzr s ILE 45 CO 0.02 0.41 -0.13 -0.63 0.00 0.00 0.00 174.94 174.60 2dzr s ILE 46 N 0.35 3.01 0.13 2.92 1.01 -1.26 0.71 121.20 128.07 2dzr s ILE 46 Ca 0.16 -0.68 -0.01 0.00 0.00 0.00 0.00 60.65 60.12 2dzr s ILE 46 Cb -0.13 -2.26 -0.04 0.00 0.01 0.00 0.00 42.46 40.04 2dzr s ILE 46 CO 0.04 0.52 0.07 -1.61 0.00 0.00 0.00 174.94 173.96 2dzr s GLU 47 N 0.36 0.93 0.00 2.79 0.41 0.44 -4.73 118.70 118.90 2dzr s GLU 47 Ca -0.11 -1.42 0.00 0.00 -0.41 0.00 0.00 54.97 53.03 2dzr s GLU 47 Cb -0.16 0.25 0.00 0.00 -1.78 0.00 0.00 34.13 32.44 2dzr s GLU 47 CO 0.06 -0.26 0.00 0.41 -0.49 0.00 0.00 175.26 174.97 2dzr n GLY 48 N -0.09 1.33 3.27 -1.39 0.00 -1.26 0.19 105.19 107.23 2dzr n GLY 48 Ca -0.06 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 -2.06 -4.79 0.99 4.77 -1.26 -3.95 117.00 110.70 2dzr n LEU 49 Ca 0.00 0.14 -0.29 0.00 -0.03 0.00 0.00 56.01 55.83 2dzr n LEU 49 Cb 0.00 -0.99 0.13 0.00 -2.33 0.00 0.00 43.42 40.23 2dzr n LEU 49 CO 0.00 -3.78 0.72 -2.16 -1.33 0.00 0.00 177.39 170.84 2dzr s PRO 50 N -3.16 1.17 -0.12 3.23 0.04 -1.26 -4.95 135.00 129.95 2dzr s PRO 50 Ca 0.52 0.29 -0.29 0.00 0.04 0.00 0.00 61.00 61.56 2dzr s PRO 50 Cb -0.15 -1.84 -0.02 0.00 0.04 0.00 0.00 34.50 32.53 2dzr s PRO 50 CO 0.70 -2.18 1.25 -1.25 0.04 0.00 0.00 177.00 175.56 2dzr s PRO 51 N -5.28 4.27 0.00 0.56 0.04 -1.26 -2.47 135.00 130.86 2dzr s PRO 51 Ca 0.64 1.68 0.00 0.00 0.04 0.00 0.00 61.00 63.36 2dzr s PRO 51 Cb -0.15 -3.70 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 0.00 177.00 177.36 2dzr n GLY 52 N 3.54 0.26 3.02 0.56 0.00 -1.26 -5.03 105.19 106.28 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 2.33 1.03 -0.61 1.01 -1.03 -5.11 121.20 116.82 2dzr s ILE 53 Ca 0.00 -2.41 -0.16 0.00 0.00 0.00 0.00 60.65 58.09 2dzr s ILE 53 Cb 0.00 -2.71 0.21 0.00 0.01 0.00 0.00 42.46 39.97 2dzr s ILE 53 CO 0.00 -0.62 1.19 -2.16 0.00 0.00 0.00 174.94 173.36 2dzr s PRO 54 N 0.83 0.17 -1.13 2.79 0.04 -1.26 -4.20 135.00 132.24 2dzr s PRO 54 Ca 0.11 -0.08 -0.21 0.00 0.04 0.00 0.00 61.00 60.86 2dzr s PRO 54 Cb -0.20 -1.76 0.04 0.00 0.04 0.00 0.00 34.50 32.63 2dzr s PRO 54 CO -0.07 -2.78 1.63 0.12 0.04 0.00 0.00 177.00 175.93 2dzr s PHE 55 N -3.41 2.53 0.33 0.56 5.36 -1.26 -4.89 117.98 117.20 2dzr s PHE 55 Ca 0.70 -0.94 0.03 