#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 -5.84 -3.83 1.61 2.88 -1.26 -5.01 113.62 102.17 1ucv n SER 2 Ca 0.00 -0.51 -0.19 0.00 -1.33 0.00 0.00 58.87 56.84 1ucv n SER 2 Cb 0.00 -4.73 -0.17 0.00 -0.75 0.00 0.00 64.21 58.57 1ucv n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1ucv s SER 3 N -3.36 0.86 -1.09 -3.46 0.15 -1.26 -5.05 113.70 100.50 1ucv s SER 3 Ca 0.51 -0.07 -0.12 0.00 0.70 0.00 0.00 55.95 56.98 1ucv s SER 3 Cb -0.23 -0.34 -0.07 0.00 -1.71 0.00 0.00 66.02 63.67 1ucv s SER 3 CO 0.68 -0.11 2.24 0.61 1.20 0.00 0.00 173.24 177.87 1ucv n GLY 4 N 4.33 3.38 3.75 9.45 0.00 -1.26 -4.92 105.19 119.92 1ucv n GLY 4 Ca -0.21 -1.18 -0.41 0.00 0.00 0.00 0.00 46.02 44.21 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 3.54 6.66 0.12 1.61 1.04 -1.26 -5.02 113.70 120.39 1ucv s SER 5 Ca 0.51 2.68 0.02 0.00 0.48 0.00 0.00 55.95 59.64 1ucv s SER 5 Cb 0.13 -2.63 -0.04 0.00 0.10 0.00 0.00 66.02 63.59 1ucv s SER 5 CO -0.01 -0.69 0.20 -0.94 0.98 0.00 0.00 173.24 172.79 1ucv s SER 6 N 0.24 6.07 0.00 7.02 1.04 -1.26 -4.68 113.70 122.13 1ucv s SER 6 Ca 0.58 0.12 0.00 0.00 0.48 0.00 0.00 55.95 57.12 1ucv s SER 6 Cb -0.42 -1.77 0.00 0.00 0.10 0.00 0.00 66.02 63.93 1ucv s SER 6 CO 0.45 0.11 0.00 0.61 0.98 0.00 0.00 173.24 175.39 1ucv n GLY 7 N -0.12 0.74 2.32 7.32 0.00 -1.26 -5.11 105.19 109.08 1ucv n GLY 7 Ca -0.07 -0.23 -0.20 0.00 0.00 0.00 0.00 46.02 45.52 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 -0.29 0.00 -4.62 0.99 -0.00 -1.26 -5.13 117.00 106.68 1ucv n LEU 8 Ca 0.00 -1.99 -0.30 0.00 -0.00 0.00 0.00 56.01 53.71 1ucv n LEU 8 Cb 0.20 0.19 -0.09 0.00 -0.00 0.00 0.00 43.42 43.72 1ucv n LEU 8 CO 0.00 -0.31 -0.38 0.28 -0.00 0.00 0.00 177.39 176.98 1ucv s THR 9 N -2.10 3.69 0.46 1.47 -1.32 -1.26 -4.09 115.64 112.49 1ucv s THR 9 Ca 0.03 -1.04 0.34 0.00 -1.21 0.00 0.00 61.69 59.81 1ucv s THR 9 Cb -0.00 -2.71 0.50 0.00 -1.51 0.00 0.00 72.50 68.77 1ucv s THR 9 CO 0.02 0.19 1.18 0.52 -2.21 0.00 0.00 174.62 174.31 1ucv n VAL 10 N 0.86 0.00 -0.04 5.08 0.31 -1.25 0.14 118.33 123.44 1ucv n VAL 10 Ca -0.13 1.13 -0.14 0.00 -0.01 0.00 0.00 64.34 65.19 1ucv n VAL 10 Cb 0.52 -1.93 -0.11 0.00 -0.91 0.00 0.00 33.84 31.41 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 0.06 -0.00 2.92 0.00 -1.92 -2.78 103.07 101.35 1ucv h GLY 11 Ca 0.63 -0.09 0.01 0.00 0.00 0.00 0.00 47.33 47.87 1ucv h GLY 11 CO -0.01 0.08 -0.26 -1.80 0.00 0.00 0.00 176.54 174.55 1ucv h ASP 12 N -0.62 -0.81 0.07 0.19 1.82 0.89 0.50 116.42 118.46 1ucv h ASP 12 Ca -0.01 0.09 0.01 