#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ucv s SER 2 N 0.00 5.62 -0.82 1.61 1.04 -1.26 -4.57 113.70 115.31 1ucv s SER 2 Ca 0.00 -0.39 -0.05 0.00 0.48 0.00 0.00 55.95 56.00 1ucv s SER 2 Cb 0.00 -0.95 0.01 0.00 0.10 0.00 0.00 66.02 65.18 1ucv s SER 2 CO 0.00 -0.52 0.72 -1.20 0.98 0.00 0.00 173.24 173.21 1ucv n SER 3 N -1.62 -4.22 0.00 7.02 7.64 -1.26 -4.85 113.62 116.33 1ucv n SER 3 Ca 0.02 -0.34 0.00 0.00 1.01 0.00 0.00 58.87 59.56 1ucv n SER 3 Cb 0.59 -3.33 0.00 0.00 -1.01 0.00 0.00 64.21 60.47 1ucv n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ucv n GLY 4 N -1.37 -0.42 3.86 0.23 0.00 -1.26 -5.15 105.19 101.08 1ucv n GLY 4 Ca -0.03 0.61 -0.33 0.00 0.00 0.00 0.00 46.02 46.27 1ucv n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ucv s SER 5 N 2.00 6.70 0.25 1.61 1.04 -1.26 -5.10 113.70 118.95 1ucv s SER 5 Ca 0.00 0.98 0.09 0.00 0.48 0.00 0.00 55.95 57.51 1ucv s SER 5 Cb 0.00 -2.25 -0.04 0.00 0.10 0.00 0.00 66.02 63.83 1ucv s SER 5 CO 0.00 -0.01 0.01 -0.94 0.98 0.00 0.00 173.24 173.29 1ucv s SER 6 N -2.10 4.65 0.00 7.02 1.04 -1.26 -4.65 113.70 118.40 1ucv s SER 6 Ca 0.44 -0.58 0.00 0.00 0.48 0.00 0.00 55.95 56.28 1ucv s SER 6 Cb -0.13 -0.91 0.00 0.00 0.10 0.00 0.00 66.02 65.08 1ucv s SER 6 CO 0.20 0.01 0.00 0.61 0.98 0.00 0.00 173.24 175.04 1ucv n GLY 7 N -0.83 0.14 3.08 7.32 0.00 -1.26 -5.13 105.19 108.52 1ucv n GLY 7 Ca -0.07 -0.60 -0.27 0.00 0.00 0.00 0.00 46.02 45.07 1ucv n GLY 7 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1ucv n LEU 8 N 0.00 0.00 -4.78 0.99 -0.00 -1.26 -5.05 117.00 106.90 1ucv n LEU 8 Ca 0.00 -2.69 -0.31 0.00 -0.00 0.00 0.00 56.01 53.01 1ucv n LEU 8 Cb 0.00 0.29 -0.07 0.00 -0.00 0.00 0.00 43.42 43.65 1ucv n LEU 8 CO 0.00 -0.39 -0.26 0.28 -0.00 0.00 0.00 177.39 177.03 1ucv s THR 9 N -2.54 4.60 0.62 1.47 -1.32 -1.26 -4.18 115.64 113.03 1ucv s THR 9 Ca 0.01 -0.66 0.20 0.00 -1.21 0.00 0.00 61.69 60.03 1ucv s THR 9 Cb -0.00 -3.19 0.29 0.00 -1.51 0.00 0.00 72.50 68.10 1ucv s THR 9 CO 0.00 0.19 1.27 0.58 -2.21 0.00 0.00 174.62 174.45 1ucv h VAL 10 N 2.73 0.02 0.03 5.08 2.07 -1.83 0.66 116.25 125.01 1ucv h VAL 10 Ca -0.47 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 66.98 1ucv h VAL 10 Cb 1.17 0.05 0.01 0.00 -1.52 0.00 0.00 31.29 30.99 1ucv h VAL 10 CO 0.65 0.00 -0.29 1.23 0.02 0.00 0.00 177.57 179.18 1ucv h GLY 11 N 0.00 0.16 0.28 2.17 0.00 -1.90 -2.81 103.07 100.97 1ucv h GLY 11 Ca 0.35 -0.34 0.02 0.00 0.00 0.00 0.00 47.33 47.36 1ucv h GLY 11 CO -0.00 0.30 -0.42 -0.55 0.00 0.00 0.00 176.54 175.86 1ucv h ASP 12 N -0.65 -1.24 0.59 0.19 3.32 -0.04 0.37 116.42 118.96 1ucv h ASP 12 Ca -0.05 0.14 -0.02 0.00 0.02 0.00 0.00 57.03 57.12 1ucv h ASP 12 Cb 1.15 0.46 -0.01 0.00 0.22 0.00 0.00 39.33 41.15 1ucv h ASP 12 CO 0.06 -0.49 -0.41 -0.25 -1.72 0.00 0.00 179.24 176.43 1ucv h TRP 13 N -0.66 -1.09 -0.73 4.55 7.01 -1.67 -2.60 115.95 120.75 1ucv h TRP 13 Ca 0.02 -0.01 0.16 0.00 2.11 0.00 0.00 58.89 61.18 1ucv h TRP 13 Cb 0.68 0.40 -0.13 0.00 -2.10 0.00 0.00 29.16 28.02 1ucv h TRP 13 CO -0.36 -0.59 0.02 -0.07 -2.79 0.00 0.00 178.44 174.65 1ucv h LEU 14 N -0.94 -0.30 -0.87 0.65 3.38 -1.41 0.19 115.31 116.01 1ucv h LEU 14 Ca -0.08 0.18 0.19 0.00 0.09 0.00 0.00 57.88 58.27 1ucv h LEU 14 Cb 0.77 0.32 -0.11 0.00 0.09 0.00 0.00 40.66 41.73 1ucv h LEU 14 CO 0.05 -0.16 0.39 -0.78 0.09 0.00 0.00 178.44 178.04 1ucv h ASP 15 N 0.12 0.38 -0.87 -0.43 1.82 -0.03 0.29 116.42 117.71 1ucv h ASP 15 Ca 0.40 0.13 0.16 0.00 -0.39 0.00 0.00 57.03 57.33 1ucv h ASP 15 Cb 0.70 0.09 -0.10 0.00 0.68 0.00 0.00 39.33 40.70 1ucv h ASP 15 CO -0.63 0.07 0.45 -1.28 -1.61 0.00 0.00 179.24 176.24 1ucv h SER 16 N 0.47 0.53 -0.50 2.28 0.87 -0.23 0.40 113.55 117.37 1ucv h SER 16 Ca 0.52 0.10 0.00 0.00 -1.23 0.00 0.00 61.79 61.18 1ucv h SER 16 Cb 0.90 0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.88 1ucv h SER 16 CO -0.47 0.20 0.00 2.30 -0.53 0.00 0.00 176.83 178.33 1ucv n ILE 17 N -4.88 1.25 -3.05 2.23 -5.35 0.26 -4.90 119.36 104.91 1ucv n ILE 17 Ca 0.18 -0.85 -0.20 0.00 -0.27 0.00 0.00 62.75 61.61 1ucv n ILE 17 Cb 0.47 0.09 0.04 0.00 -1.74 0.00 0.00 39.64 38.51 1ucv n ILE 17 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 1ucv n ARG 18 N 0.86 -4.94 0.00 6.28 5.12 0.14 -4.88 116.66 119.25 1ucv n ARG 18 Ca 0.19 0.79 0.00 0.00 -1.93 0.00 0.00 57.85 56.91 1ucv n ARG 18 Cb 0.65 -5.46 0.00 0.00 -1.16 0.00 0.00 32.46 26.49 1ucv n ARG 18 CO 0.00 0.00 0.00 -1.33 -1.93 0.00 0.00 177.63 174.37 1ucv n MET 19 N -3.83 2.04 -0.04 5.56 2.81 0.78 -4.69 117.12 119.75 1ucv n MET 19 Ca -0.08 -0.32 0.24 0.00 -1.81 0.00 0.00 57.70 55.74 1ucv n MET 19 Cb 0.60 -0.81 0.67 0.00 -0.71 0.00 0.00 33.22 32.96 1ucv n MET 19 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 1ucv h GLY 20 N 0.04 0.00 1.22 3.03 0.00 -1.74 0.27 103.07 105.88 1ucv h GLY 20 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 47.33 47.44 1ucv h GLY 20 CO 0.00 0.00 0.28 0.07 0.00 0.00 0.00 176.54 176.89 1ucv h ARG 21 N 0.00 0.02 0.00 4.80 0.11 -1.90 0.35 114.38 117.76 1ucv h ARG 21 Ca 0.32 -0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.40 1ucv h ARG 21 Cb 1.71 -0.01 0.00 0.00 1.11 0.00 0.00 29.97 32.78 1ucv h ARG 21 CO -0.00 0.02 -0.30 0.66 0.10 0.00 0.00 179.97 180.44 1ucv n TYR 22 N -4.43 