#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ucv n SER 2 N 0.00 0.29 -0.09 1.61 3.41 -1.26 -4.71 113.62 112.86 1ucv n SER 2 Ca 0.00 0.03 -0.10 0.00 -0.26 0.00 0.00 58.87 58.53 1ucv n SER 2 Cb 0.00 0.75 -0.04 0.00 -0.26 0.00 0.00 64.21 64.67 1ucv n SER 2 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1ucv n SER 3 N -2.83 1.91 0.00 4.04 7.64 -1.26 -5.03 113.62 118.08 1ucv n SER 3 Ca -0.33 0.41 0.00 0.00 1.01 0.00 0.00 58.87 59.96 1ucv n SER 3 Cb 1.13 -0.79 0.00 0.00 -1.01 0.00 0.00 64.21 63.55 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 1.48 -1.79 3.71 0.23 0.00 -1.26 -5.15 105.19 102.42 1ucv n GLY 4 Ca -0.17 0.68 -0.41 0.00 0.00 0.00 0.00 46.02 46.13 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 0.00 7.24 0.33 1.61 1.04 -1.26 -5.06 113.70 117.60 1ucv s SER 5 Ca 0.00 1.50 0.09 0.00 0.48 0.00 0.00 55.95 58.01 1ucv s SER 5 Cb 0.00 -2.51 -0.05 0.00 0.10 0.00 0.00 66.02 63.56 1ucv s SER 5 CO 0.00 -0.19 0.03 -0.94 0.98 0.00 0.00 173.24 173.12 1ucv s SER 6 N 0.83 4.27 0.00 7.02 1.04 -1.26 -4.79 113.70 120.82 1ucv s SER 6 Ca 0.46 -0.93 0.00 0.00 0.48 0.00 0.00 55.95 55.96 1ucv s SER 6 Cb -0.20 -0.58 0.00 0.00 0.10 0.00 0.00 66.02 65.34 1ucv s SER 6 CO 0.24 -0.22 0.00 0.61 0.98 0.00 0.00 173.24 174.85 1ucv n GLY 7 N -0.97 0.53 3.14 7.32 0.00 -1.26 -5.16 105.19 108.79 1ucv n GLY 7 Ca -0.04 -0.80 -0.21 0.00 0.00 0.00 0.00 46.02 44.96 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 -4.81 0.99 -0.00 -1.26 -5.10 117.00 106.83 1ucv n LEU 8 Ca 0.00 -2.35 -0.32 0.00 -0.00 0.00 0.00 56.01 53.34 1ucv n LEU 8 Cb 0.00 -0.04 -0.06 0.00 -0.00 0.00 0.00 43.42 43.31 1ucv n LEU 8 CO 0.00 -0.53 -0.24 0.28 -0.00 0.00 0.00 177.39 176.90 1ucv s THR 9 N -2.24 4.78 0.51 1.47 -1.32 -1.26 -3.95 115.64 113.62 1ucv s THR 9 Ca 0.26 -0.55 0.41 0.00 -1.21 0.00 0.00 61.69 60.61 1ucv s THR 9 Cb -0.02 -3.26 0.62 0.00 -1.51 0.00 0.00 72.50 68.33 1ucv s THR 9 CO 0.17 0.22 1.60 0.58 -2.21 0.00 0.00 174.62 174.98 1ucv h VAL 10 N 2.75 0.06 -0.00 5.08 2.07 -1.83 0.42 116.25 124.80 1ucv h VAL 10 Ca -0.47 -0.01 -0.00 0.00 0.82 0.00 0.00 66.70 67.04 1ucv h VAL 10 Cb 1.17 0.04 -0.00 0.00 -1.52 0.00 0.00 31.29 30.98 1ucv h VAL 10 CO 0.66 0.00 -0.00 1.23 0.02 0.00 0.00 177.57 179.48 1ucv h GLY 11 N 0.02 0.01 0.02 2.17 0.00 -1.90 -2.45 103.07 100.94 1ucv h GLY 11 Ca 0.88 -0.00 0.01 0.00 0.00 0.00 0.00 47.33 48.21 1ucv h GLY 11 CO -0.20 0.00 -0.39 -0.55 0.00 0.00 0.00 176.54 175.41 1ucv h ASP 12 N -0.47 -1.19 0.11 0.19 3.32 -0.55 0.37 116.42 118.20 1ucv h ASP 12 Ca 0.00 0.13 0.01 0.00 0.02 0.00 0.00 57.03 