0.00 -0.39 0.00 0.00 57.03 56.74 1ucv h ASP 12 Cb 0.77 0.31 -0.04 0.00 0.68 0.00 0.00 39.33 41.04 1ucv h ASP 12 CO 0.01 -0.25 -0.42 -0.25 -1.61 0.00 0.00 179.24 176.72 1ucv h TRP 13 N -0.33 -1.23 -1.01 0.28 7.01 -1.69 -1.24 115.95 117.75 1ucv h TRP 13 Ca 0.01 0.03 0.27 0.00 2.11 0.00 0.00 58.89 61.31 1ucv h TRP 13 Cb 0.35 0.53 -0.13 0.00 -2.10 0.00 0.00 29.16 27.81 1ucv h TRP 13 CO -0.44 -0.47 0.60 -0.07 -2.79 0.00 0.00 178.44 175.27 1ucv h LEU 14 N -0.58 0.62 -1.04 0.65 3.38 -1.37 0.35 115.31 117.32 1ucv h LEU 14 Ca -0.00 0.15 0.15 0.00 0.09 0.00 0.00 57.88 58.26 1ucv h LEU 14 Cb 0.59 0.06 -0.09 0.00 0.09 0.00 0.00 40.66 41.31 1ucv h LEU 14 CO -0.25 0.04 0.62 -0.78 0.09 0.00 0.00 178.44 178.17 1ucv h ASP 15 N 0.50 0.86 -0.82 -0.43 1.82 0.12 0.59 116.42 119.07 1ucv h ASP 15 Ca 0.67 0.06 0.08 0.00 -0.39 0.00 0.00 57.03 57.45 1ucv h ASP 15 Cb 1.37 -0.10 -0.05 0.00 0.68 0.00 0.00 39.33 41.22 1ucv h ASP 15 CO -0.49 0.41 0.53 0.28 -1.61 0.00 0.00 179.24 178.36 1ucv h SER 16 N 0.89 0.74 -0.58 2.28 0.02 -0.00 0.66 113.55 117.56 1ucv h SER 16 Ca 0.52 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.48 1ucv h SER 16 Cb 0.65 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.04 1ucv h SER 16 CO -0.30 0.46 0.00 2.30 -1.14 0.00 0.00 176.83 178.16 1ucv n ILE 17 N -4.50 1.53 -2.31 3.27 -5.35 0.02 -4.91 119.36 107.10 1ucv n ILE 17 Ca 0.13 -1.01 -0.16 0.00 -0.27 0.00 0.00 62.75 61.44 1ucv n ILE 17 Cb 0.26 0.11 -0.01 0.00 -1.74 0.00 0.00 39.64 38.25 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 1.01 -1.94 -0.09 6.28 5.12 0.22 -4.81 116.66 122.45 1ucv n ARG 18 Ca 0.23 0.78 0.06 0.00 -1.93 0.00 0.00 57.85 56.98 1ucv n ARG 18 Cb 0.77 -5.36 0.10 0.00 -1.16 0.00 0.00 32.46 26.81 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 -2.79 1.76 0.29 5.56 2.81 -0.13 -4.59 117.12 120.02 1ucv n MET 19 Ca -0.18 -1.63 0.12 0.00 -1.81 0.00 0.00 57.70 54.19 1ucv n MET 19 Cb 0.63 -1.25 0.62 0.00 -0.71 0.00 0.00 33.22 32.51 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 2.13 0.00 2.00 3.03 0.00 -1.81 0.19 103.07 108.61 1ucv h GLY 20 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 1ucv h GLY 20 CO 0.00 0.00 -0.00 0.07 0.00 0.00 0.00 176.54 176.61 1ucv h ARG 21 N 0.00 0.00 0.00 4.80 0.11 -1.91 0.17 114.38 117.55 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 0.78 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.86 1ucv h ARG 21 CO 0.00 0.00 -0.81 0.66 0.10 0.00 0.00 179.97 179.93 1ucv n TYR 22 N -3.14 0.05 -0.34 4.08 4.01 0.67 -4.43 117.16 