#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 -3.29 -0.25 1.61 3.41 -1.26 -4.83 113.62 109.01 1ucv n SER 2 Ca 0.00 -0.90 0.05 0.00 -0.26 0.00 0.00 58.87 57.76 1ucv n SER 2 Cb 0.00 -3.36 0.16 0.00 -0.26 0.00 0.00 64.21 60.75 1ucv n SER 2 CO 0.00 0.00 0.00 -1.28 -0.16 0.00 0.00 175.04 173.60 1ucv h SER 3 N -1.82 -0.19 -0.64 4.04 0.87 -2.12 -3.34 113.55 110.35 1ucv h SER 3 Ca -0.59 0.17 -0.30 0.00 -1.23 0.00 0.00 61.79 59.84 1ucv h SER 3 Cb 1.38 0.27 -0.20 0.00 -0.44 0.00 0.00 62.40 63.41 1ucv h SER 3 CO 0.70 -0.12 -0.64 0.61 -0.53 0.00 0.00 176.83 176.85 1ucv n GLY 4 N -1.38 0.62 3.51 5.77 0.00 -1.26 -5.13 105.19 107.31 1ucv n GLY 4 Ca 0.13 -0.23 -0.32 0.00 0.00 0.00 0.00 46.02 45.61 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 -1.19 4.16 0.38 1.61 1.04 -1.26 -5.13 113.70 113.31 1ucv s SER 5 Ca 0.32 -0.23 0.05 0.00 0.48 0.00 0.00 55.95 56.57 1ucv s SER 5 Cb 0.18 -0.87 -0.06 0.00 0.10 0.00 0.00 66.02 65.37 1ucv s SER 5 CO -0.19 0.31 0.04 -0.94 0.98 0.00 0.00 173.24 173.44 1ucv s SER 6 N -1.10 3.10 0.00 7.02 1.04 -1.26 -5.05 113.70 117.45 1ucv s SER 6 Ca 0.14 -1.42 0.00 0.00 0.48 0.00 0.00 55.95 55.14 1ucv s SER 6 Cb -0.11 -0.09 0.00 0.00 0.10 0.00 0.00 66.02 65.92 1ucv s SER 6 CO 0.04 -0.60 0.00 0.61 0.98 0.00 0.00 173.24 174.27 1ucv n GLY 7 N -0.86 0.50 3.09 7.32 0.00 -1.26 -5.17 105.19 108.82 1ucv n GLY 7 Ca -0.05 -0.55 -0.21 0.00 0.00 0.00 0.00 46.02 45.21 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 -4.72 0.99 -0.00 -1.26 -5.12 117.00 106.89 1ucv n LEU 8 Ca 0.00 -2.31 -0.31 0.00 -0.00 0.00 0.00 56.01 53.39 1ucv n LEU 8 Cb 0.00 -0.05 -0.08 0.00 -0.00 0.00 0.00 43.42 43.29 1ucv n LEU 8 CO 0.00 -0.53 -0.30 0.28 -0.00 0.00 0.00 177.39 176.84 1ucv s THR 9 N -2.20 4.29 0.59 1.47 -1.32 -1.26 -4.17 115.64 113.04 1ucv s THR 9 Ca 0.27 -0.76 0.26 0.00 -1.21 0.00 0.00 61.69 60.25 1ucv s THR 9 Cb -0.02 -3.01 0.39 0.00 -1.51 0.00 0.00 72.50 68.34 1ucv s THR 9 CO 0.17 0.21 1.26 0.52 -2.21 0.00 0.00 174.62 174.57 1ucv n VAL 10 N 0.81 0.00 -0.04 5.08 0.31 -1.21 0.83 118.33 124.10 1ucv n VAL 10 Ca -0.11 1.23 -0.14 0.00 -0.01 0.00 0.00 64.34 65.30 1ucv n VAL 10 Cb 0.52 -2.19 -0.12 0.00 -0.91 0.00 0.00 33.84 31.14 1ucv n VAL 10 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 1ucv h GLY 11 N 0.00 0.05 0.08 2.92 0.00 -1.91 -2.80 103.07 101.41 1ucv h GLY 11 Ca 0.49 -0.10 0.02 0.00 0.00 0.00 0.00 47.33 47.74 1ucv h GLY 11 CO -0.01 0.08 -0.53 -0.55 0.00 0.00 0.00 176.54 175.54 1ucv h ASP 12 N -0.76 -1.61 0.34 0.19 5.19 0.05 0.35 116.42 120.17 1ucv h ASP 12 Ca -0.01 0.17 -0.01 0.00 -0.62 0.00 0.00 57.03 56.56 1ucv h ASP 12 Cb 0.91 0.60 -0.01 0.00 0.18 0.00 0.00 39.33 41.01 1ucv h ASP 12 CO 0.01 -0.54 -0.31 -0.25 -3.12 0.00 0.00 179.24 175.03 1ucv h TRP 13 N -0.72 -0.86 -0.86 4.55 7.01 -1.68 -2.60 115.95 120.80 1ucv h TRP 13 Ca 0.00 0.00 0.22 0.00 2.11 0.00 0.00 58.89 61.23 1ucv h TRP 13 Cb 0.74 0.33 -0.15 0.00 -2.10 0.00 0.00 29.16 27.98 1ucv h TRP 13 CO -0.48 -0.42 0.12 -0.07 -2.79 0.00 0.00 178.44 174.80 1ucv h LEU 14 N -0.64 -0.22 -0.73 0.65 3.38 -1.40 0.32 115.31 116.67 1ucv h LEU 14 Ca -0.04 0.22 0.15 0.00 0.09 0.00 0.00 57.88 58.29 1ucv h LEU 14 Cb 0.55 0.34 -0.10 0.00 0.09 0.00 0.00 40.66 41.54 1ucv h LEU 14 CO -0.02 -0.21 0.22 -0.78 0.09 0.00 0.00 178.44 177.74 1ucv h ASP 15 N 0.13 0.12 -0.56 -0.43 1.82 0.05 0.31 116.42 117.86 1ucv h ASP 15 Ca 0.52 0.13 0.11 0.00 -0.39 0.00 0.00 57.03 57.40 1ucv h ASP 15 Cb 1.02 0.15 -0.09 0.00 0.68 0.00 0.00 39.33 41.09 1ucv h ASP 15 CO -0.72 0.02 0.04 0.28 -1.61 0.00 0.00 179.24 177.26 1ucv h SER 16 N 0.34 -0.15 -0.15 2.28 0.02 0.01 0.47 113.55 116.36 1ucv h SER 16 Ca 0.41 0.12 0.00 0.00 -0.84 0.00 0.00 61.79 61.48 1ucv h SER 16 Cb 0.66 0.21 0.00 0.00 0.14 0.00 0.00 62.40 63.40 1ucv h SER 16 CO -0.46 -0.06 0.00 2.30 -1.14 0.00 0.00 176.83 177.48 1ucv n ILE 17 N -5.21 0.32 -2.80 3.27 -5.35 -0.32 -4.86 119.36 104.40 1ucv n ILE 17 Ca 0.07 -0.24 -0.20 0.00 -0.27 0.00 0.00 62.75 62.11 1ucv n ILE 17 Cb 0.31 -0.03 0.02 0.00 -1.74 0.00 0.00 39.64 38.20 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 0.02 -3.75 -0.00 6.28 1.74 0.16 -4.86 116.66 116.25 1ucv n ARG 18 Ca 0.06 0.88 0.00 0.00 -0.77 0.00 0.00 57.85 58.01 1ucv n ARG 18 Cb 0.22 -5.56 0.00 0.00 -1.02 0.00 0.00 32.46 26.10 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 -3.55 -0.09 0.31 5.56 2.81 0.93 -4.69 117.12 118.41 1ucv n MET 19 Ca -0.14 -0.74 0.15 0.00 -1.81 0.00 0.00 57.70 55.15 1ucv n MET 19 Cb 0.63 -1.01 0.73 0.00 -0.71 0.00 0.00 33.22 32.86 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 0.08 0.00 2.00 3.03 0.00 -1.72 0.22 103.07 106.68 1ucv h GLY 20 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 1ucv h GLY 20 CO 0.00 0.00 -0.06 0.07 0.00 0.00 0.00 176.54 176.55 1ucv h ARG 21 N 0.00 0.00 0.00 4.80 0.11 -1.90 -0.24 114.38 117.15 1ucv h ARG 21 Ca 0.02 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.10 1ucv h ARG 21 Cb 0.85 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.93 1ucv h ARG 21 CO -0.00 0.06 -0.50 0.66 0.10 0.00 0.00 179.97 180.28 1ucv n TYR 22 N -3.72 0.06 -0.30 4.08 4.01 0.78 -4.31 