#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 6.84 0.10 1.61 1.04 -1.26 -4.92 113.70 117.11 1ucv s SER 2 Ca 0.00 0.88 -0.17 0.00 0.48 0.00 0.00 55.95 57.14 1ucv s SER 2 Cb 0.00 -2.53 -0.06 0.00 0.10 0.00 0.00 66.02 63.53 1ucv s SER 2 CO 0.00 -0.94 1.55 0.77 0.98 0.00 0.00 173.24 175.60 1ucv h SER 3 N 8.34 0.52 0.00 7.02 4.64 -2.07 -3.50 113.55 128.51 1ucv h SER 3 Ca -0.21 -0.29 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 1ucv h SER 3 Cb 1.06 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 1ucv h SER 3 CO 1.04 0.69 0.00 0.61 -0.87 0.00 0.00 176.83 178.30 1ucv n GLY 4 N -0.38 0.46 3.75 -0.77 0.00 -1.26 -5.09 105.19 101.90 1ucv n GLY 4 Ca -0.02 -0.37 -0.38 0.00 0.00 0.00 0.00 46.02 45.25 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 -4.00 6.76 -0.21 1.61 1.04 -1.26 -5.06 113.70 112.59 1ucv s SER 5 Ca 0.00 0.90 -0.18 0.00 0.48 0.00 0.00 55.95 57.15 1ucv s SER 5 Cb 0.00 -2.30 -0.03 0.00 0.10 0.00 0.00 66.02 63.79 1ucv s SER 5 CO 0.00 0.07 0.51 -0.55 0.98 0.00 0.00 173.24 174.25 1ucv s SER 6 N 0.21 6.54 -0.45 7.02 0.15 -1.26 -4.97 113.70 120.95 1ucv s SER 6 Ca 0.27 0.65 0.03 0.00 0.70 0.00 0.00 55.95 57.60 1ucv s SER 6 Cb -0.16 -2.29 0.24 0.00 -1.71 0.00 0.00 66.02 62.10 1ucv s SER 6 CO 0.12 -0.19 0.96 0.61 1.20 0.00 0.00 173.24 175.95 1ucv n GLY 7 N 3.94 -0.60 3.75 9.45 0.00 -1.26 -5.10 105.19 115.37 1ucv n GLY 7 Ca -0.05 0.47 -0.28 0.00 0.00 0.00 0.00 46.02 46.17 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 1.87 0.00 -4.75 0.99 -0.00 -1.26 -5.14 117.00 108.71 1ucv n LEU 8 Ca 0.09 -2.93 -0.32 0.00 -0.00 0.00 0.00 56.01 52.84 1ucv n LEU 8 Cb 0.64 0.06 -0.07 0.00 -0.00 0.00 0.00 43.42 44.04 1ucv n LEU 8 CO -0.02 -0.55 -0.27 0.28 -0.00 0.00 0.00 177.39 176.82 1ucv s THR 9 N -2.75 4.53 0.49 1.47 -1.32 -1.26 -4.29 115.64 112.51 1ucv s THR 9 Ca 0.23 -0.52 0.36 0.00 -1.21 0.00 0.00 61.69 60.55 1ucv s THR 9 Cb -0.02 -3.07 0.53 0.00 -1.51 0.00 0.00 72.50 68.42 1ucv s THR 9 CO 0.15 0.32 1.24 0.52 -2.21 0.00 0.00 174.62 174.64 1ucv n VAL 10 N 1.13 0.00 -0.03 5.08 0.31 -1.25 0.15 118.33 123.72 1ucv n VAL 10 Ca -0.13 1.19 -0.14 0.00 -0.01 0.00 0.00 64.34 65.26 1ucv n VAL 10 Cb 0.53 -2.04 -0.10 0.00 -0.91 0.00 0.00 33.84 31.32 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 0.18 0.20 2.92 0.00 -1.90 -2.64 103.07 101.83 1ucv h GLY 11 Ca 0.67 -0.24 -0.00 0.00 0.00 0.00 0.00 47.33 47.76 1ucv h GLY 11 CO -0.01 0.21 -0.33 -0.55 0.00 0.00 0.00 176.54 175.87 1ucv h ASP 12 N -0.39 -0.94 0.07 0.19 5.19 0.95 0.31 116.42 121.79 1ucv h ASP 12 Ca -0.01 0.09 