0.26 -0.39 4.08 4.01 0.94 -4.26 117.16 117.36 1ucv n TYR 22 Ca 0.06 0.07 -0.10 0.00 -0.16 0.00 0.00 57.90 57.78 1ucv n TYR 22 Cb 0.46 -0.52 -0.08 0.00 -0.31 0.00 0.00 39.34 38.89 1ucv n TYR 22 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 1ucv n ARG 23 N -1.74 -0.40 -0.44 -0.72 0.63 0.12 0.14 116.66 114.25 1ucv n ARG 23 Ca 0.05 1.43 0.38 0.00 -0.92 0.00 0.00 57.85 58.80 1ucv n ARG 23 Cb 0.37 -2.10 0.66 0.00 0.45 0.00 0.00 32.46 31.84 1ucv n ARG 23 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 1ucv h ASP 24 N 0.00 0.23 0.92 6.15 3.32 -1.75 0.17 116.42 125.46 1ucv h ASP 24 Ca 0.17 0.18 -0.04 0.00 0.02 0.00 0.00 57.03 57.35 1ucv h ASP 24 Cb 0.40 0.18 0.01 0.00 0.22 0.00 0.00 39.33 40.15 1ucv h ASP 24 CO -0.89 -0.30 -0.44 0.45 -1.72 0.00 0.00 179.24 176.34 1ucv h HIS 25 N 0.01 -1.14 -0.86 4.55 3.86 0.87 -3.00 115.15 119.44 1ucv h HIS 25 Ca 0.87 -0.03 0.22 0.00 -1.16 0.00 0.00 60.37 60.28 1ucv h HIS 25 Cb 2.68 0.38 -0.14 0.00 1.06 0.00 0.00 27.41 31.39 1ucv h HIS 25 CO -0.01 -0.71 0.19 0.74 0.86 0.00 0.00 177.93 179.00 1ucv h PHE 26 N -1.33 0.27 -0.66 2.45 -1.00 -0.55 0.82 116.94 116.95 1ucv h PHE 26 Ca -0.13 0.05 0.16 0.00 2.81 0.00 0.00 57.97 60.87 1ucv h PHE 26 Cb 0.94 0.02 -0.03 0.00 3.61 0.00 0.00 35.95 40.49 1ucv h PHE 26 CO 0.00 -0.21 0.46 0.00 -1.61 0.00 0.00 178.31 176.94 1ucv h ALA 27 N 1.77 2.40 0.07 2.45 0.00 -0.71 0.19 119.26 125.44 1ucv h ALA 27 Ca 0.52 -0.01 -0.25 0.00 0.00 0.00 0.00 54.91 55.17 1ucv h ALA 27 Cb 1.03 0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.85 1ucv h ALA 27 CO -0.66 -0.58 -1.03 0.00 0.00 0.00 0.00 179.25 176.98 1ucv h ALA 28 N 1.68 0.02 0.00 0.00 0.00 0.78 -3.17 119.26 118.57 1ucv h ALA 28 Ca 0.32 -0.71 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1ucv h ALA 28 Cb 1.04 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1ucv h ALA 28 CO -0.05 0.58 0.00 0.41 0.00 0.00 0.00 179.25 180.20 1ucv n GLY 29 N 1.29 -0.46 0.49 0.00 0.00 -0.37 -4.77 105.19 101.37 1ucv n GLY 29 Ca -0.13 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.81 1ucv n GLY 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ucv n GLY 30 N -0.08 0.86 3.09 -0.02 0.00 -0.98 -5.07 105.19 102.99 1ucv n GLY 30 Ca 0.10 -0.21 -0.33 0.00 0.00 0.00 0.00 46.02 45.59 1ucv n GLY 30 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ucv s TYR 31 N -2.00 3.22 0.00 1.61 2.02 0.54 -4.92 117.35 117.82 1ucv s TYR 31 Ca 0.00 -2.18 0.00 0.00 -0.37 0.00 0.00 57.07 54.52 1ucv s TYR 31 Cb 0.00 -1.96 0.00 0.00 -0.40 0.00 0.00 41.96 39.60 1ucv s TYR 31 CO 0.00 -0.86 0.01 -1.13 -1.57 0.00 0.00 175.55 172.00 1ucv n SER 32 N 4.48 