118.07 1ucv n TYR 22 Ca -0.02 0.02 -0.04 0.00 -0.16 0.00 0.00 57.90 57.70 1ucv n TYR 22 Cb 0.12 -0.20 0.01 0.00 -0.31 0.00 0.00 39.34 38.97 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 -0.05 -1.28 -0.72 2.43 -1.06 0.95 114.38 114.66 1ucv h ARG 23 Ca 0.00 0.00 0.39 0.00 -0.81 0.00 0.00 59.98 59.56 1ucv h ARG 23 Cb 0.55 0.01 -0.10 0.00 -0.42 0.00 0.00 29.97 30.01 1ucv h ARG 23 CO 0.00 -0.03 0.85 -0.44 -1.51 0.00 0.00 179.97 178.83 1ucv h ASP 24 N -0.05 0.25 0.75 -3.80 3.32 -1.77 -0.40 116.42 114.71 1ucv h ASP 24 Ca 0.29 0.09 -0.04 0.00 0.02 0.00 0.00 57.03 57.40 1ucv h ASP 24 Cb 0.57 0.07 0.01 0.00 0.22 0.00 0.00 39.33 40.19 1ucv h ASP 24 CO -0.90 -0.07 -0.36 0.45 -1.72 0.00 0.00 179.24 176.64 1ucv h HIS 25 N 0.15 -0.93 -0.91 4.55 3.86 0.65 -2.94 115.15 119.58 1ucv h HIS 25 Ca 0.74 -0.02 0.25 0.00 -1.16 0.00 0.00 60.37 60.17 1ucv h HIS 25 Cb 2.34 0.31 -0.14 0.00 1.06 0.00 0.00 27.41 30.97 1ucv h HIS 25 CO -0.00 -0.58 0.32 0.74 0.86 0.00 0.00 177.93 179.26 1ucv h PHE 26 N -1.19 0.49 -0.28 2.45 -1.00 -0.94 0.97 116.94 117.45 1ucv h PHE 26 Ca -0.10 0.05 0.06 0.00 2.81 0.00 0.00 57.97 60.79 1ucv h PHE 26 Cb 0.77 -0.07 -0.01 0.00 3.61 0.00 0.00 35.95 40.24 1ucv h PHE 26 CO 0.01 -0.19 0.20 0.00 -1.61 0.00 0.00 178.31 176.72 1ucv h ALA 27 N 1.79 2.14 0.01 2.45 0.00 -0.68 0.38 119.26 125.34 1ucv h ALA 27 Ca 0.59 -0.01 -0.25 0.00 0.00 0.00 0.00 54.91 55.24 1ucv h ALA 27 Cb 1.22 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 19.02 1ucv h ALA 27 CO -0.63 -0.20 -0.98 0.00 0.00 0.00 0.00 179.25 177.43 1ucv h ALA 28 N 1.86 0.11 0.00 0.00 0.00 0.11 -3.13 119.26 118.21 1ucv h ALA 28 Ca 0.13 -0.68 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1ucv h ALA 28 Cb 0.38 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1ucv h ALA 28 CO -0.01 0.63 0.00 0.41 0.00 0.00 0.00 179.25 180.28 1ucv n GLY 29 N 1.10 -0.60 0.43 0.00 0.00 -0.70 -4.78 105.19 100.65 1ucv n GLY 29 Ca -0.11 -0.10 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 0.18 1.07 3.05 -0.02 0.00 -1.03 -5.07 105.19 103.37 1ucv n GLY 30 Ca 0.12 -0.22 -0.32 0.00 0.00 0.00 0.00 46.02 45.60 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 3.49 -0.33 1.61 2.02 0.13 -4.91 117.35 117.36 1ucv s TYR 31 Ca 0.00 -2.61 0.08 0.00 -0.37 0.00 0.00 57.07 54.17 1ucv s TYR 31 Cb 0.00 -2.39 -0.09 0.00 -0.40 0.00 0.00 41.96 39.08 1ucv s TYR 31 CO 0.00 -0.91 0.32 0.45 -1.57 0.00 0.00 175.55 173.84 1ucv n SER 32 N 4.36 0.76 -4.23 2.29 2.88 -1.26 -1.43 113.62 116.98 1ucv n SER 32 Ca -0.06 -0.59 -0.19 0.00 -1.33 0.00 0.00 58.87 56.69 1ucv n SER 32 Cb 0.42 1.05 -0.10 0.00 -0.75 0.00 0.00 64.21 64.84 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 -1.92 1.72 0.13 -3.46 0.01 -1.26 -3.89 113.70 105.02 1ucv s SER 33 Ca 0.02 -1.47 -0.03 0.00 1.31 0.00 0.00 55.95 55.79 1ucv s SER 33 Cb 0.06 0.22 -0.12 0.00 0.21 0.00 0.00 66.02 66.40 1ucv s SER 33 CO 0.33 -0.78 1.29 -0.07 0.41 0.00 0.00 173.24 174.42 1ucv h LEU 34 N 2.21 0.43 -0.83 2.44 -0.00 -1.91 -3.10 115.31 114.55 1ucv h LEU 34 Ca -0.37 -0.37 0.20 0.00 -0.00 0.00 0.00 57.88 57.33 1ucv h LEU 34 Cb 1.25 -0.13 -0.15 0.00 -0.00 0.00 0.00 40.66 41.63 1ucv h LEU 34 CO 0.60 1.20 0.01 1.23 -0.00 0.00 0.00 178.44 181.47 1ucv h GLY 35 N 1.48 0.96 1.74 0.83 0.00 -1.97 0.15 103.07 106.26 1ucv h GLY 35 Ca -0.08 0.12 -0.25 0.00 0.00 0.00 0.00 47.33 47.12 1ucv h GLY 35 CO 0.16 -0.35 -1.15 0.00 0.00 0.00 0.00 176.54 175.21 1ucv h MET 36 N 0.08 0.20 -0.62 4.80 -0.00 -1.97 -3.27 114.93 114.14 1ucv h MET 36 Ca 0.47 -0.32 0.09 0.00 -0.00 0.00 0.00 59.70 59.94 1ucv h MET 36 Cb 0.86 0.12 -0.04 0.00 -0.00 0.00 0.00 31.60 32.54 1ucv h MET 36 CO -0.74 1.14 0.42 0.28 -0.00 0.00 0.00 176.91 178.01 1ucv h VAL 37 N 0.06 0.91 0.00 -0.10 2.07 -0.70 0.36 116.25 118.84 1ucv h VAL 37 Ca -0.09 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.27 1ucv h VAL 37 Cb 1.88 0.40 0.00 0.00 -1.52 0.00 0.00 31.29 32.06 1ucv h VAL 37 CO 0.18 0.09 0.00 0.18 0.02 0.00 0.00 177.57 178.03 1ucv n LEU 38 N -4.47 0.00 -0.01 2.57 7.99 -0.24 -2.64 117.00 120.20 1ucv n LEU 38 Ca 0.10 0.03 0.09 0.00 -0.01 0.00 0.00 56.01 56.22 1ucv n LEU 38 Cb 0.35 -0.03 -0.13 0.00 -0.11 0.00 0.00 43.42 43.50 1ucv n LEU 38 CO 0.34 -0.00 -0.62 0.54 -1.51 0.00 0.00 177.39 176.14 1ucv n ARG 39 N -1.03 0.64 -2.69 3.23 5.12 0.12 -4.93 116.66 117.13 1ucv n ARG 39 Ca 0.19 -0.14 -0.22 0.00 -1.93 0.00 0.00 57.85 55.75 1ucv n ARG 39 Cb 0.10 -1.41 0.07 0.00 -1.16 0.00 0.00 32.46 30.06 1ucv n ARG 39 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1ucv s MET 40 N -3.16 2.15 0.38 5.56 0.23 -1.08 -5.08 119.30 118.29 1ucv s MET 40 Ca -0.05 -1.06 -0.16 0.00 -1.03 0.00 0.00 55.69 53.39 1ucv s MET 40 Cb 0.12 -2.45 0.06 0.00 -1.53 0.00 0.00 34.83 31.02 1ucv s MET 40 CO 0.74 -1.03 0.82 -1.71 -2.03 0.00 0.00 175.02 171.81 1ucv n ASN 41 N -2.52 -2.28 -0.23 -1.18 5.15 -1.26 -4.97 115.26 107.97 1ucv n ASN 41 Ca 0.12 -2.55 0.22 0.00 -0.60 0.00 0.00 54.58 51.77 1ucv n ASN 41 Cb 0.60 3.79 0.40 0.00 -0.53 0.00 0.00 39.78 44.04 1ucv n ASN 41 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1ucv