0.02 0.00 -0.62 0.00 0.00 57.03 56.51 1ucv h ASP 12 Cb 0.77 0.33 -0.05 0.00 0.18 0.00 0.00 39.33 40.56 1ucv h ASP 12 CO 0.03 -0.39 -0.53 -0.25 -3.12 0.00 0.00 179.24 174.98 1ucv h TRP 13 N -0.56 -1.55 -0.63 4.55 7.01 -1.67 -2.02 115.95 121.09 1ucv h TRP 13 Ca -0.02 0.04 0.13 0.00 2.11 0.00 0.00 58.89 61.15 1ucv h TRP 13 Cb 0.51 0.67 -0.11 0.00 -2.10 0.00 0.00 29.16 28.13 1ucv h TRP 13 CO -0.29 -0.59 -0.09 -0.07 -2.79 0.00 0.00 178.44 174.61 1ucv h LEU 14 N -0.72 -0.46 -1.26 0.65 3.38 -1.39 0.24 115.31 115.76 1ucv h LEU 14 Ca 0.00 0.18 0.25 0.00 0.09 0.00 0.00 57.88 58.40 1ucv h LEU 14 Cb 0.74 0.34 -0.10 0.00 0.09 0.00 0.00 40.66 41.73 1ucv h LEU 14 CO -0.32 -0.17 0.65 -0.78 0.09 0.00 0.00 178.44 177.90 1ucv h ASP 15 N 0.04 0.53 -0.53 -0.43 3.58 0.34 0.27 116.42 120.21 1ucv h ASP 15 Ca 0.31 0.10 0.09 0.00 0.42 0.00 0.00 57.03 57.94 1ucv h ASP 15 Cb 0.50 0.01 -0.07 0.00 1.72 0.00 0.00 39.33 41.49 1ucv h ASP 15 CO -0.60 0.11 0.16 -1.28 -2.88 0.00 0.00 179.24 174.74 1ucv h SER 16 N 0.47 0.11 -0.38 2.28 0.87 -0.02 0.80 113.55 117.69 1ucv h SER 16 Ca 0.60 0.08 0.00 0.00 -1.23 0.00 0.00 61.79 61.24 1ucv h SER 16 Cb 1.38 0.09 0.00 0.00 -0.44 0.00 0.00 62.40 63.43 1ucv h SER 16 CO -0.34 0.08 0.00 2.30 -0.53 0.00 0.00 176.83 178.34 1ucv n ILE 17 N -5.06 1.34 -2.51 2.23 -5.35 0.14 -4.88 119.36 105.28 1ucv n ILE 17 Ca 0.07 -0.76 -0.18 0.00 -0.27 0.00 0.00 62.75 61.60 1ucv n ILE 17 Cb 0.25 -0.17 0.00 0.00 -1.74 0.00 0.00 39.64 37.98 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 0.51 -2.24 0.00 6.28 1.74 0.28 -4.87 116.66 118.35 1ucv n ARG 18 Ca 0.16 0.83 0.03 0.00 -0.77 0.00 0.00 57.85 58.10 1ucv n ARG 18 Cb 0.69 -5.34 0.02 0.00 -1.02 0.00 0.00 32.46 26.81 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 -2.94 -0.12 0.15 5.56 2.81 0.71 -4.63 117.12 118.66 1ucv n MET 19 Ca -0.18 -0.79 0.06 0.00 -1.81 0.00 0.00 57.70 54.99 1ucv n MET 19 Cb 0.64 -1.09 0.34 0.00 -0.71 0.00 0.00 33.22 32.40 1ucv n MET 19 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1ucv n GLY 20 N 0.32 -0.61 0.22 3.03 0.00 -1.03 -0.11 105.19 107.01 1ucv n GLY 20 Ca 0.03 0.12 0.08 0.00 0.00 0.00 0.00 46.02 46.25 1ucv n GLY 20 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1ucv h ARG 21 N 0.00 0.00 -0.01 1.61 0.11 -1.90 -2.37 114.38 111.82 1ucv h ARG 21 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1ucv h ARG 21 Cb 0.53 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.61 1ucv h ARG 21 CO 0.00 0.27 -0.45 0.66 0.10 0.00 0.00 179.97 180.55 1ucv n TYR 22 N -3.62 0.00 -0.29 4.08 4.01 0.84 -4.36 