117.16 117.75 1ucv n TYR 22 Ca -0.02 0.02 -0.06 0.00 -0.16 0.00 0.00 57.90 57.67 1ucv n TYR 22 Cb 0.15 -0.30 -0.01 0.00 -0.31 0.00 0.00 39.34 38.87 1ucv n TYR 22 CO 0.00 0.00 0.00 -0.09 -0.46 0.00 0.00 176.86 176.31 1ucv h ARG 23 N 0.00 -0.10 -1.50 -0.72 9.65 -1.11 0.83 114.38 121.43 1ucv h ARG 23 Ca 0.00 0.01 0.46 0.00 -1.10 0.00 0.00 59.98 59.34 1ucv h ARG 23 Cb 0.53 0.02 -0.10 0.00 -1.39 0.00 0.00 29.97 29.03 1ucv h ARG 23 CO 0.00 -0.07 1.03 -0.44 2.80 0.00 0.00 179.97 183.30 1ucv h ASP 24 N -0.10 0.13 0.66 -3.80 3.32 -1.76 0.83 116.42 115.69 1ucv h ASP 24 Ca 0.24 0.06 -0.03 0.00 0.02 0.00 0.00 57.03 57.32 1ucv h ASP 24 Cb 0.55 0.05 0.01 0.00 0.22 0.00 0.00 39.33 40.16 1ucv h ASP 24 CO -0.84 -0.07 -0.32 0.45 -1.72 0.00 0.00 179.24 176.74 1ucv h HIS 25 N 0.06 -0.82 -0.85 4.55 3.86 0.40 -3.09 115.15 119.26 1ucv h HIS 25 Ca 0.80 -0.02 0.21 0.00 -1.16 0.00 0.00 60.37 60.21 1ucv h HIS 25 Cb 2.86 0.27 -0.13 0.00 1.06 0.00 0.00 27.41 31.48 1ucv h HIS 25 CO -0.00 -0.49 0.28 0.74 0.86 0.00 0.00 177.93 179.32 1ucv h PHE 26 N -1.20 0.45 -0.43 2.45 -1.00 -0.73 0.73 116.94 117.20 1ucv h PHE 26 Ca -0.09 0.04 0.13 0.00 2.81 0.00 0.00 57.97 60.86 1ucv h PHE 26 Cb 0.69 -0.06 -0.02 0.00 3.61 0.00 0.00 35.95 40.17 1ucv h PHE 26 CO 0.00 -0.12 0.32 0.00 -1.61 0.00 0.00 178.31 176.90 1ucv h ALA 27 N 1.72 2.39 0.22 2.45 0.00 -0.82 0.38 119.26 125.59 1ucv h ALA 27 Ca 0.53 -0.02 -0.34 0.00 0.00 0.00 0.00 54.91 55.09 1ucv h ALA 27 Cb 1.01 0.03 0.03 0.00 0.00 0.00 0.00 17.79 18.85 1ucv h ALA 27 CO -0.58 -0.54 -1.54 0.00 0.00 0.00 0.00 179.25 176.59 1ucv h ALA 28 N 1.77 -0.03 0.00 0.00 0.00 0.51 -3.26 119.26 118.26 1ucv h ALA 28 Ca 0.21 -0.96 0.00 0.00 0.00 0.00 0.00 54.91 54.16 1ucv h ALA 28 Cb 0.84 0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1ucv h ALA 28 CO -0.00 0.84 0.00 0.41 0.00 0.00 0.00 179.25 180.50 1ucv n GLY 29 N 1.74 -0.57 0.59 0.00 0.00 -0.49 -4.79 105.19 101.67 1ucv n GLY 29 Ca -0.18 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.73 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 0.14 0.82 3.01 -0.02 0.00 -0.89 -5.06 105.19 103.19 1ucv n GLY 30 Ca 0.13 -0.28 -0.31 0.00 0.00 0.00 0.00 46.02 45.56 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 3.64 -0.27 1.61 2.02 0.12 -4.90 117.35 117.57 1ucv s TYR 31 Ca 0.00 -2.89 0.08 0.00 -0.37 0.00 0.00 57.07 53.89 1ucv s TYR 31 Cb 0.00 -2.79 -0.10 0.00 -0.40 0.00 0.00 41.96 38.67 1ucv s TYR 31 CO 0.00 -0.94 0.30 0.45 -1.57 0.00 0.00 175.55 173.79 1ucv n SER 32 N 4.29 1.24 -4.60 2.29 2.88 -1.26 -2.06 113.62 116.40 