n ALA 42 N -0.56 0.72 0.19 5.20 0.00 -1.26 0.16 120.51 124.95 1ucv n ALA 42 Ca -0.17 0.64 -0.14 0.00 0.00 0.00 0.00 53.44 53.77 1ucv n ALA 42 Cb 0.60 -0.67 -0.07 0.00 0.00 0.00 0.00 19.45 19.31 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 -0.04 0.00 4.20 -2.00 -0.15 115.11 116.63 1ucv h GLN 43 Ca 0.56 0.03 -0.12 0.00 0.06 0.00 0.00 58.65 59.18 1ucv h GLN 43 Cb 1.55 0.11 0.01 0.00 0.30 0.00 0.00 27.48 29.45 1ucv h GLN 43 CO -0.46 -0.33 -0.45 -0.44 -0.67 0.00 0.00 178.83 176.48 1ucv h ASP 44 N -0.51 0.46 -0.26 1.46 3.32 0.11 -3.33 116.42 117.67 1ucv h ASP 44 Ca -0.02 -0.71 0.06 0.00 0.02 0.00 0.00 57.03 56.38 1ucv h ASP 44 Cb 0.44 -0.14 -0.08 0.00 0.22 0.00 0.00 39.33 39.78 1ucv h ASP 44 CO 0.00 1.10 -0.30 0.58 -1.72 0.00 0.00 179.24 178.90 1ucv h VAL 45 N -0.15 0.29 -0.97 -1.35 2.07 -0.43 -0.66 116.25 115.05 1ucv h VAL 45 Ca -0.05 0.00 0.32 0.00 0.82 0.00 0.00 66.70 67.79 1ucv h VAL 45 Cb 1.14 0.29 -0.16 0.00 -1.52 0.00 0.00 31.29 31.04 1ucv h VAL 45 CO 0.09 0.00 0.38 -0.09 0.02 0.00 0.00 177.57 177.97 1ucv h ARG 46 N -0.31 0.14 -0.46 1.57 1.12 -1.12 1.28 114.38 116.60 1ucv h ARG 46 Ca 0.13 -0.01 -0.01 0.00 -1.11 0.00 0.00 59.98 58.99 1ucv h ARG 46 Cb 0.52 -0.03 -0.02 0.00 -0.01 0.00 0.00 29.97 30.43 1ucv h ARG 46 CO -0.43 0.09 0.25 0.00 -3.11 0.00 0.00 179.97 176.78 1ucv h ALA 47 N 1.90 1.58 -0.14 2.80 0.00 -1.22 -1.59 119.26 122.58 1ucv h ALA 47 Ca 0.70 -0.07 0.04 0.00 0.00 0.00 0.00 54.91 55.58 1ucv h ALA 47 Cb 1.63 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 19.22 1ucv h ALA 47 CO -0.72 0.36 0.10 -0.07 0.00 0.00 0.00 179.25 178.92 1ucv h LEU 48 N 0.64 0.00 0.00 0.00 3.38 0.18 -3.46 115.31 116.05 1ucv h LEU 48 Ca 0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1ucv h LEU 48 Cb 0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1ucv h LEU 48 CO -0.03 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.11 1ucv n GLY 49 N -1.56 1.89 3.56 0.83 0.00 -0.60 -4.84 105.19 104.48 1ucv n GLY 49 Ca 0.00 0.00 -0.42 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 -1.73 3.85 -0.00 -0.61 1.09 -1.26 -4.73 121.20 117.81 1ucv s ILE 50 Ca 0.00 0.64 0.00 0.00 -1.10 0.00 0.00 60.65 60.19 1ucv s ILE 50 Cb 0.00 -4.79 -0.00 0.00 -1.06 0.00 0.00 42.46 36.61 1ucv s ILE 50 CO 0.00 -1.58 0.00 0.35 -0.10 0.00 0.00 174.94 173.61 1ucv n THR 51 N 6.55 0.00 -1.49 2.92 -2.24 -1.26 -4.20 114.28 114.56 1ucv n THR 51 Ca 0.06 -0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.41 1ucv n THR 51 Cb 0.49 0.22 -0.08 0.00 -2.10 0.00 0.00 70.33 