0.01 -4.53 2.29 3.41 -1.26 -1.31 113.62 116.71 1ucv n SER 32 Ca -0.15 -0.51 -0.26 0.00 -0.26 0.00 0.00 58.87 57.70 1ucv n SER 32 Cb 0.43 0.98 -0.10 0.00 -0.26 0.00 0.00 64.21 65.26 1ucv n SER 32 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1ucv s SER 33 N -0.98 3.22 -0.02 4.04 1.04 -1.26 -3.67 113.70 116.06 1ucv s SER 33 Ca 0.00 -1.42 -0.17 0.00 0.48 0.00 0.00 55.95 54.84 1ucv s SER 33 Cb 0.00 -0.13 -0.33 0.00 0.10 0.00 0.00 66.02 65.66 1ucv s SER 33 CO 0.00 -0.58 0.86 -0.07 0.98 0.00 0.00 173.24 174.42 1ucv h LEU 34 N 1.87 0.63 -0.79 2.42 -0.00 -1.92 -3.13 115.31 114.40 1ucv h LEU 34 Ca -0.42 -0.92 0.19 0.00 -0.00 0.00 0.00 57.88 56.72 1ucv h LEU 34 Cb 1.25 -0.21 -0.13 0.00 -0.00 0.00 0.00 40.66 41.58 1ucv h LEU 34 CO 0.74 1.61 0.13 1.23 -0.00 0.00 0.00 178.44 182.16 1ucv h GLY 35 N 0.04 1.07 2.00 0.83 0.00 -1.97 0.58 103.07 105.62 1ucv h GLY 35 Ca -0.24 0.02 -0.05 0.00 0.00 0.00 0.00 47.33 47.06 1ucv h GLY 35 CO 0.19 -0.29 -0.25 0.00 0.00 0.00 0.00 176.54 176.19 1ucv h MET 36 N 0.19 0.00 0.02 4.80 -0.00 -2.00 -3.21 114.93 114.73 1ucv h MET 36 Ca 0.46 0.00 -0.22 0.00 -0.00 0.00 0.00 59.70 59.94 1ucv h MET 36 Cb 0.85 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 32.45 1ucv h MET 36 CO -0.62 0.25 -0.96 0.28 -0.00 0.00 0.00 176.91 175.87 1ucv h VAL 37 N 0.00 1.47 0.00 -0.10 2.07 -0.03 -3.13 116.25 116.53 1ucv h VAL 37 Ca -0.00 -2.65 -0.01 0.00 0.82 0.00 0.00 66.70 64.86 1ucv h VAL 37 Cb 1.07 2.53 -0.00 0.00 -1.52 0.00 0.00 31.29 33.37 1ucv h VAL 37 CO 0.03 0.78 -0.06 -0.07 0.02 0.00 0.00 177.57 178.27 1ucv h LEU 38 N 0.14 0.00 0.00 2.57 4.07 -0.29 -0.67 115.31 121.14 1ucv h LEU 38 Ca -0.07 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.89 1ucv h LEU 38 Cb 1.61 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.35 1ucv h LEU 38 CO 0.15 0.06 -0.66 0.03 -1.08 0.00 0.00 178.44 176.95 1ucv h ARG 39 N 0.00 0.00 -7.13 1.13 2.47 -1.65 -3.46 114.38 105.75 1ucv h ARG 39 Ca -0.00 0.00 -0.39 0.00 -1.26 0.00 0.00 59.98 58.33 1ucv h ARG 39 Cb 0.15 0.00 0.21 0.00 -1.65 0.00 0.00 29.97 28.68 1ucv h ARG 39 CO 0.01 0.00 -0.05 -1.64 0.56 0.00 0.00 179.97 178.85 1ucv s MET 40 N -3.21 -2.40 0.17 0.04 -1.94 -0.26 -5.08 119.30 106.63 1ucv s MET 40 Ca 0.05 0.14 -0.24 0.00 -1.71 0.00 0.00 55.69 53.92 1ucv s MET 40 Cb 0.12 -1.44 0.06 0.00 2.01 0.00 0.00 34.83 35.58 1ucv s MET 40 CO 0.73 -4.53 0.86 -0.80 -0.01 0.00 0.00 175.02 171.27 1ucv s ASN 41 N -3.28 -0.25 0.29 3.03 0.01 -1.26 -4.99 114.94 108.48 1ucv s ASN 41 Ca 0.69 -0.38 0.04 0.00 -0.71 0.00 0.00 52.86 52.50 1ucv s ASN 41 Cb -0.13 0.55 0.75 0.00 0.41 0.00 0.00 41.25 42.83 1ucv s ASN 