117.16 117.82 1ucv n TYR 22 Ca -0.01 0.00 0.02 0.00 -0.16 0.00 0.00 57.90 57.75 1ucv n TYR 22 Cb 0.40 -0.12 0.10 0.00 -0.31 0.00 0.00 39.34 39.40 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 0.93 -0.01 -0.99 -0.72 0.11 -1.47 0.86 114.38 113.09 1ucv h ARG 23 Ca 0.00 0.00 0.24 0.00 0.10 0.00 0.00 59.98 60.32 1ucv h ARG 23 Cb 0.54 0.00 -0.08 0.00 1.11 0.00 0.00 29.97 31.55 1ucv h ARG 23 CO 0.00 -0.01 0.65 0.22 0.10 0.00 0.00 179.97 180.93 1ucv h ASP 24 N -0.01 0.39 0.60 0.08 1.82 -1.78 -1.48 116.42 116.04 1ucv h ASP 24 Ca 0.39 0.06 -0.03 0.00 -0.39 0.00 0.00 57.03 57.05 1ucv h ASP 24 Cb 0.60 -0.01 0.01 0.00 0.68 0.00 0.00 39.33 40.61 1ucv h ASP 24 CO -0.85 0.11 -0.29 0.45 -1.61 0.00 0.00 179.24 177.05 1ucv h HIS 25 N 0.37 -0.75 -0.71 0.28 3.86 0.46 -2.69 115.15 115.96 1ucv h HIS 25 Ca 0.54 -0.02 0.15 0.00 -1.16 0.00 0.00 60.37 59.88 1ucv h HIS 25 Cb 1.41 0.25 -0.13 0.00 1.06 0.00 0.00 27.41 30.00 1ucv h HIS 25 CO -0.00 -0.43 -0.09 0.74 0.86 0.00 0.00 177.93 179.01 1ucv h PHE 26 N -0.93 -0.22 -0.72 2.45 -1.00 -1.08 0.50 116.94 115.93 1ucv h PHE 26 Ca -0.08 0.06 0.10 0.00 2.81 0.00 0.00 57.97 60.86 1ucv h PHE 26 Cb 0.66 0.21 -0.05 0.00 3.61 0.00 0.00 35.95 40.38 1ucv h PHE 26 CO -0.01 -0.27 0.48 0.00 -1.61 0.00 0.00 178.31 176.90 1ucv h ALA 27 N 1.69 1.90 -0.05 2.45 0.00 -0.25 0.50 119.26 125.50 1ucv h ALA 27 Ca 0.36 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 55.10 1ucv h ALA 27 Cb 0.59 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1ucv h ALA 27 CO -0.68 -0.06 -0.72 0.00 0.00 0.00 0.00 179.25 177.80 1ucv h ALA 28 N 1.64 0.70 -0.01 0.00 0.00 0.27 -2.96 119.26 118.88 1ucv h ALA 28 Ca 0.34 -0.61 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1ucv h ALA 28 Cb 0.54 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1ucv h ALA 28 CO -0.12 0.80 0.00 0.41 0.00 0.00 0.00 179.25 180.34 1ucv n GLY 29 N 0.52 -0.91 0.46 0.00 0.00 -0.23 -4.82 105.19 100.21 1ucv n GLY 29 Ca -0.03 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.88 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 0.75 0.87 2.97 -0.02 0.00 -0.97 -5.05 105.19 103.74 1ucv n GLY 30 Ca 0.11 -0.11 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 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 3.36 -0.52 1.61 2.02 0.16 -4.90 117.35 117.07 1ucv s TYR 31 Ca 0.00 -2.74 0.10 0.00 -0.37 0.00 0.00 57.07 54.06 1ucv s TYR 31 Cb 0.00 -2.66 -0.10 0.00 -0.40 0.00 0.00 41.96 38.80 1ucv s TYR 31 CO 0.00 -0.93 0.45 0.43 -1.57 0.00 0.00 175.55 173.92 1ucv n SER 32 N 4.37 0.55 -4.54 2.29 7.64 -1.26 -0.19 113.62 122.48 1ucv n SER 32 Ca 0.02 -0.77 -0.25 0.00 1.01 0.00 0.00 58.87 58.88 1ucv n SER 32 Cb 0.42 0.95 -0.11 0.00 -1.01 0.00 0.00 64.21 64.46 1ucv n SER 32 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1ucv s SER 33 N -1.89 3.24 -0.03 6.43 0.01 -1.26 -3.76 113.70 116.44 1ucv s SER 33 Ca 0.04 -1.34 -0.22 0.00 1.31 0.00 0.00 55.95 55.74 1ucv s SER 33 Cb 0.08 -0.27 -0.28 0.00 0.21 0.00 0.00 66.02 65.77 1ucv s SER 33 CO 0.40 -0.48 0.98 -0.07 0.41 0.00 0.00 173.24 174.48 1ucv h LEU 34 N 1.95 0.46 -0.86 2.44 -0.00 -1.92 -3.07 115.31 114.31 1ucv h LEU 34 Ca -0.42 -0.87 0.22 0.00 -0.00 0.00 0.00 57.88 56.81 1ucv h LEU 34 Cb 1.24 -0.14 -0.14 0.00 -0.00 0.00 0.00 40.66 41.61 1ucv h LEU 34 CO 0.75 1.28 0.13 1.23 -0.00 0.00 0.00 178.44 181.83 1ucv h GLY 35 N -0.30 1.18 2.00 0.83 0.00 -1.97 0.91 103.07 105.71 1ucv h GLY 35 Ca -0.10 0.04 -0.04 0.00 0.00 0.00 0.00 47.33 47.23 1ucv h GLY 35 CO 0.13 -0.37 -0.21 0.00 0.00 0.00 0.00 176.54 176.08 1ucv h MET 36 N 0.14 0.00 0.00 4.80 -0.00 -1.98 -3.14 114.93 114.74 1ucv h MET 36 Ca 0.52 0.00 -0.17 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 32.59 1ucv h MET 36 CO -0.70 0.21 -0.81 0.28 -0.00 0.00 0.00 176.91 175.89 1ucv h VAL 37 N 0.00 1.50 0.00 -0.10 2.07 0.74 -3.15 116.25 117.32 1ucv h VAL 37 Ca -0.00 -2.85 -0.03 0.00 0.82 0.00 0.00 66.70 64.64 1ucv h VAL 37 Cb 1.01 2.57 -0.00 0.00 -1.52 0.00 0.00 31.29 33.34 1ucv h VAL 37 CO 0.03 0.79 -0.13 -0.07 0.02 0.00 0.00 177.57 178.21 1ucv h LEU 38 N 0.00 0.00 -2.87 2.57 4.07 -0.45 -2.17 115.31 116.46 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 1.51 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.25 1ucv h LEU 38 CO 0.11 0.13 0.00 -2.11 -1.08 0.00 0.00 178.44 175.49 1ucv n ARG 39 N -3.37 3.58 -2.72 1.13 1.85 -1.19 -4.88 116.66 111.07 1ucv n ARG 39 Ca -0.00 -2.58 -0.21 0.00 -1.00 0.00 0.00 57.85 54.05 1ucv n ARG 39 Cb 0.33 -1.88 0.06 0.00 -1.05 0.00 0.00 32.46 29.91 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 -1.92 2.32 0.22 2.89 -1.94 -0.82 -5.10 119.30 114.95 1ucv s MET 40 Ca 0.46 -1.03 -0.17 0.00 -1.71 0.00 0.00 55.69 53.24 1ucv s MET 40 Cb 0.30 -2.50 0.02 0.00 2.01 0.00 0.00 34.83 34.66 1ucv s MET 40 CO 0.21 -0.87 0.54 -0.80 -0.01 0.00 0.00 175.02 174.09 1ucv s ASN 41 N -4.53 -0.22 0.21 3.03 0.01 -1.26 -4.99 114.94 107.19 1ucv s ASN 41 Ca 0.60 -0.60 -0.03 0.00 -0.71 0.00 0.00 52.86 52.12 1ucv s ASN 41 Cb -0.08 0.60 0.41 0.00 0.41 0.00 0.00 41.25 42.59 1ucv s ASN 41 CO 0.39 -1.11 1.10 0.00 -1.51 0.00 0.00 177.10 175.97 1ucv n ALA 42 N -0.36 0.25 -0.23 0.60 0.00 -1.26 0.23 120.51 119.74 1ucv n ALA 42 Ca -0.07 0.77 0.01 0.00 0.00 0.00 0.00 53.44 54.15 1ucv n ALA 42 Cb 0.62 -0.50 0.13 0.00 0.00 0.00 0.00 19.45 19.70 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 0.49 0.35 0.00 1.08 -1.99 0.36 115.11 115.40 1ucv h GLN 43 Ca 0.38 -0.03 -0.02 0.00 -1.45 0.00 0.00 58.65 57.53 1ucv h GLN 43 Cb 0.67 -0.11 0.00 0.00 -0.05 0.00 0.00 27.48 27.99 1ucv h GLN 43 CO -0.70 0.32 -0.17 -0.44 -0.95 0.00 0.00 178.83 176.90 1ucv h ASP 44 N 0.50 -0.40 -0.48 1.46 5.19 0.25 -3.09 116.42 119.86 1ucv h ASP 44 Ca 0.34 0.01 0.09 0.00 -0.62 0.00 0.00 57.03 56.86 1ucv h ASP 44 Cb 0.41 0.10 -0.10 0.00 0.18 0.00 0.00 39.33 39.92 1ucv h ASP 44 CO -0.30 0.01 -0.27 0.58 -3.12 0.00 0.00 179.24 176.14 1ucv h VAL 45 N -1.05 0.28 -0.81 -1.35 2.07 -0.88 0.02 116.25 114.53 1ucv h VAL 45 Ca -0.05 0.00 0.19 0.00 0.82 0.00 0.00 66.70 67.66 1ucv h VAL 45 Cb 0.36 0.28 -0.12 0.00 -1.52 0.00 0.00 31.29 30.28 1ucv h VAL 45 CO 0.08 0.00 0.23 -0.09 0.02 0.00 0.00 177.57 177.81 1ucv h ARG 46 N -0.16 0.27 -0.54 1.57 1.12 -0.41 0.51 114.38 116.73 1ucv h ARG 46 Ca 0.21 -0.02 0.11 0.00 -1.11 0.00 0.00 59.98 59.17 1ucv h ARG 46 Cb 0.51 -0.06 -0.03 0.00 -0.01 0.00 0.00 29.97 30.38 1ucv h ARG 46 CO -0.58 0.18 0.37 0.00 -3.11 0.00 0.00 179.97 176.83 1ucv h ALA 47 N 1.68 2.13 0.00 2.80 0.00 -0.90 0.13 119.26 125.11 1ucv h ALA 47 Ca 0.48 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.37 1ucv h ALA 47 Cb 0.88 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 1ucv h ALA 47 CO -0.56 -0.26 -0.05 -0.07 0.00 0.00 0.00 179.25 178.31 1ucv h LEU 48 N 0.28 0.00 0.00 0.00 3.38 0.27 -3.46 115.31 115.78 1ucv h LEU 48 Ca 0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.22 1ucv h LEU 48 Cb 0.62 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1ucv h LEU 48 CO -0.06 0.05 0.00 0.61 0.09 0.00 0.00 178.44 179.14 1ucv n GLY 49 N -0.85 1.53 3.57 0.83 0.00 0.46 -4.82 105.19 105.92 1ucv n GLY 49 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 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 -1.55 3.67 -0.00 -0.61 1.09 -1.25 -4.72 121.20 117.83 1ucv s ILE 50 Ca 0.00 0.53 0.00 0.00 -1.10 0.00 0.00 60.65 60.08 1ucv s ILE 50 Cb 0.00 -4.34 -0.00 0.00 -1.06 0.00 0.00 42.46 37.06 1ucv s ILE 50 CO 0.00 -1.15 0.00 0.35 -0.10 0.00 0.00 174.94 174.04 1ucv n THR 51 N 6.91 0.00 -1.59 2.92 -2.24 -1.26 -4.01 114.28 115.01 1ucv n THR 51 Ca 0.14 -0.00 -0.54 0.00 -2.27 0.00 0.00 64.05 61.37 1ucv n THR 51 Cb 0.50 -0.08 -0.07 0.00 -2.10 0.00 0.00 70.33 68.58 