68.86 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 -1.60 1.56 -0.26 3.22 4.32 -1.26 -4.63 117.00 118.35 1ucv n LEU 52 Ca -0.00 0.05 0.00 0.00 -0.02 0.00 0.00 56.01 56.04 1ucv n LEU 52 Cb 0.10 -1.24 0.04 0.00 -1.62 0.00 0.00 43.42 40.69 1ucv n LEU 52 CO 0.00 -1.00 0.40 0.23 -1.22 0.00 0.00 177.39 175.80 1ucv n MET 53 N 8.53 -0.14 -0.29 3.23 2.81 -1.26 0.21 117.12 130.20 1ucv n MET 53 Ca 0.48 1.04 0.08 0.00 -1.81 0.00 0.00 57.70 57.50 1ucv n MET 53 Cb 0.26 -1.55 0.24 0.00 -0.71 0.00 0.00 33.22 31.46 1ucv n MET 53 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 1ucv h GLY 54 N 0.00 1.39 0.00 3.03 0.00 -2.01 -1.60 103.07 103.88 1ucv h GLY 54 Ca 0.25 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.36 1ucv h GLY 54 CO -0.68 -0.10 -0.08 0.45 0.00 0.00 0.00 176.54 176.13 1ucv h HIS 55 N 0.55 0.00 -1.27 5.60 -0.00 0.21 -3.29 115.15 116.95 1ucv h HIS 55 Ca 0.48 0.00 0.42 0.00 -0.00 0.00 0.00 60.37 61.27 1ucv h HIS 55 Cb 0.75 0.00 -0.10 0.00 -0.00 0.00 0.00 27.41 28.06 1ucv h HIS 55 CO -0.11 0.00 0.85 1.04 -0.00 0.00 0.00 177.93 179.70 1ucv n GLN 56 N -4.62 -0.02 -0.05 2.45 6.02 0.15 0.21 117.38 121.52 1ucv n GLN 56 Ca -0.01 1.01 -0.13 0.00 -0.01 0.00 0.00 57.00 57.87 1ucv n GLN 56 Cb 0.04 -2.07 -0.07 0.00 1.02 0.00 0.00 30.24 29.16 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 0.27 0.44 -1.09 1.57 -1.41 -2.44 116.57 113.91 1ucv h LYS 57 Ca 0.75 -0.13 -0.02 0.00 -1.87 0.00 0.00 60.65 59.39 1ucv h LYS 57 Cb 2.56 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 34.86 1ucv h LYS 57 CO -0.30 0.63 -0.35 0.87 -0.57 0.00 0.00 179.45 179.73 1ucv h LYS 58 N -0.10 -0.74 0.00 3.15 6.56 0.23 1.03 116.57 126.71 1ucv h LYS 58 Ca 0.02 0.05 0.00 0.00 -1.06 0.00 0.00 60.65 59.66 1ucv h LYS 58 Cb 0.56 0.17 0.00 0.00 -0.57 0.00 0.00 32.23 32.39 1ucv h LYS 58 CO 0.02 -0.49 0.00 -0.89 -2.06 0.00 0.00 179.45 176.03 1ucv n ILE 59 N -4.53 0.00 0.19 1.86 5.41 -0.94 -0.92 119.36 120.43 1ucv n ILE 59 Ca -0.09 1.47 -0.17 0.00 1.00 0.00 0.00 62.75 64.96 1ucv n ILE 59 Cb 0.34 -2.21 -0.10 0.00 -0.71 0.00 0.00 39.64 36.96 1ucv n ILE 59 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1ucv h LEU 60 N 0.00 -1.49 -1.33 1.39 -0.00 -1.51 -0.91 115.31 111.46 1ucv h LEU 60 Ca 0.00 0.14 0.47 0.00 -0.00 0.00 0.00 57.88 58.49 1ucv h LEU 60 Cb 0.00 0.53 -0.14 0.00 -0.00 0.00 0.00 40.66 41.04 1ucv h LEU 60 CO 0.00 -0.60 0.83 1.23 -0.00 0.00 0.00 178.44 179.90 1ucv h GLY 61 N -0.86 1.51 1.49 0.83 0.00 0.12 1.28 103.07 107.43 1ucv h GLY 61 Ca -0.03 -0.10 -0.27 0.00 0.00 