57.19 1ucv h ASP 12 Cb 0.47 0.45 -0.04 0.00 0.22 0.00 0.00 39.33 40.44 1ucv h ASP 12 CO 0.00 -0.39 -0.40 -0.25 -1.72 0.00 0.00 179.24 176.48 1ucv h TRP 13 N -0.50 -1.17 -0.82 4.55 7.01 -1.62 -1.99 115.95 121.41 1ucv h TRP 13 Ca 0.00 0.03 0.20 0.00 2.11 0.00 0.00 58.89 61.24 1ucv h TRP 13 Cb 0.53 0.49 -0.13 0.00 -2.10 0.00 0.00 29.16 27.95 1ucv h TRP 13 CO -0.46 -0.46 0.16 -0.07 -2.79 0.00 0.00 178.44 174.82 1ucv h LEU 14 N -0.59 -0.09 -0.86 0.65 3.38 -1.30 0.21 115.31 116.71 1ucv h LEU 14 Ca -0.01 0.19 0.21 0.00 0.09 0.00 0.00 57.88 58.36 1ucv h LEU 14 Cb 0.58 0.28 -0.13 0.00 0.09 0.00 0.00 40.66 41.48 1ucv h LEU 14 CO -0.21 -0.14 0.31 -0.78 0.09 0.00 0.00 178.44 177.71 1ucv h ASP 15 N 0.19 0.18 -0.76 -0.43 3.58 0.50 0.24 116.42 119.92 1ucv h ASP 15 Ca 0.49 0.16 0.15 0.00 0.42 0.00 0.00 57.03 58.25 1ucv h ASP 15 Cb 0.93 0.18 -0.10 0.00 1.72 0.00 0.00 39.33 42.06 1ucv h ASP 15 CO -0.63 -0.05 0.30 -1.28 -2.88 0.00 0.00 179.24 174.69 1ucv h SER 16 N 0.32 0.26 -0.45 2.28 0.87 -0.30 0.39 113.55 116.93 1ucv h SER 16 Ca 0.53 0.12 0.00 0.00 -1.23 0.00 0.00 61.79 61.21 1ucv h SER 16 Cb 1.01 0.10 0.00 0.00 -0.44 0.00 0.00 62.40 63.07 1ucv h SER 16 CO -0.56 0.08 0.00 2.30 -0.53 0.00 0.00 176.83 178.12 1ucv n ILE 17 N -5.02 1.50 -2.91 2.23 -5.35 0.46 -4.89 119.36 105.37 1ucv n ILE 17 Ca 0.15 -0.88 -0.22 0.00 -0.27 0.00 0.00 62.75 61.53 1ucv n ILE 17 Cb 0.44 -0.10 0.02 0.00 -1.74 0.00 0.00 39.64 38.27 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 0.65 -4.09 0.00 6.28 1.74 0.14 -4.85 116.66 116.53 1ucv n ARG 18 Ca 0.19 0.89 0.03 0.00 -0.77 0.00 0.00 57.85 58.19 1ucv n ARG 18 Cb 0.75 -5.70 0.02 0.00 -1.02 0.00 0.00 32.46 26.51 1ucv n ARG 18 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 1ucv n MET 19 N -3.78 0.97 0.03 5.56 2.81 0.54 -4.63 117.12 118.63 1ucv n MET 19 Ca -0.13 -0.74 0.22 0.00 -1.81 0.00 0.00 57.70 55.23 1ucv n MET 19 Cb 0.63 -1.07 0.65 0.00 -0.71 0.00 0.00 33.22 32.71 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 1.43 0.00 1.51 3.03 0.00 -1.76 0.30 103.07 107.58 1ucv h GLY 20 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 47.33 47.39 1ucv h GLY 20 CO 0.00 0.00 0.20 0.07 0.00 0.00 0.00 176.54 176.81 1ucv h ARG 21 N 0.00 0.15 -0.00 4.80 0.11 -1.91 0.15 114.38 117.68 1ucv h ARG 21 Ca 0.26 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 60.33 1ucv h ARG 21 Cb 1.60 -0.03 0.00 0.00 1.11 0.00 0.00 29.97 32.65 1ucv h ARG 21 CO -0.00 0.10 -0.35 0.66 0.10 0.00 0.00 179.97 180.48 1ucv n TYR 22 N -4.48 0.00 -0.31 4.08 4.01 0.11 -4.11 117.16 116.46 1ucv n TYR 22 Ca 