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 -1.70 2.43 -0.25 3.22 4.32 -1.26 -4.61 117.00 119.14 1ucv n LEU 52 Ca -0.00 0.80 -0.03 0.00 -0.02 0.00 0.00 56.01 56.77 1ucv n LEU 52 Cb 0.20 -1.22 0.04 0.00 -1.62 0.00 0.00 43.42 40.82 1ucv n LEU 52 CO 0.00 -0.48 0.64 0.24 -1.22 0.00 0.00 177.39 176.57 1ucv h MET 53 N 9.52 -0.09 -0.48 3.23 2.86 -1.97 1.02 114.93 129.03 1ucv h MET 53 Ca -0.38 0.01 0.14 0.00 -2.06 0.00 0.00 59.70 57.40 1ucv h MET 53 Cb 1.31 0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.98 1ucv h MET 53 CO 0.99 -0.06 0.50 0.78 1.06 0.00 0.00 176.91 180.18 1ucv h GLY 54 N -0.09 0.00 0.00 8.32 0.00 -2.00 -0.95 103.07 108.35 1ucv h GLY 54 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.62 1ucv h GLY 54 CO -0.77 0.00 -0.45 1.42 0.00 0.00 0.00 176.54 176.74 1ucv n HIS 55 N -3.73 0.11 -0.33 5.60 -0.00 0.29 -4.19 115.22 112.96 1ucv n HIS 55 Ca 0.09 0.05 0.18 0.00 -0.00 0.00 0.00 57.72 58.03 1ucv n HIS 55 Cb 0.69 -0.31 0.34 0.00 -0.00 0.00 0.00 29.99 30.71 1ucv n HIS 55 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.34 177.38 1ucv n GLN 56 N -3.48 -0.07 -0.35 -0.41 6.02 0.24 0.20 117.38 119.51 1ucv n GLN 56 Ca -0.06 1.42 0.05 0.00 -0.01 0.00 0.00 57.00 58.39 1ucv n GLN 56 Cb 0.23 -2.31 0.21 0.00 1.02 0.00 0.00 30.24 29.40 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 1.05 0.42 -1.09 1.79 -1.36 0.40 116.57 117.78 1ucv h LYS 57 Ca 0.63 -0.06 -0.02 0.00 -2.18 0.00 0.00 60.65 59.02 1ucv h LYS 57 Cb 1.40 -0.24 0.00 0.00 -1.58 0.00 0.00 32.23 31.81 1ucv h LYS 57 CO -0.87 0.69 -0.20 0.87 -1.08 0.00 0.00 179.45 178.86 1ucv h LYS 58 N 1.08 -0.54 -0.40 3.15 1.79 0.20 0.19 116.57 122.04 1ucv h LYS 58 Ca 0.45 0.04 0.08 0.00 -2.18 0.00 0.00 60.65 59.03 1ucv h LYS 58 Cb 0.30 0.12 -0.09 0.00 -1.58 0.00 0.00 32.23 30.99 1ucv h LYS 58 CO -0.20 -0.36 -0.35 0.82 -1.08 0.00 0.00 179.45 178.28 1ucv h ILE 59 N -0.92 0.20 0.58 1.86 2.04 -1.21 1.16 117.51 121.22 1ucv h ILE 59 Ca -0.06 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.77 1ucv h ILE 59 Cb 0.43 0.20 0.01 0.00 -0.74 0.00 0.00 36.82 36.72 1ucv h ILE 59 CO 0.09 0.00 -0.28 -0.07 0.00 0.00 0.00 178.15 177.89 1ucv h LEU 60 N -0.27 -0.66 -2.56 1.44 3.38 -1.02 -1.79 115.31 113.83 1ucv h LEU 60 Ca 0.16 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.12 1ucv h LEU 60 Cb 0.55 0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.47 1ucv h LEU 60 CO -0.54 -0.38 0.09 1.23 0.09 0.00 0.00 178.44 178.93 1ucv h GLY 61 N -0.92 0.00 1.76 0.83 0.00 -0.23 0.72 103.07 105.23 1ucv h GLY 61 Ca -0.08 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.15 