0.00 0.00 47.33 46.93 1ucv h GLY 61 CO -0.18 -0.52 -1.16 1.76 0.00 0.00 0.00 176.54 176.43 1ucv h SER 62 N 0.01 0.60 0.14 0.19 0.02 0.04 -3.23 113.55 111.32 1ucv h SER 62 Ca 0.87 -0.56 -0.01 0.00 -0.84 0.00 0.00 61.79 61.26 1ucv h SER 62 Cb 2.73 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 65.08 1ucv h SER 62 CO -0.51 1.39 -0.07 0.40 -1.14 0.00 0.00 176.83 176.91 1ucv h ILE 63 N 0.18 0.99 -1.01 3.27 2.04 0.28 0.14 117.51 123.41 1ucv h ILE 63 Ca -0.14 -0.59 0.22 0.00 1.00 0.00 0.00 64.86 65.36 1ucv h ILE 63 Cb 1.84 1.35 -0.11 0.00 -0.74 0.00 0.00 36.82 39.15 1ucv h ILE 63 CO 0.20 0.14 0.61 0.06 0.00 0.00 0.00 178.15 179.16 1ucv h GLN 64 N -0.47 0.62 0.00 2.37 3.07 -1.05 0.36 115.11 120.01 1ucv h GLN 64 Ca -0.02 -0.04 -0.10 0.00 0.09 0.00 0.00 58.65 58.58 1ucv h GLN 64 Cb 0.37 -0.14 -0.02 0.00 0.08 0.00 0.00 27.48 27.78 1ucv h GLN 64 CO 0.03 0.41 -0.68 0.00 0.09 0.00 0.00 178.83 178.68 1ucv h THR 65 N 0.64 0.67 0.00 1.86 1.03 -1.54 -2.52 112.91 113.04 1ucv h THR 65 Ca 0.61 -2.01 -0.12 0.00 -0.01 0.00 0.00 66.41 64.88 1ucv h THR 65 Cb 1.11 2.26 -0.02 0.00 -1.07 0.00 0.00 68.15 70.43 1ucv h THR 65 CO -0.41 0.38 -0.59 0.24 -0.01 0.00 0.00 175.52 175.13 1ucv h MET 66 N 0.00 0.00 0.09 0.00 2.86 0.25 -3.23 114.93 114.90 1ucv h MET 66 Ca -0.04 0.00 -0.34 0.00 -2.06 0.00 0.00 59.70 57.26 1ucv h MET 66 Cb 1.38 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 33.01 1ucv h MET 66 CO 0.05 0.59 -1.87 0.07 1.06 0.00 0.00 176.91 176.81 1ucv h ARG 67 N 0.00 0.20 -0.82 1.72 0.11 -1.01 -3.37 114.38 111.21 1ucv h ARG 67 Ca -0.01 -0.34 0.19 0.00 0.10 0.00 0.00 59.98 59.92 1ucv h ARG 67 Cb 1.09 0.13 -0.12 0.00 1.11 0.00 0.00 29.97 32.18 1ucv h ARG 67 CO 0.08 1.02 0.27 0.00 0.10 0.00 0.00 179.97 181.43 1ucv h ALA 68 N 0.36 1.17 -0.41 0.08 0.00 -1.48 0.54 119.26 119.53 1ucv h ALA 68 Ca -0.37 0.17 0.11 0.00 0.00 0.00 0.00 54.91 54.82 1ucv h ALA 68 Cb 2.03 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 20.01 1ucv h ALA 68 CO 0.10 -0.34 0.29 -0.56 0.00 0.00 0.00 179.25 178.74 1ucv h GLN 69 N 0.32 0.06 0.00 0.00 3.07 -1.72 -0.94 115.11 115.90 1ucv h GLN 69 Ca 0.48 -0.00 -0.03 0.00 0.09 0.00 0.00 58.65 59.19 1ucv h GLN 69 Cb 0.87 -0.01 -0.00 0.00 0.08 0.00 0.00 27.48 28.42 1ucv h GLN 69 CO -0.53 0.04 -0.30 -0.07 0.09 0.00 0.00 178.83 178.06 1ucv h LEU 70 N 0.06 0.00 -0.87 0.06 3.38 -0.21 -3.37 115.31 114.36 1ucv h LEU 70 Ca 0.19 -0.25 0.22 0.00 0.09 0.00 0.00 57.88 58.14 1ucv h LEU 70 Cb 0.70 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.31 1ucv h