0.03 0.00 0.16 0.00 -0.16 0.00 0.00 57.90 57.93 1ucv n TYR 22 Cb 0.26 -0.32 0.35 0.00 -0.31 0.00 0.00 39.34 39.31 1ucv n TYR 22 CO 0.00 0.00 0.00 0.07 -0.46 0.00 0.00 176.86 176.47 1ucv h ARG 23 N 0.00 0.29 -0.61 -0.72 0.11 -0.73 0.83 114.38 113.56 1ucv h ARG 23 Ca 0.00 -0.02 0.13 0.00 0.10 0.00 0.00 59.98 60.20 1ucv h ARG 23 Cb 0.50 -0.06 -0.03 0.00 1.11 0.00 0.00 29.97 31.48 1ucv h ARG 23 CO 0.00 0.19 0.42 -0.44 0.10 0.00 0.00 179.97 180.24 1ucv h ASP 24 N 0.30 0.22 0.42 0.08 3.32 -1.73 -2.34 116.42 116.69 1ucv h ASP 24 Ca 0.61 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.65 1ucv h ASP 24 Cb 1.26 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.78 1ucv h ASP 24 CO -0.61 0.12 -0.20 0.45 -1.72 0.00 0.00 179.24 177.28 1ucv h HIS 25 N 0.24 -0.52 -0.88 4.55 3.86 0.42 -3.16 115.15 119.66 1ucv h HIS 25 Ca 0.29 -0.01 0.24 0.00 -1.16 0.00 0.00 60.37 59.72 1ucv h HIS 25 Cb 0.81 0.17 -0.15 0.00 1.06 0.00 0.00 27.41 29.31 1ucv h HIS 25 CO -0.00 -0.19 0.21 0.74 0.86 0.00 0.00 177.93 179.54 1ucv h PHE 26 N -0.89 0.29 -0.55 2.45 -1.00 -1.29 0.93 116.94 116.88 1ucv h PHE 26 Ca -0.06 0.05 0.12 0.00 2.81 0.00 0.00 57.97 60.89 1ucv h PHE 26 Cb 0.56 0.01 -0.03 0.00 3.61 0.00 0.00 35.95 40.10 1ucv h PHE 26 CO 0.02 -0.24 0.38 0.00 -1.61 0.00 0.00 178.31 176.86 1ucv h ALA 27 N 1.80 2.20 -0.00 2.45 0.00 -1.03 0.30 119.26 124.98 1ucv h ALA 27 Ca 0.55 -0.01 -0.22 0.00 0.00 0.00 0.00 54.91 55.23 1ucv h ALA 27 Cb 1.12 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1ucv h ALA 27 CO -0.68 -0.34 -0.93 0.00 0.00 0.00 0.00 179.25 177.30 1ucv h ALA 28 N 1.73 0.39 0.00 0.00 0.00 0.91 -3.09 119.26 119.19 1ucv h ALA 28 Ca 0.26 -0.71 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1ucv h ALA 28 Cb 0.71 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1ucv h ALA 28 CO -0.05 0.83 0.00 0.41 0.00 0.00 0.00 179.25 180.43 1ucv n GLY 29 N 0.92 -0.92 0.67 0.00 0.00 -0.24 -4.82 105.19 100.80 1ucv n GLY 29 Ca -0.06 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.84 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 0.69 0.94 3.01 -0.02 0.00 -0.95 -5.06 105.19 103.80 1ucv n GLY 30 Ca 0.14 -0.35 -0.31 0.00 0.00 0.00 0.00 46.02 45.50 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 3.40 -0.37 1.61 1.51 0.89 -4.91 117.35 117.48 1ucv s TYR 31 Ca 0.00 -2.64 0.11 0.00 -1.01 0.00 0.00 57.07 53.53 1ucv s TYR 31 Cb 0.00 -2.46 -0.13 0.00 -0.11 0.00 0.00 41.96 39.26 1ucv s TYR 31 CO 0.00 -0.91 0.40 0.45 -1.11 0.00 0.00 175.55 174.38 1ucv n SER 32 N 4.37 1.06 -4.25 2.29 2.88 -1.26 -1.51 113.62 117.21 1ucv