41 CO 0.58 -1.00 1.42 0.00 -1.51 0.00 0.00 177.10 176.59 1ucv n ALA 42 N -0.43 0.52 -0.25 0.60 0.00 -1.26 0.16 120.51 119.83 1ucv n ALA 42 Ca -0.07 0.97 0.02 0.00 0.00 0.00 0.00 53.44 54.36 1ucv n ALA 42 Cb 0.61 -0.73 0.15 0.00 0.00 0.00 0.00 19.45 19.47 1ucv n ALA 42 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1ucv h GLN 43 N 0.00 0.58 0.03 0.00 1.08 -1.99 0.26 115.11 115.07 1ucv h GLN 43 Ca 0.57 -0.04 -0.00 0.00 -1.45 0.00 0.00 58.65 57.74 1ucv h GLN 43 Cb 1.23 -0.13 0.00 0.00 -0.05 0.00 0.00 27.48 28.53 1ucv h GLN 43 CO -0.84 0.39 -0.01 -0.44 -0.95 0.00 0.00 178.83 176.98 1ucv h ASP 44 N 0.60 -0.03 -0.33 1.46 3.32 0.11 -3.30 116.42 118.25 1ucv h ASP 44 Ca 0.37 -0.65 0.07 0.00 0.02 0.00 0.00 57.03 56.84 1ucv h ASP 44 Cb 0.42 0.01 -0.08 0.00 0.22 0.00 0.00 39.33 39.89 1ucv h ASP 44 CO -0.29 0.75 -0.24 0.58 -1.72 0.00 0.00 179.24 178.32 1ucv h VAL 45 N -0.94 0.36 -0.86 -1.35 2.07 -0.30 -1.05 116.25 114.19 1ucv h VAL 45 Ca -0.00 0.00 0.22 0.00 0.82 0.00 0.00 66.70 67.74 1ucv h VAL 45 Cb 0.68 0.36 -0.15 0.00 -1.52 0.00 0.00 31.29 30.66 1ucv h VAL 45 CO 0.01 0.00 0.12 -0.09 0.02 0.00 0.00 177.57 177.62 1ucv h ARG 46 N -0.21 0.13 -0.86 1.57 1.12 -0.62 0.69 114.38 116.20 1ucv h ARG 46 Ca 0.17 -0.01 0.14 0.00 -1.11 0.00 0.00 59.98 59.17 1ucv h ARG 46 Cb 0.47 -0.03 -0.07 0.00 -0.01 0.00 0.00 29.97 30.33 1ucv h ARG 46 CO -0.45 0.08 0.56 0.00 -3.11 0.00 0.00 179.97 177.05 1ucv h ALA 47 N 1.80 1.88 -0.11 2.80 0.00 -1.26 0.14 119.26 124.51 1ucv h ALA 47 Ca 0.52 0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.47 1ucv h ALA 47 Cb 1.01 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 1ucv h ALA 47 CO -0.71 -0.11 0.10 -0.07 0.00 0.00 0.00 179.25 178.45 1ucv h LEU 48 N 0.64 0.00 0.00 0.00 3.38 0.51 -3.46 115.31 116.38 1ucv h LEU 48 Ca 0.43 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.40 1ucv h LEU 48 Cb 0.73 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.48 1ucv h LEU 48 CO -0.18 0.00 0.00 0.61 0.09 0.00 0.00 178.44 178.96 1ucv n GLY 49 N -1.48 1.28 3.55 0.83 0.00 0.50 -4.88 105.19 105.00 1ucv n GLY 49 Ca -0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1ucv n GLY 49 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ucv s ILE 50 N -1.23 3.41 -0.02 -0.61 1.09 -1.26 -4.69 121.20 117.90 1ucv s ILE 50 Ca 0.00 0.26 0.03 0.00 -1.10 0.00 0.00 60.65 59.83 1ucv s ILE 50 Cb 0.00 -4.02 -0.04 0.00 -1.06 0.00 0.00 42.46 37.34 1ucv s ILE 50 CO 0.00 -0.96 0.03 0.35 -0.10 0.00 0.00 174.94 174.26 1ucv n THR 51 N 7.15 0.12 -1.51 2.92 -2.24 -1.26 -4.21 114.28 115.24 1ucv n THR 51 Ca 0.19 -0.10 -0.51 0.00 -2.27 0.00 0.00 64.05 