1ucv h GLY 61 CO 0.13 0.00 -0.64 0.23 0.00 0.00 0.00 176.54 176.26 1ucv h SER 62 N 0.00 0.00 0.00 0.19 0.87 0.17 -3.33 113.55 111.45 1ucv h SER 62 Ca 0.02 0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.54 1ucv h SER 62 Cb 0.20 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.16 1ucv h SER 62 CO -0.00 0.44 -0.36 0.40 -0.53 0.00 0.00 176.83 176.77 1ucv h ILE 63 N 0.00 0.65 -1.02 2.23 2.04 -0.03 -3.10 117.51 118.28 1ucv h ILE 63 Ca -0.03 -1.58 0.42 0.00 1.00 0.00 0.00 64.86 64.66 1ucv h ILE 63 Cb 1.36 1.32 -0.17 0.00 -0.74 0.00 0.00 36.82 38.59 1ucv h ILE 63 CO 0.05 0.22 0.57 0.00 0.00 0.00 0.00 178.15 178.99 1ucv n GLN 64 N -4.63 -0.06 0.08 2.37 10.64 -0.59 0.23 117.38 125.43 1ucv n GLN 64 Ca -0.11 1.34 -0.10 0.00 -1.83 0.00 0.00 57.00 56.30 1ucv n GLN 64 Cb 0.32 -2.43 -0.08 0.00 -0.86 0.00 0.00 30.24 27.20 1ucv n GLN 64 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1ucv h THR 65 N 0.00 1.57 -0.34 -0.39 1.03 -1.70 0.13 112.91 113.20 1ucv h THR 65 Ca 0.84 -3.01 -0.06 0.00 -0.01 0.00 0.00 66.41 64.16 1ucv h THR 65 Cb 2.27 2.72 -0.02 0.00 -1.07 0.00 0.00 68.15 72.06 1ucv h THR 65 CO -0.72 0.87 -0.06 0.24 -0.01 0.00 0.00 175.52 175.84 1ucv h MET 66 N 0.06 0.56 0.06 0.00 2.86 0.30 -3.17 114.93 115.60 1ucv h MET 66 Ca -0.06 -0.14 -0.35 0.00 -2.06 0.00 0.00 59.70 57.09 1ucv h MET 66 Cb 1.71 -0.07 -0.04 0.00 0.06 0.00 0.00 31.60 33.26 1ucv h MET 66 CO 0.15 0.63 -2.07 2.89 1.06 0.00 0.00 176.91 179.57 1ucv n ARG 67 N -4.23 0.70 -0.36 1.72 1.85 -0.20 -4.25 116.66 111.89 1ucv n ARG 67 Ca 0.01 0.22 0.32 0.00 -1.00 0.00 0.00 57.85 57.40 1ucv n ARG 67 Cb 0.29 -1.67 0.59 0.00 -1.05 0.00 0.00 32.46 30.62 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 0.39 2.30 -0.50 2.89 0.00 -0.71 0.90 119.26 124.52 1ucv h ALA 68 Ca -0.44 0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 1ucv h ALA 68 Cb 2.03 0.27 -0.02 0.00 0.00 0.00 0.00 17.79 20.06 1ucv h ALA 68 CO 0.04 -1.02 0.22 -0.56 0.00 0.00 0.00 179.25 177.93 1ucv h GLN 69 N 0.08 0.74 -0.03 0.00 3.07 -1.73 0.53 115.11 117.77 1ucv h GLN 69 Ca 0.83 -0.12 0.01 0.00 0.09 0.00 0.00 58.65 59.46 1ucv h GLN 69 Cb 2.26 -0.12 -0.03 0.00 0.08 0.00 0.00 27.48 29.66 1ucv h GLN 69 CO -0.65 0.64 -0.30 -0.07 0.09 0.00 0.00 178.83 178.54 1ucv h LEU 70 N 0.67 -0.94 -0.64 0.06 3.38 0.63 -2.60 115.31 115.87 1ucv h LEU 70 Ca 0.17 0.11 -0.02 0.00 0.09 0.00 0.00 57.88 58.22 1ucv h LEU 70 Cb 0.16 0.36 -0.03 0.00 0.09 0.00 0.00 40.66 41.25 1ucv h LEU 70 CO -0.02 -0.28 0.30 0.00 0.09 0.00 0.00 178.44 178.53 1ucv h THR 