n SER 32 Ca -0.03 -0.54 -0.21 0.00 -1.33 0.00 0.00 58.87 56.76 1ucv n SER 32 Cb 0.42 1.15 -0.10 0.00 -0.75 0.00 0.00 64.21 64.93 1ucv n SER 32 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1ucv s SER 33 N -2.39 2.06 0.10 -3.46 0.01 -1.26 -3.84 113.70 104.91 1ucv s SER 33 Ca 0.02 -1.49 -0.07 0.00 1.31 0.00 0.00 55.95 55.72 1ucv s SER 33 Cb 0.08 0.22 -0.20 0.00 0.21 0.00 0.00 66.02 66.33 1ucv s SER 33 CO 0.45 -0.77 1.21 -0.07 0.41 0.00 0.00 173.24 174.46 1ucv h LEU 34 N 2.11 0.59 -1.00 2.44 -0.00 -1.90 -3.18 115.31 114.36 1ucv h LEU 34 Ca -0.37 -0.53 0.40 0.00 -0.00 0.00 0.00 57.88 57.37 1ucv h LEU 34 Cb 1.25 -0.18 -0.17 0.00 -0.00 0.00 0.00 40.66 41.56 1ucv h LEU 34 CO 0.61 1.36 0.54 1.23 -0.00 0.00 0.00 178.44 182.18 1ucv h GLY 35 N 1.11 2.22 1.24 0.83 0.00 -1.97 0.90 103.07 107.39 1ucv h GLY 35 Ca -0.12 -0.16 -0.27 0.00 0.00 0.00 0.00 47.33 46.77 1ucv h GLY 35 CO 0.19 -0.74 -1.52 0.00 0.00 0.00 0.00 176.54 174.47 1ucv h MET 36 N 0.06 0.00 -0.41 4.80 -0.00 -1.97 -3.35 114.93 114.06 1ucv h MET 36 Ca 0.82 0.00 -0.09 0.00 -0.00 0.00 0.00 59.70 60.44 1ucv h MET 36 Cb 2.12 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 33.71 1ucv h MET 36 CO -0.74 0.61 -0.10 0.28 -0.00 0.00 0.00 176.91 176.96 1ucv h VAL 37 N 0.00 1.25 0.00 -0.10 2.07 0.62 -2.35 116.25 117.74 1ucv h VAL 37 Ca -0.21 -1.12 -0.02 0.00 0.82 0.00 0.00 66.70 66.16 1ucv h VAL 37 Cb 1.95 1.05 -0.00 0.00 -1.52 0.00 0.00 31.29 32.77 1ucv h VAL 37 CO 0.09 0.38 -0.08 -0.07 0.02 0.00 0.00 177.57 177.91 1ucv h LEU 38 N 0.65 0.00 -3.52 2.57 -0.00 -0.54 -1.30 115.31 113.17 1ucv h LEU 38 Ca 0.11 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.99 1ucv h LEU 38 Cb 0.56 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.22 1ucv h LEU 38 CO 0.03 0.08 0.00 -2.11 -0.00 0.00 0.00 178.44 176.45 1ucv n ARG 39 N -3.57 4.55 -2.96 1.13 1.85 -0.90 -4.89 116.66 111.87 1ucv n ARG 39 Ca -0.02 -3.12 -0.19 0.00 -1.00 0.00 0.00 57.85 53.53 1ucv n ARG 39 Cb 0.21 -2.20 0.04 0.00 -1.05 0.00 0.00 32.46 29.46 1ucv n ARG 39 CO 0.00 0.00 0.00 -1.64 -0.01 0.00 0.00 177.63 175.98 1ucv s MET 40 N -2.79 2.52 0.24 2.89 -1.94 -0.49 -5.08 119.30 114.64 1ucv s MET 40 Ca 0.53 -1.36 -0.19 0.00 -1.71 0.00 0.00 55.69 52.95 1ucv s MET 40 Cb 0.41 -2.66 0.03 0.00 2.01 0.00 0.00 34.83 34.61 1ucv s MET 40 CO 0.15 -0.63 0.63 -0.80 -0.01 0.00 0.00 175.02 174.36 1ucv s ASN 41 N -4.51 -0.29 0.37 3.03 0.01 -1.26 -4.99 114.94 107.30 1ucv s ASN 41 Ca 0.59 -0.53 0.25 0.00 -0.71 0.00 0.00 52.86 52.46 1ucv s ASN 41 Cb -0.08 0.66 1.27 0.00 0.41 0.00 0.00 41.25 43.51 1ucv s