0.00 -0.96 0.00 0.00 56.93 55.77 2dzr s PHE 55 Cb -0.09 -4.62 -0.02 0.00 -0.34 0.00 0.00 43.02 37.95 2dzr s PHE 55 CO 0.54 -1.83 0.34 1.03 -1.46 0.00 0.00 175.22 173.85 2dzr s ARG 56 N 4.96 1.79 0.60 10.12 1.81 -1.26 -4.97 118.95 131.99 2dzr s ARG 56 Ca 0.52 -1.91 -0.19 0.00 -1.72 0.00 0.00 55.73 52.44 2dzr s ARG 56 Cb 0.01 0.37 -0.03 0.00 -0.45 0.00 0.00 34.95 34.84 2dzr s ARG 56 CO -0.01 -0.69 1.19 0.15 -0.68 0.00 0.00 175.30 175.26 2dzr s LYS 57 N -3.32 2.98 0.28 3.54 1.02 -1.26 -4.91 119.74 118.07 2dzr s LYS 57 Ca 0.37 1.78 0.26 0.00 0.02 0.00 0.00 55.97 58.40 2dzr s LYS 57 Cb 0.02 -1.94 0.89 0.00 -0.52 0.00 0.00 37.83 36.28 2dzr s LYS 57 CO 0.24 -1.19 1.76 -1.00 -0.92 0.00 0.00 175.35 174.24 2dzr h PRO 58 N 0.84 0.00 -0.59 -1.68 0.13 -1.95 -2.98 132.00 125.77 2dzr h PRO 58 Ca -0.50 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.53 2dzr h PRO 58 Cb 1.29 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.40 2dzr h PRO 58 CO 0.55 0.00 -0.03 0.00 -0.23 0.00 0.00 178.00 178.29 2dzr n THR 60 N -4.17 0.60 -3.82 0.00 -2.24 -1.12 -4.75 114.28 98.79 2dzr n THR 60 Ca 0.03 0.15 -0.21 0.00 -2.27 0.00 0.00 64.05 61.75 2dzr n THR 60 Cb 0.36 -0.83 -0.02 0.00 -2.10 0.00 0.00 70.33 67.73 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 -2.82 3.14 0.36 4.78 0.08 -0.47 -5.08 117.98 117.97 2dzr s PHE 61 Ca 0.13 -0.17 0.08 0.00 0.12 0.00 0.00 56.93 57.09 2dzr s PHE 61 Cb 0.12 -1.71 -0.03 0.00 -0.57 0.00 0.00 43.02 40.83 2dzr s PHE 61 CO 0.32 0.26 0.29 0.20 -0.10 0.00 0.00 175.22 176.19 2dzr s GLY 62 N -4.01 1.90 0.28 4.36 0.00 -1.26 -4.90 107.32 103.69 2dzr s GLY 62 Ca 0.39 -1.75 -0.03 0.00 0.00 0.00 0.00 44.72 43.33 2dzr s GLY 62 CO 0.28 -1.64 1.60 1.48 0.00 0.00 0.00 173.10 174.82 2dzr h SER 63 N 1.24 -0.47 0.12 1.64 4.64 -1.98 0.26 113.55 119.01 2dzr h SER 63 Ca -0.44 0.25 0.00 0.00 -0.47 0.00 0.00 61.79 61.13 2dzr h SER 63 Cb 1.26 0.44 -0.03 0.00 -0.31 0.00 0.00 62.40 63.76 2dzr h SER 63 CO 0.59 -0.27 -0.32 1.56 -0.87 0.00 0.00 176.83 177.51 2dzr h GLN 64 N 0.05 -0.48 -0.25 4.77 7.50 -1.99 0.47 115.11 125.19 2dzr h GLN 64 Ca 0.51 0.03 0.06 0.00 0.50 0.00 0.00 58.65 59.75 2dzr h GLN 64 Cb 0.96 0.11 -0.08 0.00 0.05 0.00 0.00 27.48 28.52 2dzr h GLN 64 CO -0.82 -0.32 -0.35 -0.91 -1.50 0.00 0.00 