1ucv n SER 32 Ca 0.02 -0.47 -0.27 0.00 -1.33 0.00 0.00 58.87 56.82 1ucv n SER 32 Cb 0.42 1.12 -0.10 0.00 -0.75 0.00 0.00 64.21 64.90 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 -2.16 3.89 0.00 -3.46 0.01 -1.26 -3.35 113.70 107.38 1ucv s SER 33 Ca 0.01 -1.23 -0.19 0.00 1.31 0.00 0.00 55.95 55.85 1ucv s SER 33 Cb 0.06 -0.40 -0.30 0.00 0.21 0.00 0.00 66.02 65.59 1ucv s SER 33 CO 0.34 -0.33 1.01 -0.07 0.41 0.00 0.00 173.24 174.61 1ucv h LEU 34 N 1.86 0.66 -0.85 2.44 -0.00 -1.91 -3.07 115.31 114.43 1ucv h LEU 34 Ca -0.43 -0.87 0.21 0.00 -0.00 0.00 0.00 57.88 56.79 1ucv h LEU 34 Cb 1.25 -0.21 -0.13 0.00 -0.00 0.00 0.00 40.66 41.57 1ucv h LEU 34 CO 0.74 1.47 0.28 1.23 -0.00 0.00 0.00 178.44 182.16 1ucv h GLY 35 N -0.05 1.35 2.00 0.83 0.00 -1.97 0.55 103.07 105.78 1ucv h GLY 35 Ca -0.16 -0.08 -0.08 0.00 0.00 0.00 0.00 47.33 47.01 1ucv h GLY 35 CO 0.19 -0.29 -0.39 0.00 0.00 0.00 0.00 176.54 176.05 1ucv h MET 36 N 0.29 0.00 0.00 4.80 -0.00 -1.99 -3.19 114.93 114.84 1ucv h MET 36 Ca 0.52 0.00 -0.18 0.00 -0.00 0.00 0.00 59.70 60.05 1ucv h MET 36 Cb 1.01 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 32.58 1ucv h MET 36 CO -0.58 0.39 -0.83 0.28 -0.00 0.00 0.00 176.91 176.17 1ucv h VAL 37 N 0.00 1.58 0.00 -0.10 2.07 -0.00 -3.09 116.25 116.70 1ucv h VAL 37 Ca -0.00 -2.79 -0.01 0.00 0.82 0.00 0.00 66.70 64.72 1ucv h VAL 37 Cb 1.19 2.51 -0.00 0.00 -1.52 0.00 0.00 31.29 33.47 1ucv h VAL 37 CO 0.05 0.80 -0.03 -0.07 0.02 0.00 0.00 177.57 178.34 1ucv h LEU 38 N 0.02 0.00 -3.15 2.57 4.07 -0.44 -1.60 115.31 116.77 1ucv h LEU 38 Ca -0.01 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.95 1ucv h LEU 38 Cb 1.46 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.20 1ucv h LEU 38 CO 0.11 0.03 0.00 -2.11 -1.08 0.00 0.00 178.44 175.39 1ucv n ARG 39 N -3.19 3.87 -2.83 1.13 1.85 -1.17 -4.71 116.66 111.61 1ucv n ARG 39 Ca -0.01 -2.90 -0.19 0.00 -1.00 0.00 0.00 57.85 53.75 1ucv n ARG 39 Cb 0.24 -1.95 0.03 0.00 -1.05 0.00 0.00 32.46 29.73 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 -1.95 2.60 0.21 2.89 -1.94 -0.60 -5.10 119.30 115.41 1ucv s MET 40 Ca 0.52 -1.07 -0.19 0.00 -1.71 0.00 0.00 55.69 53.24 1ucv s MET 40 Cb 0.34 -2.61 0.03 0.00 2.01 0.00 0.00 34.83 34.60 1ucv s MET 40 CO 0.24 -0.57 0.57 -0.80 -0.01 0.00 0.00 175.02 174.45 1ucv s ASN 41 N -4.43 -0.30 0.22 3.03 0.01 -1.26 -4.93 114.94 107.28 1ucv s ASN 41 Ca 0.57 -0.45 0.04 0.00 -0.71 0.00 0.00 52.86 52.31 1ucv s ASN 41 Cb -0.10 0.61 0.61 0.00 0.41 0.00 0.00 41.25 42.78 1ucv s ASN 41 CO 0.36 -1.10 1.04 0.00 -1.51 0.00 0.00 177.10 175.89 1ucv n ALA 42 N -0.37 0.43 -0.05 0.60 0.00 -1.26 0.16 120.51 120.01 1ucv n ALA 42 Ca -0.10 0.70 -0.08 0.00 0.00 0.00 0.00 53.44 53.97 1ucv n ALA 42 Cb 0.62 -0.56 -0.01 0.00 0.00 0.00 0.00 19.45 19.50 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 -0.17 0.07 0.00 5.75 -2.00 0.30 115.11 119.06 1ucv h GLN 43 Ca 0.44 0.01 -0.00 0.00 -0.15 0.00 0.00 58.65 58.95 1ucv h GLN 43 Cb 1.00 0.04 0.00 0.00 1.07 0.00 0.00 27.48 29.59 1ucv h GLN 43 CO -0.60 -0.12 -0.03 -0.44 -2.65 0.00 0.00 178.83 175.00 1ucv h ASP 44 N -0.18 -0.08 -0.33 -0.69 3.32 0.11 -3.25 116.42 115.32 1ucv h ASP 44 Ca 0.14 -0.51 0.07 0.00 0.02 0.00 0.00 57.03 56.75 1ucv h ASP 44 Cb 0.39 0.02 -0.08 0.00 0.22 0.00 0.00 39.33 39.88 1ucv h ASP 44 CO -0.36 0.51 -0.37 0.58 -1.72 0.00 0.00 179.24 177.88 1ucv h VAL 45 N -0.70 0.19 -0.87 -1.35 2.07 -0.72 -0.89 116.25 113.98 1ucv h VAL 45 Ca -0.01 0.00 0.21 0.00 0.82 0.00 0.00 66.70 67.73 1ucv h VAL 45 Cb 0.58 0.19 -0.16 0.00 -1.52 0.00 0.00 31.29 30.38 1ucv h VAL 45 CO 0.02 0.00 0.00 -0.09 0.02 0.00 0.00 177.57 177.52 1ucv h ARG 46 N -0.33 0.06 -0.82 1.57 1.12 -0.51 0.96 114.38 116.44 1ucv h ARG 46 Ca 0.14 -0.00 0.18 0.00 -1.11 0.00 0.00 59.98 59.19 1ucv h ARG 46 Cb 0.57 -0.01 -0.06 0.00 -0.01 0.00 0.00 29.97 30.46 1ucv h ARG 46 CO -0.51 0.04 0.55 0.00 -3.11 0.00 0.00 179.97 176.95 1ucv h ALA 47 N 1.84 2.21 0.00 2.80 0.00 -1.19 0.29 119.26 125.20 1ucv h ALA 47 Ca 0.50 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.39 1ucv h ALA 47 Cb 0.93 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 1ucv h ALA 47 CO -0.79 -0.45 -0.10 -0.07 0.00 0.00 0.00 179.25 177.84 1ucv h LEU 48 N 0.38 0.00 0.00 0.00 3.38 0.11 -3.46 115.31 115.72 1ucv h LEU 48 Ca 0.42 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.39 1ucv h LEU 48 Cb 1.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.79 1ucv h LEU 48 CO -0.14 0.10 0.00 0.61 0.09 0.00 0.00 178.44 179.11 1ucv n GLY 49 N -1.06 0.75 3.55 0.83 0.00 0.10 -4.81 105.19 104.54 1ucv n GLY 49 Ca -0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.88 3.30 -0.03 -0.61 1.09 -1.26 -4.68 121.20 118.14 1ucv s ILE 50 Ca 0.00 0.17 0.03 0.00 -1.10 0.00 0.00 60.65 59.75 1ucv s ILE 50 Cb 0.00 -3.79 -0.05 0.00 -1.06 0.00 0.00 42.46 37.57 1ucv s ILE 50 CO 0.00 -0.76 0.03 0.35 -0.10 0.00 0.00 174.94 174.46 1ucv n THR 51 N 7.34 0.17 -1.49 2.92 -2.24 -1.26 -4.17 114.28 115.56 1ucv n THR 51 Ca 0.23 -0.13 -0.52 0.00 -2.27 0.00 0.00 64.05 61.36 1ucv n THR 51 Cb 0.53 -0.57 -0.07 0.00 -2.10 0.00 0.00 70.33 68.11 