ASN 41 CO 0.37 -1.20 1.38 0.00 -1.51 0.00 0.00 177.10 176.13 1ucv n ALA 42 N -0.41 1.10 0.02 0.60 0.00 -1.26 0.13 120.51 120.70 1ucv n ALA 42 Ca -0.07 0.81 -0.11 0.00 0.00 0.00 0.00 53.44 54.06 1ucv n ALA 42 Cb 0.61 -0.92 -0.06 0.00 0.00 0.00 0.00 19.45 19.08 1ucv n ALA 42 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1ucv h GLN 43 N 0.00 0.05 -0.01 0.00 4.15 -1.99 0.29 115.11 117.61 1ucv h GLN 43 Ca 0.76 -0.00 -0.01 0.00 0.77 0.00 0.00 58.65 60.17 1ucv h GLN 43 Cb 2.32 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 30.00 1ucv h GLN 43 CO -0.50 0.04 -0.04 -0.44 -1.93 0.00 0.00 178.83 175.95 1ucv h ASP 44 N 0.06 0.06 0.10 -0.69 3.32 0.74 -3.12 116.42 116.88 1ucv h ASP 44 Ca 0.02 -0.64 0.02 0.00 0.02 0.00 0.00 57.03 56.45 1ucv h ASP 44 Cb -0.00 -0.02 -0.03 0.00 0.22 0.00 0.00 39.33 39.50 1ucv h ASP 44 CO -0.01 0.69 -0.24 0.58 -1.72 0.00 0.00 179.24 178.54 1ucv h VAL 45 N -0.57 0.45 -1.02 -1.35 2.07 -0.87 -1.82 116.25 113.15 1ucv h VAL 45 Ca -0.00 0.00 0.26 0.00 0.82 0.00 0.00 66.70 67.78 1ucv h VAL 45 Cb 0.68 0.45 -0.12 0.00 -1.52 0.00 0.00 31.29 30.79 1ucv h VAL 45 CO 0.01 0.00 0.62 -0.09 0.02 0.00 0.00 177.57 178.13 1ucv h ARG 46 N -0.44 0.50 -0.43 1.57 9.65 -0.51 0.49 114.38 125.21 1ucv h ARG 46 Ca 0.03 -0.03 -0.03 0.00 -1.10 0.00 0.00 59.98 58.85 1ucv h ARG 46 Cb 0.47 -0.11 -0.02 0.00 -1.39 0.00 0.00 29.97 28.92 1ucv h ARG 46 CO -0.15 0.33 0.15 0.00 2.80 0.00 0.00 179.97 183.10 1ucv h ALA 47 N 1.71 1.44 0.00 2.80 0.00 -1.27 -1.72 119.26 122.22 1ucv h ALA 47 Ca 0.64 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.41 1ucv h ALA 47 Cb 1.34 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.95 1ucv h ALA 47 CO -0.44 0.42 -0.01 -0.07 0.00 0.00 0.00 179.25 179.15 1ucv h LEU 48 N 0.62 0.00 0.00 0.00 3.38 0.28 -3.46 115.31 116.13 1ucv h LEU 48 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1ucv h LEU 48 Cb 0.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1ucv h LEU 48 CO -0.01 0.01 0.00 0.61 0.09 0.00 0.00 178.44 179.14 1ucv n GLY 49 N -1.27 0.80 3.56 0.83 0.00 -0.64 -4.82 105.19 103.64 1ucv n GLY 49 Ca -0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.76 3.22 -0.03 -0.61 1.09 -1.25 -4.69 121.20 118.17 1ucv s ILE 50 Ca 0.00 0.14 0.04 0.00 -1.10 0.00 0.00 60.65 59.73 1ucv s ILE 50 Cb 0.00 -3.54 -0.06 0.00 -1.06 0.00 0.00 42.46 37.80 1ucv s ILE 50 CO 0.00 -0.51 0.04 0.35 -0.10 0.00 0.00 174.94 174.72 1ucv n THR 51 N 7.54 0.20 -1.45 2.92 -2.24 -1.26 -4.11 114.28 115.88 1ucv n THR 51 Ca 0.27 -0.15 -0.52 0.00 -2.27 0.00 0.00 64.05 61.38 1ucv n THR 51 Cb 0.52 -0.50 -0.07 0.00 -2.10 0.00 0.00 70.33 68.18 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 -2.00 2.07 -0.34 3.22 4.77 -1.26 -4.63 117.00 118.83 1ucv n LEU 52 Ca -0.05 0.48 0.08 0.00 -0.03 0.00 0.00 56.01 56.49 1ucv n LEU 52 Cb 0.48 -1.23 0.19 0.00 -2.33 0.00 0.00 43.42 40.52 1ucv n LEU 52 CO 0.09 -0.70 0.73 0.24 -1.33 0.00 0.00 177.39 176.41 1ucv h MET 53 N 11.81 0.01 -1.01 3.23 2.86 -1.96 0.93 114.93 130.80 1ucv h MET 53 Ca -0.27 -0.00 0.23 0.00 -2.06 0.00 0.00 59.70 57.60 1ucv h MET 53 Cb 1.33 -0.00 -0.11 0.00 0.06 0.00 0.00 31.60 32.88 1ucv h MET 53 CO 1.02 0.01 0.62 0.78 1.06 0.00 0.00 176.91 180.40 1ucv h GLY 54 N 0.01 1.59 0.00 8.32 0.00 -2.01 -1.53 103.07 109.45 1ucv h GLY 54 Ca 0.50 -0.29 -0.01 0.00 0.00 0.00 0.00 47.33 47.53 1ucv h GLY 54 CO -0.94 -0.13 -0.59 1.42 0.00 0.00 0.00 176.54 176.29 1ucv n HIS 55 N -4.74 0.84 -0.43 5.60 8.25 0.27 -3.88 115.22 121.12 1ucv n HIS 55 Ca 0.25 0.36 0.37 0.00 -0.26 0.00 0.00 57.72 58.44 1ucv n HIS 55 Cb 0.72 -0.76 0.57 0.00 1.12 0.00 0.00 29.99 31.65 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 -4.59 0.01 0.01 -0.41 6.02 0.17 0.22 117.38 118.81 1ucv n GLN 56 Ca -0.09 0.94 -0.17 0.00 -0.01 0.00 0.00 57.00 57.67 1ucv n GLN 56 Cb 0.31 -2.25 -0.12 0.00 1.02 0.00 0.00 30.24 29.19 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 0.32 0.83 -1.09 1.57 -1.44 -3.01 116.57 113.75 1ucv h LYS 57 Ca 0.66 -0.39 -0.04 0.00 -1.87 0.00 0.00 60.65 59.01 1ucv h LYS 57 Cb 3.04 0.12 0.01 0.00 0.08 0.00 0.00 32.23 35.48 1ucv h LYS 57 CO -0.01 1.10 -0.40 0.87 -0.57 0.00 0.00 179.45 180.44 1ucv h LYS 58 N -0.29 -1.08 -0.22 3.15 6.56 0.26 0.67 116.57 125.63 1ucv h LYS 58 Ca -0.08 0.07 0.03 0.00 -1.06 0.00 0.00 60.65 59.61 1ucv h LYS 58 Cb 1.32 0.24 -0.06 0.00 -0.57 0.00 0.00 32.23 33.17 1ucv h LYS 58 CO 0.11 -0.72 -0.41 0.82 -2.06 0.00 0.00 179.45 177.19 1ucv h ILE 59 N -1.12 0.00 0.62 1.86 2.04 -1.58 0.96 117.51 120.29 1ucv h ILE 59 Ca -0.11 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.72 1ucv h ILE 59 Cb 0.86 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.93 1ucv h ILE 59 CO 0.19 0.00 -0.42 -0.07 0.00 0.00 0.00 178.15 177.85 1ucv h LEU 60 N -0.35 -1.07 -2.00 1.44 -0.00 -1.57 -1.01 115.31 110.74 1ucv h LEU 60 Ca 0.04 0.07 0.13 0.00 -0.00 0.00 0.00 57.88 58.12 1ucv h LEU 60 Cb 0.47 0.32 -0.02 0.00 -0.00 0.00 0.00 40.66 41.43 1ucv h LEU 60 CO -0.39 -0.63 0.43 1.23 -0.00 0.00 0.00 178.44 179.08 1ucv h GLY 61 N -0.99 0.00 1.91 0.83 0.00 0.64 0.39 103.07 105.85 1ucv h GLY 61 Ca -0.08 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.14 