178.83 174.93 2dzr h ASN 65 N -0.50 -1.12 -0.32 1.46 4.21 -1.43 -1.97 115.58 115.91 2dzr h ASN 65 Ca -0.01 0.17 0.04 0.00 1.21 0.00 0.00 56.30 57.71 2dzr h ASN 65 Cb 0.48 0.49 -0.06 0.00 -1.12 0.00 0.00 38.32 38.11 2dzr h ASN 65 CO -0.15 -0.36 -0.44 -0.07 -1.29 0.00 0.00 177.43 175.12 2dzr h LEU 66 N -0.35 -1.48 -1.30 1.61 3.38 -0.21 0.62 115.31 117.57 2dzr h LEU 66 Ca 0.12 0.19 0.42 0.00 0.09 0.00 0.00 57.88 58.71 2dzr h LEU 66 Cb 0.56 0.61 -0.10 0.00 0.09 0.00 0.00 40.66 41.81 2dzr h LEU 66 CO -0.44 -0.32 0.87 -0.62 0.09 0.00 0.00 178.44 178.01 2dzr n GLU 67 N -4.82 -0.02 -0.03 1.13 1.02 0.16 0.16 120.64 118.24 2dzr n GLU 67 Ca -0.03 1.02 -0.11 0.00 -0.02 0.00 0.00 57.16 58.02 2dzr n GLU 67 Cb 0.27 -2.09 -0.09 0.00 -0.02 0.00 0.00 31.44 29.51 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 -0.05 -0.42 3.49 3.08 0.52 -2.97 114.38 118.03 2dzr h ARG 68 Ca 0.76 0.00 0.04 0.00 0.07 0.00 0.00 59.98 60.85 2dzr h ARG 68 Cb 2.61 0.01 -0.07 0.00 0.08 0.00 0.00 29.97 32.60 2dzr h ARG 68 CO -0.29 0.59 -0.42 0.82 -1.07 0.00 0.00 179.97 179.60 2dzr h ILE 69 N -0.92 0.00 -0.50 2.04 2.04 0.33 1.60 117.51 122.11 2dzr h ILE 69 Ca -0.01 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.00 2dzr h ILE 69 Cb 0.66 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 36.72 2dzr h ILE 69 CO 0.01 0.00 0.48 -0.07 0.00 0.00 0.00 178.15 178.57 2dzr h LEU 70 N -0.21 0.00 0.30 1.44 3.38 -1.34 0.88 115.31 119.76 2dzr h LEU 70 Ca 0.07 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 2dzr h LEU 70 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 2dzr h LEU 70 CO -0.51 0.00 -0.14 0.00 0.09 0.00 0.00 178.44 177.88 2dzr h ALA 71 N 1.51 -0.40 -0.26 1.53 0.00 0.23 -2.87 119.26 119.00 2dzr h ALA 71 Ca 0.24 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2dzr h ALA 71 Cb 1.19 0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.14 2dzr h ALA 71 CO -0.00 -0.54 0.00 1.33 0.00 0.00 0.00 179.25 180.04 2dzr n VAL 72 N -5.11 0.81 -0.32 0.00 0.24 0.69 -4.28 118.33 110.37 2dzr n VAL 72 Ca -0.09 -0.50 0.35 0.00 -2.04 0.00 0.00 64.34 62.06 2dzr n VAL 72 Cb 0.26 -0.14 0.65 0.00 -1.47 0.00 0.00 33.84 33.14 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 3.14 3.11 -0.02 2.33 0.00 0.91 1.47 119.26 130.19 2dzr