61.36 1ucv n THR 51 Cb 0.51 -0.42 -0.07 0.00 -2.10 0.00 0.00 70.33 68.26 1ucv n THR 51 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1ucv n LEU 52 N -1.92 2.36 -0.32 3.22 4.77 -1.26 -4.63 117.00 119.22 1ucv n LEU 52 Ca -0.03 0.57 0.09 0.00 -0.03 0.00 0.00 56.01 56.61 1ucv n LEU 52 Cb 0.40 -1.26 0.20 0.00 -2.33 0.00 0.00 43.42 40.43 1ucv n LEU 52 CO 0.06 -0.60 0.76 0.24 -1.33 0.00 0.00 177.39 176.52 1ucv h MET 53 N 11.33 0.03 -0.96 3.23 2.86 -1.97 1.01 114.93 130.46 1ucv h MET 53 Ca -0.33 -0.00 0.23 0.00 -2.06 0.00 0.00 59.70 57.54 1ucv h MET 53 Cb 1.31 -0.01 -0.07 0.00 0.06 0.00 0.00 31.60 32.89 1ucv h MET 53 CO 1.00 0.02 0.64 0.78 1.06 0.00 0.00 176.91 180.41 1ucv h GLY 54 N 0.03 0.88 0.00 8.32 0.00 -2.01 -1.23 103.07 109.07 1ucv h GLY 54 Ca 0.51 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.66 1ucv h GLY 54 CO -0.88 -0.04 -0.64 1.42 0.00 0.00 0.00 176.54 176.39 1ucv n HIS 55 N -4.52 0.43 -0.30 5.60 8.25 0.30 -4.08 115.22 120.91 1ucv n HIS 55 Ca 0.21 0.19 0.29 0.00 -0.26 0.00 0.00 57.72 58.15 1ucv n HIS 55 Cb 0.80 -0.58 0.52 0.00 1.12 0.00 0.00 29.99 31.84 1ucv n HIS 55 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1ucv n GLN 56 N -4.26 -0.05 -0.02 -0.41 6.02 0.16 0.16 117.38 118.98 1ucv n GLN 56 Ca -0.09 1.16 -0.11 0.00 -0.01 0.00 0.00 57.00 57.95 1ucv n GLN 56 Cb 0.34 -2.12 -0.06 0.00 1.02 0.00 0.00 30.24 29.42 1ucv n GLN 56 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.06 176.92 1ucv h LYS 57 N 0.00 0.17 0.33 -1.09 1.57 -1.42 -1.74 116.57 114.40 1ucv h LYS 57 Ca 0.73 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 59.47 1ucv h LYS 57 Cb 2.01 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 34.28 1ucv h LYS 57 CO -0.62 0.26 -0.24 0.87 -0.57 0.00 0.00 179.45 179.15 1ucv h LYS 58 N 0.04 -0.53 -0.06 3.15 6.56 0.14 0.88 116.57 126.76 1ucv h LYS 58 Ca 0.04 0.04 0.01 0.00 -1.06 0.00 0.00 60.65 59.67 1ucv h LYS 58 Cb 0.15 0.12 -0.01 0.00 -0.57 0.00 0.00 32.23 31.92 1ucv h LYS 58 CO -0.00 -0.35 -0.10 0.82 -2.06 0.00 0.00 179.45 177.75 1ucv h ILE 59 N -0.55 0.00 0.15 1.86 2.04 -1.48 0.61 117.51 120.14 1ucv h ILE 59 Ca -0.04 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.83 1ucv h ILE 59 Cb 0.45 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 36.49 1ucv h ILE 59 CO 0.02 0.00 -0.46 -0.07 0.00 0.00 0.00 178.15 177.65 1ucv h LEU 60 N -0.09 -1.35 -1.89 1.44 -0.00 -1.37 -0.28 115.31 111.78 1ucv h LEU 60 Ca 0.01 0.14 0.28 0.00 -0.00 0.00 0.00 57.88 58.31 1ucv h LEU 60 Cb 0.12 0.50 -0.05 0.00 -0.00 0.00 0.00 40.66 41.23 1ucv h LEU 60 CO -0.10 -0.53 0.69 1.23 -0.00 0.00 0.00 178.44 179.74 1ucv h GLY 