1ucv h GLY 61 CO 0.05 0.00 -0.60 0.23 0.00 0.00 0.00 176.54 176.23 1ucv h SER 62 N 0.00 0.00 0.00 0.19 0.87 0.17 -3.27 113.55 111.51 1ucv h SER 62 Ca 0.22 0.00 -0.08 0.00 -1.23 0.00 0.00 61.79 60.69 1ucv h SER 62 Cb 1.08 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.03 1ucv h SER 62 CO -0.00 0.52 -0.47 0.40 -0.53 0.00 0.00 176.83 176.75 1ucv h ILE 63 N 0.00 1.37 -1.06 2.23 2.04 0.98 -2.95 117.51 120.12 1ucv h ILE 63 Ca -0.02 -2.21 0.29 0.00 1.00 0.00 0.00 64.86 63.92 1ucv h ILE 63 Cb 1.41 2.77 -0.11 0.00 -0.74 0.00 0.00 36.82 40.15 1ucv h ILE 63 CO 0.07 0.46 0.67 0.06 0.00 0.00 0.00 178.15 179.41 1ucv h GLN 64 N -1.00 0.38 0.04 2.37 3.07 -1.16 0.49 115.11 119.30 1ucv h GLN 64 Ca -0.13 -0.02 -0.23 0.00 0.09 0.00 0.00 58.65 58.36 1ucv h GLN 64 Cb 1.06 -0.09 -0.02 0.00 0.08 0.00 0.00 27.48 28.52 1ucv h GLN 64 CO -0.08 0.25 -1.07 0.00 0.09 0.00 0.00 178.83 178.02 1ucv h THR 65 N 0.39 1.65 -0.10 1.86 1.03 -1.69 0.09 112.91 116.15 1ucv h THR 65 Ca 0.65 -3.32 -0.09 0.00 -0.01 0.00 0.00 66.41 63.64 1ucv h THR 65 Cb 1.59 2.88 -0.01 0.00 -1.07 0.00 0.00 68.15 71.54 1ucv h THR 65 CO -0.38 0.95 -0.35 0.24 -0.01 0.00 0.00 175.52 175.97 1ucv h MET 66 N 0.02 0.20 0.04 0.00 2.86 0.07 -3.11 114.93 115.01 1ucv h MET 66 Ca -0.05 -0.08 -0.35 0.00 -2.06 0.00 0.00 59.70 57.16 1ucv h MET 66 Cb 1.83 -0.01 -0.05 0.00 0.06 0.00 0.00 31.60 33.43 1ucv h MET 66 CO 0.15 0.53 -2.06 2.89 1.06 0.00 0.00 176.91 179.48 1ucv n ARG 67 N -4.08 0.69 -0.35 1.72 1.85 -0.01 -4.25 116.66 112.23 1ucv n ARG 67 Ca -0.01 0.20 0.15 0.00 -1.00 0.00 0.00 57.85 57.19 1ucv n ARG 67 Cb 0.43 -1.67 0.35 0.00 -1.05 0.00 0.00 32.46 30.52 1ucv n ARG 67 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1ucv h ALA 68 N 0.53 1.72 -0.83 2.89 0.00 -0.95 0.21 119.26 122.82 1ucv h ALA 68 Ca -0.43 0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.61 1ucv h ALA 68 Cb 2.04 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 19.77 1ucv h ALA 68 CO 0.04 -0.17 0.55 -0.56 0.00 0.00 0.00 179.25 179.11 1ucv h GLN 69 N 0.66 1.04 -0.99 0.00 3.07 -1.72 -2.42 115.11 114.74 1ucv h GLN 69 Ca 0.61 -0.06 0.37 0.00 0.09 0.00 0.00 58.65 59.66 1ucv h GLN 69 Cb 1.07 -0.23 -0.17 0.00 0.08 0.00 0.00 27.48 28.22 1ucv h GLN 69 CO -0.44 0.69 0.46 -0.07 0.09 0.00 0.00 178.83 179.56 1ucv h LEU 70 N 1.07 0.24 -6.32 0.06 3.38 -0.78 -3.32 115.31 109.63 1ucv h LEU 70 Ca 0.32 0.24 -0.20 0.00 0.09 0.00 0.00 57.88 58.34 1ucv h LEU 70 Cb -0.03 0.27 -0.29 0.00 0.09 0.00 0.00 40.66 40.70 1ucv h LEU 70 CO -0.09 -0.35 -0.54 0.28 0.09 0.00 0.00 178.44 177.84 1ucv s THR 71 