LEU 70 CO -0.01 0.79 0.28 0.71 0.09 0.00 0.00 178.44 180.29 1ucv h THR 71 N -1.00 0.38 -2.71 0.22 1.35 -0.79 -3.37 112.91 106.99 1ucv h THR 71 Ca -0.04 -0.09 -0.58 0.00 -0.55 0.00 0.00 66.41 65.15 1ucv h THR 71 Cb 0.49 0.09 -0.03 0.00 -1.73 0.00 0.00 68.15 66.97 1ucv h THR 71 CO -0.03 0.05 1.26 -0.44 -0.25 0.00 0.00 175.52 176.11 1ucv s SER 72 N -5.12 5.95 0.38 5.36 0.01 -0.38 -4.98 113.70 114.91 1ucv s SER 72 Ca -0.12 1.30 0.08 0.00 1.31 0.00 0.00 55.95 58.52 1ucv s SER 72 Cb 0.25 -2.53 -0.04 0.00 0.21 0.00 0.00 66.02 63.92 1ucv s SER 72 CO 0.77 -1.67 0.22 0.42 0.41 0.00 0.00 173.24 173.39 1ucv s THR 73 N 6.70 2.78 0.30 1.44 -4.23 -1.26 -4.92 115.64 116.45 1ucv s THR 73 Ca 0.79 -1.59 0.09 0.00 -1.18 0.00 0.00 61.69 59.79 1ucv s THR 73 Cb -0.22 -3.00 0.35 0.00 1.34 0.00 0.00 72.50 70.96 1ucv s THR 73 CO 0.34 -0.09 1.40 1.67 -0.54 0.00 0.00 174.62 177.40 1ucv n GLN 74 N -1.28 -0.06 0.00 3.99 -0.06 -1.26 -4.88 117.38 113.83 1ucv n GLN 74 Ca -0.01 1.29 0.00 0.00 -2.00 0.00 0.00 57.00 56.28 1ucv n GLN 74 Cb 0.62 -2.16 0.00 0.00 -4.06 0.00 0.00 30.24 24.64 1ucv n GLN 74 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1ucv n GLY 75 N -1.36 0.88 3.67 1.69 0.00 -1.26 -5.01 105.19 103.80 1ucv n GLY 75 Ca 0.26 -0.43 -0.24 0.00 0.00 0.00 0.00 46.02 45.61 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 0.00 -4.68 -0.81 1.61 7.64 -1.26 -4.43 113.62 111.69 1ucv n SER 76 Ca 0.00 -0.65 0.00 0.00 1.01 0.00 0.00 58.87 59.23 1ucv n SER 76 Cb 0.00 -4.64 0.00 0.00 -1.01 0.00 0.00 64.21 58.56 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 -1.74 -1.55 3.67 0.23 0.00 -1.26 -4.95 105.19 99.59 1ucv n GLY 77 Ca -0.07 -0.54 -0.52 0.00 0.00 0.00 0.00 46.02 44.90 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 0.24 1.69 -4.01 1.61 -0.02 -1.26 -4.95 135.00 128.29 1ucv n PRO 78 Ca 0.00 0.61 -0.33 0.00 -2.02 0.00 0.00 63.50 61.76 1ucv n PRO 78 Cb 0.00 -2.43 -0.15 0.00 -0.02 0.00 0.00 33.50 30.90 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 4.28 4.51 -0.33 2.55 0.15 -1.26 -5.08 113.70 118.51 1ucv s SER 79 Ca 0.97 -1.28 -0.08 0.00 0.70 0.00 0.00 55.95 56.26 1ucv s SER 79 Cb -0.85 -1.61 0.02 0.00 -1.71 0.00 0.00 66.02 61.88 1ucv s SER 79 CO 0.57 -0.20 0.12 -0.55 1.20 0.00 0.00 173.24 174.38 1ucv s SER 80 N 1.18 5.33 0.00 5.45 0.15 -1.26 -5.18 113.70 119.37 1ucv s SER 80 Ca -0.06 -0.92 0.05 0.00 0.70 0.00 0.00 55.95 55.72 1ucv s SER 80 Cb -0.19 -1.91 0.04 0.00 -1.71 0.00 0.00 66.02 62.25 1ucv s SER 80 CO -0.04 -0.28 0.66 0.61 1.20 0.00 0.00 173.24 175.39