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 2.18 -0.32 3.22 4.77 -1.26 -4.63 117.00 118.97 1ucv n LEU 52 Ca -0.04 0.57 0.17 0.00 -0.03 0.00 0.00 56.01 56.68 1ucv n LEU 52 Cb 0.48 -1.23 0.34 0.00 -2.33 0.00 0.00 43.42 40.68 1ucv n LEU 52 CO 0.07 -0.64 0.91 0.24 -1.33 0.00 0.00 177.39 176.65 1ucv h MET 53 N 11.13 0.10 -0.89 3.23 2.86 -1.97 0.94 114.93 130.33 1ucv h MET 53 Ca -0.31 -0.01 0.19 0.00 -2.06 0.00 0.00 59.70 57.52 1ucv h MET 53 Cb 1.32 -0.02 -0.07 0.00 0.06 0.00 0.00 31.60 32.89 1ucv h MET 53 CO 1.01 0.06 0.58 0.78 1.06 0.00 0.00 176.91 180.41 1ucv h GLY 54 N 0.10 0.95 0.00 8.32 0.00 -2.01 -1.69 103.07 108.75 1ucv h GLY 54 Ca 0.62 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.74 1ucv h GLY 54 CO -0.77 0.01 -0.78 1.42 0.00 0.00 0.00 176.54 176.41 1ucv n HIS 55 N -4.53 0.40 -0.28 5.60 8.25 0.28 -4.17 115.22 120.78 1ucv n HIS 55 Ca 0.19 0.17 0.27 0.00 -0.26 0.00 0.00 57.72 58.09 1ucv n HIS 55 Cb 0.64 -0.61 0.50 0.00 1.12 0.00 0.00 29.99 31.63 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 -4.51 -0.05 -0.19 -0.41 6.02 0.13 0.24 117.38 118.61 1ucv n GLN 56 Ca -0.11 1.15 -0.08 0.00 -0.01 0.00 0.00 57.00 57.95 1ucv n GLN 56 Cb 0.41 -2.07 0.02 0.00 1.02 0.00 0.00 30.24 29.61 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 0.79 0.23 -1.09 1.79 -1.50 -1.79 116.57 115.00 1ucv h LYS 57 Ca 0.71 -0.13 -0.01 0.00 -2.18 0.00 0.00 60.65 59.04 1ucv h LYS 57 Cb 1.91 -0.14 0.00 0.00 -1.58 0.00 0.00 32.23 32.43 1ucv h LYS 57 CO -0.63 0.67 -0.11 0.87 -1.08 0.00 0.00 179.45 179.17 1ucv h LYS 58 N 0.73 -0.30 -0.33 3.15 6.56 0.28 0.64 116.57 127.30 1ucv h LYS 58 Ca 0.18 0.02 0.04 0.00 -1.06 0.00 0.00 60.65 59.83 1ucv h LYS 58 Cb 0.16 0.07 -0.06 0.00 -0.57 0.00 0.00 32.23 31.82 1ucv h LYS 58 CO -0.02 -0.20 -0.42 0.82 -2.06 0.00 0.00 179.45 177.57 1ucv h ILE 59 N -0.31 0.00 0.25 1.86 2.04 -1.52 0.50 117.51 120.32 1ucv h ILE 59 Ca -0.03 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.84 1ucv h ILE 59 Cb 0.24 0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 36.29 1ucv h ILE 59 CO 0.05 0.00 -0.38 -0.07 0.00 0.00 0.00 178.15 177.75 1ucv h LEU 60 N -0.28 -1.08 -1.47 1.44 3.38 -1.39 0.24 115.31 116.15 1ucv h LEU 60 Ca 0.06 0.11 0.23 0.00 0.09 0.00 0.00 57.88 58.37 1ucv h LEU 60 Cb 0.43 0.39 -0.08 0.00 0.09 0.00 0.00 40.66 41.49 1ucv h LEU 60 CO -0.46 -0.49 0.63 1.23 0.09 0.00 0.00 178.44 179.44 1ucv h GLY 61 N -0.70 0.96 1.91 0.83 0.00 0.79 0.37 103.07 107.25 1ucv h GLY 61 Ca -0.00 -0.19 -0.21 0.00 0.00 0.00 0.00 47.33 46.93 1ucv h GLY 61 CO -0.15 -0.05 -0.99 