h ALA 73 Ca 0.00 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 2dzr h ALA 73 Cb 0.80 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.68 2dzr h ALA 73 CO 0.11 -1.71 -0.05 -0.44 0.00 0.00 0.00 179.25 177.17 2dzr h ASP 74 N 0.00 0.07 0.34 0.00 3.32 -1.83 -3.30 116.42 115.02 2dzr h ASP 74 Ca 0.58 -0.61 -0.02 0.00 0.02 0.00 0.00 57.03 57.00 2dzr h ASP 74 Cb 2.73 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 42.26 2dzr h ASP 74 CO -0.01 0.67 -0.16 0.11 -1.72 0.00 0.00 179.24 178.13 2dzr h LYS 75 N -0.53 -0.43 -5.58 3.56 6.56 0.16 -3.42 116.57 116.90 2dzr h LYS 75 Ca -0.00 0.03 -0.72 0.00 -1.06 0.00 0.00 60.65 58.90 2dzr h LYS 75 Cb 0.66 0.10 -0.04 0.00 -0.57 0.00 0.00 32.23 32.38 2dzr h LYS 75 CO 0.01 -0.26 1.23 -0.89 -2.06 0.00 0.00 179.45 177.47 2dzr n ILE 76 N -5.27 0.00 -4.95 1.86 5.41 0.41 -4.30 119.36 112.51 2dzr n ILE 76 Ca -0.10 0.00 -0.29 0.00 1.00 0.00 0.00 62.75 63.36 2dzr n ILE 76 Cb 0.21 -0.46 -0.17 0.00 -0.71 0.00 0.00 39.64 38.51 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 5.59 2.49 0.10 0.38 2.20 0.50 -4.93 119.74 126.08 2dzr s LYS 77 Ca 1.12 -0.69 -0.01 0.00 -0.36 0.00 0.00 55.97 56.03 2dzr s LYS 77 Cb -1.39 -1.93 -0.04 0.00 -1.51 0.00 0.00 37.83 32.95 2dzr s LYS 77 CO 0.61 0.12 0.27 -0.06 -0.36 0.00 0.00 175.35 175.93 2dzr s PHE 78 N 0.48 3.50 -0.12 4.03 0.40 -1.25 -0.42 117.98 124.60 2dzr s PHE 78 Ca -0.17 0.29 0.03 0.00 -0.60 0.00 0.00 56.93 56.48 2dzr s PHE 78 Cb -0.17 -1.80 0.01 0.00 0.51 0.00 0.00 43.02 41.57 2dzr s PHE 78 CO 0.07 0.53 -0.20 0.99 0.70 0.00 0.00 175.22 177.31 2dzr s THR 79 N -1.60 1.86 -0.28 0.64 2.01 0.22 -4.74 115.64 113.75 2dzr s THR 79 Ca 0.36 -0.87 -0.01 0.00 0.31 0.00 0.00 61.69 61.47 2dzr s THR 79 Cb -0.12 -1.65 0.04 0.00 0.01 0.00 0.00 72.50 70.78 2dzr s THR 79 CO 0.28 0.51 -0.03 -0.69 -0.69 0.00 0.00 174.62 174.00 2dzr s VAL 80 N 0.73 2.89 0.01 3.82 1.01 -1.26 -2.35 120.40 125.25 2dzr s VAL 80 Ca -0.10 -1.25 -0.25 0.00 0.00 0.00 0.00 61.98 60.37 2dzr s VAL 80 Cb -0.16 -2.59 -0.17 0.00 0.00 0.00 0.00 36.38 33.46 2dzr s VAL 80 CO 0.01 0.02 1.28 0.71 0.00 0.00 0.00 175.10 177.12 2dzr h THR 81 N 6.35 0.81 -2.48 3.92 1.35 -1.96 -3.45 112.91 117.44 2dzr h THR 81 Ca -0.26 -0.63 -0.56 0.00 -0.55 0.00 0.00 66.41 64.42 2dzr h