61 N -0.71 0.20 1.82 0.83 0.00 0.10 0.40 103.07 105.71 1ucv h GLY 61 Ca 0.01 -0.04 -0.21 0.00 0.00 0.00 0.00 47.33 47.09 1ucv h GLY 61 CO -0.24 -0.01 -0.95 1.76 0.00 0.00 0.00 176.54 177.10 1ucv h SER 62 N 0.08 0.21 0.14 0.19 0.02 0.17 -3.30 113.55 111.07 1ucv h SER 62 Ca 0.48 -0.19 -0.01 0.00 -0.84 0.00 0.00 61.79 61.23 1ucv h SER 62 Cb 1.78 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 64.25 1ucv h SER 62 CO -0.05 1.04 -0.07 0.40 -1.14 0.00 0.00 176.83 177.01 1ucv h ILE 63 N 0.07 0.85 -1.53 3.27 2.04 0.13 -1.74 117.51 120.61 1ucv h ILE 63 Ca -0.05 -1.20 0.47 0.00 1.00 0.00 0.00 64.86 65.09 1ucv h ILE 63 Cb 1.61 1.46 -0.10 0.00 -0.74 0.00 0.00 36.82 39.05 1ucv h ILE 63 CO 0.14 0.23 1.05 0.06 0.00 0.00 0.00 178.15 179.63 1ucv h GLN 64 N -0.88 0.05 0.11 2.37 3.07 -1.20 0.84 115.11 119.46 1ucv h GLN 64 Ca -0.02 -0.00 -0.33 0.00 0.09 0.00 0.00 58.65 58.39 1ucv h GLN 64 Cb 0.53 -0.01 -0.02 0.00 0.08 0.00 0.00 27.48 28.06 1ucv h GLN 64 CO 0.03 0.03 -1.75 0.00 0.09 0.00 0.00 178.83 177.23 1ucv h THR 65 N 0.05 0.89 -0.69 1.86 1.03 -1.63 -2.94 112.91 111.48 1ucv h THR 65 Ca 0.83 -2.59 0.01 0.00 -0.01 0.00 0.00 66.41 64.66 1ucv h THR 65 Cb 2.95 2.61 -0.04 0.00 -1.07 0.00 0.00 68.15 72.60 1ucv h THR 65 CO -0.23 0.79 0.46 0.24 -0.01 0.00 0.00 175.52 176.77 1ucv h MET 66 N 0.06 0.89 0.05 0.00 2.86 0.16 -2.37 114.93 116.57 1ucv h MET 66 Ca -0.33 -0.05 -0.26 0.00 -2.06 0.00 0.00 59.70 57.00 1ucv h MET 66 Cb 2.03 -0.20 -0.02 0.00 0.06 0.00 0.00 31.60 33.47 1ucv h MET 66 CO 0.12 0.59 -1.31 0.07 1.06 0.00 0.00 176.91 177.44 1ucv h ARG 67 N 0.91 0.11 -1.01 1.72 0.11 -1.14 -3.32 114.38 111.76 1ucv h ARG 67 Ca 0.26 -0.19 0.25 0.00 0.10 0.00 0.00 59.98 60.40 1ucv h ARG 67 Cb -0.07 0.07 -0.12 0.00 1.11 0.00 0.00 29.97 30.96 1ucv h ARG 67 CO -0.06 0.98 0.60 0.00 0.10 0.00 0.00 179.97 181.59 1ucv h ALA 68 N 0.79 1.84 -1.02 0.08 0.00 -1.23 0.24 119.26 119.96 1ucv h ALA 68 Ca -0.14 0.13 0.25 0.00 0.00 0.00 0.00 54.91 55.15 1ucv h ALA 68 Cb 1.91 0.03 -0.10 0.00 0.00 0.00 0.00 17.79 19.63 1ucv h ALA 68 CO 0.14 -0.32 0.64 -0.56 0.00 0.00 0.00 179.25 179.15 1ucv h GLN 69 N 0.55 0.47 0.11 0.00 3.07 -1.65 0.27 115.11 117.93 1ucv h GLN 69 Ca 0.65 -0.03 0.02 0.00 0.09 0.00 0.00 58.65 59.38 1ucv h GLN 69 Cb 1.29 -0.11 -0.03 0.00 0.08 0.00 0.00 27.48 28.71 1ucv h GLN 69 CO -0.48 0.31 -0.23 -0.07 0.09 0.00 0.00 178.83 178.46 1ucv h LEU 70 N 0.48 -0.64 -0.57 0.06 3.38 -0.75 -2.67 115.31 114.60 1ucv h LEU 70 Ca 0.60 0.08 -0.16 0.00 0.09 0.00 0.00 57.88 58.49 1ucv h LEU 70 Cb 1.35 0.24 -0.01 0.00 0.09 0.00 0.00 40.66 42.34 1ucv h LEU 70 CO -0.34 -0.31 -0.61 0.71 0.09 0.00 