N -5.64 -0.62 -0.02 0.22 -1.32 -0.91 -5.14 115.64 102.20 1ucv s THR 71 Ca -0.10 -0.30 -0.05 0.00 -1.21 0.00 0.00 61.69 60.03 1ucv s THR 71 Cb 0.32 -0.99 0.01 0.00 -1.51 0.00 0.00 72.50 70.33 1ucv s THR 71 CO 0.78 -0.29 0.11 -0.55 -2.21 0.00 0.00 174.62 172.46 1ucv s SER 72 N 2.54 -0.04 -0.64 8.08 0.15 -1.22 -4.91 113.70 117.64 1ucv s SER 72 Ca 0.10 0.04 -0.28 0.00 0.70 0.00 0.00 55.95 56.51 1ucv s SER 72 Cb -0.12 0.22 0.03 0.00 -1.71 0.00 0.00 66.02 64.43 1ucv s SER 72 CO -0.30 -0.16 1.27 -0.89 1.20 0.00 0.00 173.24 174.36 1ucv s THR 73 N -0.50 3.86 0.05 6.45 2.01 -1.26 -4.98 115.64 121.27 1ucv s THR 73 Ca -0.06 0.66 -0.00 0.00 0.31 0.00 0.00 61.69 62.61 1ucv s THR 73 Cb -0.04 -4.75 -0.04 0.00 0.01 0.00 0.00 72.50 67.68 1ucv s THR 73 CO 0.00 -1.52 -0.04 -1.10 -0.69 0.00 0.00 174.62 171.28 1ucv s GLN 74 N 5.38 0.60 0.00 4.92 -0.21 -1.26 -4.98 119.66 124.11 1ucv s GLN 74 Ca 0.41 -1.12 0.00 0.00 0.02 0.00 0.00 55.36 54.67 1ucv s GLN 74 Cb -0.08 0.08 0.00 0.00 1.00 0.00 0.00 33.01 34.01 1ucv s GLN 74 CO 0.21 -0.07 0.00 0.41 -2.12 0.00 0.00 175.29 173.72 1ucv n GLY 75 N 0.38 1.83 0.32 3.09 0.00 -1.26 -5.00 105.19 104.55 1ucv n GLY 75 Ca -0.16 -0.12 0.10 0.00 0.00 0.00 0.00 46.02 45.83 1ucv n GLY 75 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1ucv h SER 76 N 0.00 -0.46 0.00 1.61 0.02 -2.04 -3.42 113.55 109.25 1ucv h SER 76 Ca 0.00 0.24 0.00 0.00 -0.84 0.00 0.00 61.79 61.19 1ucv h SER 76 Cb 0.00 0.44 0.00 0.00 0.14 0.00 0.00 62.40 62.98 1ucv h SER 76 CO 0.00 -0.27 0.00 0.61 -1.14 0.00 0.00 176.83 176.03 1ucv n GLY 77 N -1.48 -0.57 0.29 -3.77 0.00 -1.26 -5.00 105.19 93.40 1ucv n GLY 77 Ca 0.18 0.69 0.12 0.00 0.00 0.00 0.00 46.02 47.01 1ucv n GLY 77 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1ucv h PRO 78 N 0.00 0.00 -5.27 1.61 0.11 -1.99 -3.44 132.00 123.02 1ucv h PRO 78 Ca 0.00 0.00 -0.34 0.00 0.11 0.00 0.00 66.00 65.77 1ucv h PRO 78 Cb 0.00 0.00 0.13 0.00 0.11 0.00 0.00 31.00 31.24 1ucv h PRO 78 CO 0.00 0.00 -0.62 0.45 -0.21 0.00 0.00 178.00 177.62 1ucv n SER 79 N -2.64 -5.04 -4.41 -2.05 2.88 -1.26 -4.99 113.62 96.11 1ucv n SER 79 Ca -0.02 -0.49 -0.37 0.00 -1.33 0.00 0.00 58.87 56.66 1ucv n SER 79 Cb 0.41 -4.52 -0.12 0.00 -0.75 0.00 0.00 64.21 59.22 1ucv n SER 79 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1ucv s SER 80 N -3.48 5.15 0.00 -3.46 1.04 -1.26 -5.33 113.70 106.35 1ucv s SER 80 Ca 0.41 -0.41 0.00 0.00 0.48 0.00 0.00 55.95 56.43 1ucv s SER 80 Cb -0.18 -1.91 0.00 0.00 0.10 0.00 0.00 66.02 64.03 1ucv s SER 80 CO 0.64 -0.10 0.00 0.61 0.98 0.00 0.00 173.24 175.37