THR 81 Cb 1.08 1.15 0.21 0.00 -1.73 0.00 0.00 68.15 68.86 2dzr h THR 81 CO 0.54 0.13 -1.19 -2.11 -0.25 0.00 0.00 175.52 172.64 2dzr n ARG 82 N -5.09 0.02 -2.53 4.72 1.85 -1.26 -4.89 116.66 109.48 2dzr n ARG 82 Ca -0.09 0.02 -0.36 0.00 -1.00 0.00 0.00 57.85 56.42 2dzr n ARG 82 Cb 0.25 -1.31 -0.04 0.00 -1.05 0.00 0.00 32.46 30.30 2dzr n ARG 82 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 2dzr s PRO 83 N -2.21 4.11 0.35 2.89 0.04 -1.26 -5.05 135.00 133.87 2dzr s PRO 83 Ca 0.52 1.51 0.02 0.00 0.04 0.00 0.00 61.00 63.09 2dzr s PRO 83 Cb -0.29 -2.50 -0.01 0.00 0.04 0.00 0.00 34.50 31.75 2dzr s PRO 83 CO 0.72 -0.19 0.41 -0.59 0.04 0.00 0.00 177.00 177.39 2dzr s PHE 84 N -1.68 1.35 0.01 0.56 -0.12 -1.26 -5.17 117.98 111.67 2dzr s PHE 84 Ca 0.59 -1.46 0.01 0.00 -0.05 0.00 0.00 56.93 56.02 2dzr s PHE 84 Cb -0.22 -0.32 -0.01 0.00 -0.63 0.00 0.00 43.02 41.85 2dzr s PHE 84 CO 0.27 -1.06 -0.04 -0.65 -0.05 0.00 0.00 175.22 173.69 2dzr s GLN 85 N -3.11 0.31 -0.29 1.99 -0.21 -1.26 -5.13 119.66 111.95 2dzr s GLN 85 Ca 0.34 -0.28 -0.14 0.00 0.02 0.00 0.00 55.36 55.31 2dzr s GLN 85 Cb 0.00 -0.22 0.13 0.00 1.00 0.00 0.00 33.01 33.93 2dzr s GLN 85 CO 0.24 0.05 0.80 0.20 -2.12 0.00 0.00 175.29 174.46 2dzr s GLY 86 N -0.48 -0.44 -0.12 3.09 0.00 -1.26 -4.48 107.32 103.62 2dzr s GLY 86 Ca -0.03 2.68 -0.03 0.00 0.00 0.00 0.00 44.72 47.35 2dzr s GLY 86 CO -0.00 2.85 -0.02 1.08 0.00 0.00 0.00 173.10 177.00 2dzr s LEU 87 N 2.17 3.37 0.38 0.66 2.01 -1.26 -4.97 118.68 121.05 2dzr s LEU 87 Ca -0.07 -0.02 0.00 0.00 0.01 0.00 0.00 54.13 54.05 2dzr s LEU 87 Cb -0.07 -1.79 0.00 0.00 0.01 0.00 0.00 46.19 44.34 2dzr s LEU 87 CO -0.18 0.26 0.00 -0.38 1.01 0.00 0.00 176.35 177.06 2dzr n ILE 88 N 2.91 -3.71 -1.54 -0.59 2.08 -1.26 -4.96 119.36 112.29 2dzr n ILE 88 Ca -0.18 1.59 -0.29 0.00 0.56 0.00 0.00 62.75 64.43 2dzr n ILE 88 Cb 0.53 -2.24 0.14 0.00 -0.75 0.00 0.00 39.64 37.32 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 -4.52 1.06 -0.40 0.38 0.04 -1.26 -5.05 135.00 125.26 2dzr s PRO 89 Ca 0.00 0.26 0.08 0.00 0.04 0.00 0.00 61.00 61.38 2dzr s PRO 89 Cb 0.00 -1.83 0.26 0.00 0.04 0.00 0.00 34.50 32.96 2dzr s PRO 89 CO 0.00 -2.24 0.59 1.17 0.04 0.00 0.00 177.00 176.56 2dzr n LYS 90 N -3.79 0.74 -2.47 4.56 4.81 -1.26 -5.11 118.16 115.63 2dzr n LYS 90 Ca 0.07 -3.02 -0.42 0.00 -0.87 0.00 0.00 58.31 54.07 2dzr n LYS 90 Cb 0.59 -1.28 -0.03 0.00 0.02 0.00 0.00 35.03 34.33 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 -1.01 4.50 0.29 1.64 0.04 -1.26 -5.04 135.00 134.16 2dzr s PRO 91 Ca 0.35 1.73 0.06 0.00 0.04 0.00 0.00 61.00 63.18 2dzr s PRO 91 Cb 0.19 -3.32 -0.02 0.00 0.04 0.00 0.00 34.50 31.39 2dzr s PRO 91 CO -0.13 -0.11 0.42 0.34 0.04 0.00 0.00 177.00 177.56 2dzr s ASP 92 N 0.55 6.15 0.21 6.66 -1.08 -1.26 -5.04 116.67 122.87 2dzr s ASP 92 Ca 0.54 -0.04 0.00 0.00 -0.52 0.00 0.00 52.55 52.53 2dzr s ASP 92 Cb -0.29 -1.57 0.00 0.00 -1.46 0.00 0.00 42.92 39.60 2dzr s ASP 92 CO 0.32 -0.25 0.00 1.21 0.52 0.00 0.00 175.17 176.97 2dzr n GLU 93 N -1.53 0.00 -3.64 4.34 2.13 -1.26 -5.15 120.64 115.53 2dzr n GLU 93 Ca -0.05 0.00 -0.03 0.00 0.66 0.00 0.00 57.16 57.74 2dzr n GLU 93 Cb 0.57 -0.09 -0.06 0.00 0.27 0.00 0.00 31.44 32.14 2dzr n GLU 93 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 2dzr s SER 94 N -5.03 -0.09 0.00 4.31 0.15 -1.26 -5.18 113.70 106.60 2dzr s SER 94 Ca 0.00 0.14 0.00 0.00 0.70 0.00 0.00 55.95 56.79 2dzr s SER 94 Cb 0.00 0.13 0.00 0.00 -1.71 0.00 0.00 66.02 64.44 2dzr s SER 94 CO 0.00 -0.05 0.00 0.61 1.20 0.00 0.00 173.24 175.00 2dzr n GLY 95 N 1.18 0.87 3.61 9.45 0.00 -1.26 -4.95 105.19 114.08 2dzr n GLY 95 Ca -0.07 -1.60 -0.43 0.00 0.00 0.00 0.00 46.02 43.93 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 0.77 3.63 0.10 1.61 0.04 -1.26 -4.94 135.00 134.96 2dzr s PRO 96 Ca 0.00 1.00 -0.26 0.00 0.04 0.00 0.00 61.00 61.78 2dzr s PRO 96 Cb 0.00 -4.00 0.08 0.00 0.04 0.00 0.00 34.50 30.61 2dzr s PRO 96 CO 0.00 -1.49 0.94 -1.54 0.04 0.00 0.00 177.00 174.95 2dzr s SER 97 N 3.77 -0.23 -0.01 6.66 1.04 -1.26 -5.11 113.70 118.56 2dzr s SER 97 Ca 0.61 -0.28 -0.02 0.00 0.48 0.00 0.00 55.95 56.74 2dzr s SER 97 Cb -0.14 0.45 0.01 0.00 0.10 0.00 0.00 66.02 66.44 2dzr s SER 97 CO 0.31 -0.81 0.03 -1.20 0.98 0.00 0.00 173.24 172.55 2dzr n SER 98 N -0.40 -7.60 0.00 7.02 7.64 -1.26 -5.21 113.62 113.81 2dzr n SER 98 Ca -0.07 1.61 0.00 0.00 1.01 0.00 0.00 58.87 61.42 2dzr n SER 98 Cb 0.61 -4.79 0.00 0.00 -1.01 0.00 0.00 64.21 59.02 2dzr n SER 98 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64