71 N -0.36 1.22 -2.80 0.22 1.03 -1.54 -3.43 112.91 107.25 1ucv h THR 71 Ca 0.01 -0.63 -0.53 0.00 -0.01 0.00 0.00 66.41 65.26 1ucv h THR 71 Cb 0.40 0.46 0.04 0.00 -1.07 0.00 0.00 68.15 67.97 1ucv h THR 71 CO -0.22 0.26 0.90 -0.55 -0.01 0.00 0.00 175.52 175.90 1ucv s SER 72 N -6.05 6.60 -0.14 0.00 0.15 0.17 -4.89 113.70 109.54 1ucv s SER 72 Ca -0.13 2.58 -0.32 0.00 0.70 0.00 0.00 55.95 58.78 1ucv s SER 72 Cb 0.13 -2.59 -0.09 0.00 -1.71 0.00 0.00 66.02 61.77 1ucv s SER 72 CO 0.79 -0.83 2.06 0.41 1.20 0.00 0.00 173.24 176.87 1ucv n THR 73 N 4.12 0.49 -3.43 6.45 -1.04 -1.26 -4.78 114.28 114.83 1ucv n THR 73 Ca 0.14 -0.25 -0.14 0.00 -2.04 0.00 0.00 64.05 61.76 1ucv n THR 73 Cb 0.39 -2.16 -0.11 0.00 -1.82 0.00 0.00 70.33 66.64 1ucv n THR 73 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 1ucv s GLN 74 N 5.22 0.26 -0.12 -2.82 -0.21 -1.26 -5.13 119.66 115.60 1ucv s GLN 74 Ca 0.97 0.36 -0.04 0.00 0.02 0.00 0.00 55.36 56.67 1ucv s GLN 74 Cb -0.55 -0.88 -0.03 0.00 1.00 0.00 0.00 33.01 32.55 1ucv s GLN 74 CO 0.44 -0.65 0.03 0.20 -2.12 0.00 0.00 175.29 173.19 1ucv s GLY 75 N 2.43 1.88 -0.18 3.09 0.00 -1.26 -5.09 107.32 108.18 1ucv s GLY 75 Ca 0.09 -0.77 -0.05 0.00 0.00 0.00 0.00 44.72 43.99 1ucv s GLY 75 CO -0.14 -0.34 0.35 -1.35 0.00 0.00 0.00 173.10 171.63 1ucv s SER 76 N -0.44 0.10 -0.52 1.64 1.04 -1.26 -5.11 113.70 109.15 1ucv s SER 76 Ca 0.09 0.69 -0.04 0.00 0.48 0.00 0.00 55.95 57.17 1ucv s SER 76 Cb -0.12 1.05 0.14 0.00 0.10 0.00 0.00 66.02 67.18 1ucv s SER 76 CO 0.02 -0.25 0.33 -0.83 0.98 0.00 0.00 173.24 173.49 1ucv s GLY 77 N 2.52 2.24 1.11 7.32 0.00 -1.26 -5.09 107.32 114.16 1ucv s GLY 77 Ca 0.02 -2.88 -0.16 0.00 0.00 0.00 0.00 44.72 41.71 1ucv s GLY 77 CO -0.12 1.07 0.47 -1.05 0.00 0.00 0.00 173.10 173.47 1ucv n PRO 78 N 4.11 -2.84 -3.80 2.90 -0.02 -1.26 -5.06 135.00 129.03 1ucv n PRO 78 Ca 0.02 -0.84 -0.11 0.00 -2.02 0.00 0.00 63.50 60.55 1ucv n PRO 78 Cb 0.40 -1.58 -0.08 0.00 -0.02 0.00 0.00 33.50 32.22 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 -2.22 -0.04 0.13 2.55 1.04 -1.26 -5.15 113.70 108.75 1ucv s SER 79 Ca 0.43 -0.31 -0.30 0.00 0.48 0.00 0.00 55.95 56.25 1ucv s SER 79 Cb -0.08 0.33 -0.06 0.00 0.10 0.00 0.00 66.02 66.31 1ucv s SER 79 CO 0.38 -0.60 0.99 -0.55 0.98 0.00 0.00 173.24 174.43 1ucv s SER 80 N -2.16 7.46 0.00 7.02 0.15 -1.26 -5.26 113.70 119.66 1ucv s SER 80 Ca -0.04 1.85 0.00 0.00 0.70 0.00 0.00 55.95 58.46 1ucv s SER 80 Cb -0.00 -2.59 0.00 0.00 -1.71 0.00 0.00 66.02 61.71 1ucv s SER 80 CO -0.04 -0.09 0.00 0.61 1.20 0.00 0.00 173.24 174.92