0.00 178.44 177.97 1ucv h THR 71 N -0.42 1.37 -1.68 0.22 1.35 -1.24 -3.49 112.91 109.02 1ucv h THR 71 Ca 0.03 -1.96 0.00 0.00 -0.55 0.00 0.00 66.41 63.93 1ucv h THR 71 Cb 0.44 1.96 -0.00 0.00 -1.73 0.00 0.00 68.15 68.83 1ucv h THR 71 CO -0.13 0.59 -0.00 -1.20 -0.25 0.00 0.00 175.52 174.53 1ucv n SER 72 N -3.89 -5.04 -4.07 5.36 7.64 0.80 -4.88 113.62 109.55 1ucv n SER 72 Ca -0.03 0.00 -0.33 0.00 1.01 0.00 0.00 58.87 59.52 1ucv n SER 72 Cb 0.63 -0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 63.82 1ucv n SER 72 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1ucv n THR 73 N -1.68 -1.57 -0.07 0.44 -1.04 -1.26 -4.89 114.28 104.21 1ucv n THR 73 Ca 0.00 -0.02 -0.05 0.00 -2.04 0.00 0.00 64.05 61.95 1ucv n THR 73 Cb 0.00 -2.28 -0.02 0.00 -1.82 0.00 0.00 70.33 66.22 1ucv n THR 73 CO 0.00 0.00 0.00 1.67 -0.64 0.00 0.00 175.07 176.10 1ucv n GLN 74 N -4.53 0.43 -0.71 -2.82 0.00 -1.26 -5.01 117.38 103.47 1ucv n GLN 74 Ca 0.05 0.48 -0.04 0.00 -0.00 0.00 0.00 57.00 57.49 1ucv n GLN 74 Cb 0.51 -1.60 0.02 0.00 0.00 0.00 0.00 30.24 29.17 1ucv n GLN 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1ucv n GLY 75 N 1.61 0.15 3.20 1.69 0.00 -1.26 -5.06 105.19 105.52 1ucv n GLY 75 Ca -0.07 -1.88 -0.30 0.00 0.00 0.00 0.00 46.02 43.77 1ucv n GLY 75 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ucv n SER 76 N -3.03 -2.58 -4.45 1.61 7.64 -1.26 -4.61 113.62 106.95 1ucv n SER 76 Ca 0.02 -0.19 -0.47 0.00 1.01 0.00 0.00 58.87 59.24 1ucv n SER 76 Cb 0.09 -0.88 -0.09 0.00 -1.01 0.00 0.00 64.21 62.31 1ucv n SER 76 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ucv n GLY 77 N 2.23 0.04 0.15 0.23 0.00 -1.26 -4.73 105.19 101.85 1ucv n GLY 77 Ca 0.02 0.98 0.06 0.00 0.00 0.00 0.00 46.02 47.08 1ucv n GLY 77 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1ucv n PRO 78 N 8.31 0.08 -3.73 1.61 -0.02 -1.26 -4.40 135.00 135.60 1ucv n PRO 78 Ca 0.50 0.54 -0.12 0.00 -2.02 0.00 0.00 63.50 62.40 1ucv n PRO 78 Cb 0.18 -2.05 -0.11 0.00 -0.02 0.00 0.00 33.50 31.51 1ucv n PRO 78 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1ucv s SER 79 N -3.34 -0.44 0.10 2.55 0.15 -1.26 -5.16 113.70 106.31 1ucv s SER 79 Ca -0.01 0.81 -0.14 0.00 0.70 0.00 0.00 55.95 57.31 1ucv s SER 79 Cb 0.03 0.77 -0.06 0.00 -1.71 0.00 0.00 66.02 65.05 1ucv s SER 79 CO 0.11 -0.15 0.50 -0.55 1.20 0.00 0.00 173.24 174.35 1ucv s SER 80 N 0.62 6.82 0.00 5.45 0.15 -1.26 -5.22 113.70 120.26 1ucv s SER 80 Ca -0.03 1.03 0.17 0.00 0.70 0.00 0.00 55.95 57.81 1ucv s SER 80 Cb -0.05 -2.27 0.13 0.00 -1.71 0.00 0.00 66.02 62.12 1ucv s SER 80 CO -0.04 0.17 1.02 0.61 1.20 0.00 0.00 173.24 176.20