0.23 0.00 0.00 0.00 176.54 175.59 1ucv h SER 62 N 0.39 0.10 0.18 0.19 0.87 0.88 -3.29 113.55 112.88 1ucv h SER 62 Ca 0.52 -0.10 -0.01 0.00 -1.23 0.00 0.00 61.79 60.97 1ucv h SER 62 Cb 1.33 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 63.26 1ucv h SER 62 CO -0.21 1.02 -0.09 0.40 -0.53 0.00 0.00 176.83 177.42 1ucv h ILE 63 N 0.02 0.29 -1.05 2.23 2.04 0.26 -0.51 117.51 120.80 1ucv h ILE 63 Ca -0.03 -0.98 0.43 0.00 1.00 0.00 0.00 64.86 65.28 1ucv h ILE 63 Cb 1.71 0.52 -0.17 0.00 -0.74 0.00 0.00 36.82 38.14 1ucv h ILE 63 CO 0.14 0.09 0.59 0.00 0.00 0.00 0.00 178.15 178.97 1ucv n GLN 64 N -4.93 -0.06 0.04 2.37 -0.00 0.98 0.23 117.38 116.02 1ucv n GLN 64 Ca -0.05 1.35 -0.22 0.00 -0.00 0.00 0.00 57.00 58.09 1ucv n GLN 64 Cb 0.16 -2.46 -0.14 0.00 -0.00 0.00 0.00 30.24 27.80 1ucv n GLN 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1ucv h THR 65 N 0.00 1.12 -0.88 -0.39 1.03 -1.64 -2.78 112.91 109.37 1ucv h THR 65 Ca 0.85 -2.46 0.13 0.00 -0.01 0.00 0.00 66.41 64.91 1ucv h THR 65 Cb 2.33 2.83 -0.07 0.00 -1.07 0.00 0.00 68.15 72.17 1ucv h THR 65 CO -0.72 0.74 0.57 0.24 -0.01 0.00 0.00 175.52 176.34 1ucv h MET 66 N -0.22 0.72 0.13 0.00 2.86 0.15 -1.45 114.93 117.13 1ucv h MET 66 Ca -0.28 -0.04 -0.28 0.00 -2.06 0.00 0.00 59.70 57.03 1ucv h MET 66 Cb 1.83 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 33.33 1ucv h MET 66 CO 0.11 0.48 -1.32 0.07 1.06 0.00 0.00 176.91 177.30 1ucv h ARG 67 N 0.74 0.28 -0.95 1.72 0.11 -0.65 -3.32 114.38 112.31 1ucv h ARG 67 Ca 0.43 -0.48 0.28 0.00 0.10 0.00 0.00 59.98 60.32 1ucv h ARG 67 Cb 0.61 0.18 -0.15 0.00 1.11 0.00 0.00 29.97 31.72 1ucv h ARG 67 CO -0.19 1.20 0.40 0.00 0.10 0.00 0.00 179.97 181.48 1ucv h ALA 68 N 0.54 1.63 -0.89 0.08 0.00 -0.96 0.23 119.26 119.89 1ucv h ALA 68 Ca -0.17 0.21 0.24 0.00 0.00 0.00 0.00 54.91 55.20 1ucv h ALA 68 Cb 1.99 0.24 -0.14 0.00 0.00 0.00 0.00 17.79 19.88 1ucv h ALA 68 CO 0.20 -0.53 0.24 -0.56 0.00 0.00 0.00 179.25 178.60 1ucv h GLN 69 N 0.26 0.19 -0.97 0.00 3.07 -1.63 0.51 115.11 116.54 1ucv h GLN 69 Ca 0.65 -0.01 0.13 0.00 0.09 0.00 0.00 58.65 59.51 1ucv h GLN 69 Cb 1.41 -0.04 -0.09 0.00 0.08 0.00 0.00 27.48 28.84 1ucv h GLN 69 CO -0.64 0.13 0.60 -0.07 0.09 0.00 0.00 178.83 178.93 1ucv h LEU 70 N 0.20 0.85 -6.31 0.06 3.38 -0.77 -3.38 115.31 109.34 1ucv h LEU 70 Ca 0.56 0.06 -0.19 0.00 0.09 0.00 0.00 57.88 58.40 1ucv h LEU 70 Cb 1.15 -0.11 -0.28 0.00 0.09 0.00 0.00 40.66 41.50 1ucv h LEU 70 CO -0.67 0.43 -0.54 0.28 0.09 0.00 0.00 178.44 178.04 1ucv s THR 71 N -5.96 -0.64 0.35 0.22 -1.32 0.18 -5.16 115.64 103.32 1ucv s THR 71 Ca -0.12 -0.30 0.08 0.00 -1.21 0.00 0.00 61.69 60.14 1ucv s THR 71 Cb 0.22 -0.99 -0.04 0.00 -1.51 0.00 0.00 72.50 70.18 1ucv s THR 71 CO 0.80 -0.29 0.16 -0.94 -2.21 0.00 0.00 174.62 172.14 1ucv s SER 72 N 2.54 4.67 0.30 8.08 1.04 -0.89 -4.73 113.70 124.72 1ucv s SER 72 Ca 0.10 -0.81 -0.15 0.00 0.48 0.00 0.00 55.95 55.57 1ucv s SER 72 Cb -0.12 -0.69 -0.09 0.00 0.10 0.00 0.00 66.02 65.22 1ucv s SER 72 CO -0.30 -0.34 0.72 0.28 0.98 0.00 0.00 173.24 174.57 1ucv s THR 73 N -2.45 4.69 -0.42 2.02 -1.32 -1.26 -5.03 115.64 111.87 1ucv s THR 73 Ca 0.39 0.93 -0.27 0.00 -1.21 0.00 0.00 61.69 61.53 1ucv s THR 73 Cb -0.02 -3.63 0.02 0.00 -1.51 0.00 0.00 72.50 67.36 1ucv s THR 73 CO 0.23 -0.14 0.98 -1.10 -2.21 0.00 0.00 174.62 172.38 1ucv s GLN 74 N -2.88 3.72 0.00 7.08 -0.21 -1.26 -4.93 119.66 121.17 1ucv s GLN 74 Ca 0.53 0.45 0.00 0.00 0.02 0.00 0.00 55.36 56.36 1ucv s GLN 74 Cb -0.11 -3.87 0.00 0.00 1.00 0.00 0.00 33.01 30.04 1ucv s GLN 74 CO 0.18 -1.14 0.00 0.41 -2.12 0.00 0.00 175.29 172.62 1ucv n GLY 75 N 4.65 -0.19 3.01 3.09 0.00 -1.26 -5.11 105.19 109.39 1ucv n GLY 75 Ca 0.08 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.00 1ucv n GLY 75 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ucv s SER 76 N -0.78 0.09 -0.22 1.61 1.04 -1.26 -5.11 113.70 109.07 1ucv s SER 76 Ca 0.00 -0.24 -0.29 0.00 0.48 0.00 0.00 55.95 55.91 1ucv s SER 76 Cb 0.00 0.15 -0.04 0.00 0.10 0.00 0.00 66.02 66.23 1ucv s SER 76 CO 0.00 -0.25 1.94 -0.83 0.98 0.00 0.00 173.24 175.08 1ucv s GLY 77 N -1.04 0.85 1.06 7.32 0.00 -1.26 -4.96 107.32 109.30 1ucv s GLY 77 Ca -0.11 0.64 -0.17 0.00 0.00 0.00 0.00 44.72 45.08 1ucv s GLY 77 CO 0.00 3.45 0.13 -1.05 0.00 0.00 0.00 173.10 175.63 1ucv n PRO 78 N 8.29 -1.14 -4.47 2.90 -0.02 -1.26 -5.04 135.00 134.27 1ucv n PRO 78 Ca 0.24 -0.31 -0.25 0.00 -2.02 0.00 0.00 63.50 61.16 1ucv n PRO 78 Cb 0.45 -1.75 -0.10 0.00 -0.02 0.00 0.00 33.50 32.09 1ucv n PRO 78 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1ucv s SER 79 N -1.89 3.89 0.03 2.55 1.04 -1.26 -5.15 113.70 112.90 1ucv s SER 79 Ca 0.56 -1.11 0.05 0.00 0.48 0.00 0.00 55.95 55.93 1ucv s SER 79 Cb -0.15 -0.41 -0.03 0.00 0.10 0.00 0.00 66.02 65.52 1ucv s SER 79 CO 0.67 -0.20 -0.11 -0.55 0.98 0.00 0.00 173.24 174.03 1ucv s SER 80 N -3.64 4.28 0.00 7.02 0.15 -1.26 -5.33 113.70 114.93 1ucv s SER 80 Ca 0.33 -0.27 0.00 0.00 0.70 0.00 0.00 55.95 56.71 1ucv s SER 80 Cb 0.01 -0.88 0.00 0.00 -1.71 0.00 0.00 66.02 63.44 1ucv s SER 80 CO 0.17 0.26 0.00 0.61 1.20 0.00 0.00 173.24 175.49