#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 6.75 0.16 1.61 1.04 -1.26 -4.92 113.70 117.08 1ucv s SER 2 Ca 0.00 0.99 -0.20 0.00 0.48 0.00 0.00 55.95 57.22 1ucv s SER 2 Cb 0.00 -2.54 0.07 0.00 0.10 0.00 0.00 66.02 63.65 1ucv s SER 2 CO 0.00 -1.05 1.28 -0.24 0.98 0.00 0.00 173.24 174.21 1ucv n SER 3 N 7.42 -0.71 -4.67 7.02 2.88 -1.26 -4.36 113.62 119.94 1ucv n SER 3 Ca 0.13 1.45 -0.31 0.00 -1.33 0.00 0.00 58.87 58.82 1ucv n SER 3 Cb 0.47 -0.26 -0.08 0.00 -0.75 0.00 0.00 64.21 63.59 1ucv n SER 3 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1ucv s GLY 4 N -3.06 1.89 -0.29 0.46 0.00 -1.26 -5.10 107.32 99.95 1ucv s GLY 4 Ca -0.11 -1.09 -0.07 0.00 0.00 0.00 0.00 44.72 43.45 1ucv s GLY 4 CO 0.55 -1.03 0.09 -0.45 0.00 0.00 0.00 173.10 172.26 1ucv s SER 5 N -2.08 5.21 -0.42 1.64 0.15 -1.26 -4.96 113.70 111.97 1ucv s SER 5 Ca 0.23 -0.60 -0.29 0.00 0.70 0.00 0.00 55.95 56.00 1ucv s SER 5 Cb -0.12 -1.91 0.01 0.00 -1.71 0.00 0.00 66.02 62.29 1ucv s SER 5 CO 0.16 -0.17 1.48 -0.44 1.20 0.00 0.00 173.24 175.46 1ucv s SER 6 N 1.54 6.23 -0.11 5.45 0.01 -1.26 -4.70 113.70 120.86 1ucv s SER 6 Ca 0.04 0.83 -0.11 0.00 1.31 0.00 0.00 55.95 58.02 1ucv s SER 6 Cb -0.17 -2.54 -0.05 0.00 0.21 0.00 0.00 66.02 63.48 1ucv s SER 6 CO 0.03 -1.52 -0.22 0.61 0.41 0.00 0.00 173.24 172.55 1ucv n GLY 7 N 5.16 -0.34 3.88 3.44 0.00 -1.26 -5.07 105.19 111.01 1ucv n GLY 7 Ca 0.17 -0.17 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 1ucv n GLY 7 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1ucv s LEU 8 N -7.40 2.55 0.03 0.99 0.05 -1.26 -5.12 118.68 108.52 1ucv s LEU 8 Ca -0.20 -1.37 0.01 0.00 0.05 0.00 0.00 54.13 52.62 1ucv s LEU 8 Cb 0.04 -1.04 -0.04 0.00 -2.05 0.00 0.00 46.19 43.11 1ucv s LEU 8 CO 0.28 -1.10 0.08 0.28 -0.55 0.00 0.00 176.35 175.34 1ucv s THR 9 N -2.82 4.62 0.44 5.48 -1.32 -1.26 -4.11 115.64 116.67 1ucv s THR 9 Ca 0.26 -0.55 0.36 0.00 -1.21 0.00 0.00 61.69 60.55 1ucv s THR 9 Cb -0.02 -3.15 0.55 0.00 -1.51 0.00 0.00 72.50 68.37 1ucv s THR 9 CO 0.16 0.27 1.37 0.52 -2.21 0.00 0.00 174.62 174.74 1ucv n VAL 10 N 0.93 -0.11 0.13 5.08 0.31 -1.23 0.45 118.33 123.89 1ucv n VAL 10 Ca -0.11 1.45 -0.13 0.00 -0.01 0.00 0.00 64.34 65.54 1ucv n VAL 10 Cb 0.52 -2.40 -0.08 0.00 -0.91 0.00 0.00 33.84 30.98 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 -0.39 -0.33 2.92 0.00 -1.89 -2.33 103.07 101.05 1ucv h GLY 11 Ca 0.80 0.14 0.04 0.00 0.00 0.00 0.00 47.33 48.31 1ucv h GLY 11 CO -0.22 -0.14 -0.44 -0.55 0.00 0.00 0.00 176.54 175.19 1ucv h ASP 12 N -0.79 -1.47 0.17 0.19 3.32 -0.39 0.49 116.42 117.94 1ucv h ASP 12 Ca -0.04 0.19 0.00 0.00 0.02 0.00 0.00 57.03 57.21 1ucv h ASP 12 Cb 0.51 0.60 -0.03 0.00 0.22 0.00 0.00 39.33 40.63 1ucv h ASP 12 CO 0.06 -0.31 -0.40 -0.25 -1.72 0.00 0.00 179.24 176.62 1ucv h TRP 13 N -0.31 -1.14 -1.10 4.55 7.01 -1.63 -1.26 115.95 122.07 1ucv h TRP 13 Ca 0.06 0.02 0.30 0.00 2.11 0.00 0.00 58.89 61.39 1ucv h TRP 13 Cb 0.46 0.48 -0.10 0.00 -2.10 0.00 0.00 29.16 27.90 1ucv h TRP 13 CO -0.71 -0.47 0.71 -0.07 -2.79 0.00 0.00 178.44 175.11 1ucv h LEU 14 N -0.62 0.39 -1.23 0.65 3.38 -1.07 0.50 115.31 117.31 1ucv h LEU 14 Ca -0.02 0.09 0.08 0.00 0.09 0.00 0.00 57.88 58.13 1ucv h LEU 14 Cb 0.60 0.04 -0.06 0.00 0.09 0.00 0.00 40.66 41.33 1ucv h LEU 14 CO -0.17 0.02 0.56 -0.78 0.09 0.00 0.00 178.44 178.16 1ucv h ASP 15 N 0.32 0.80 -0.95 -0.43 1.82 0.12 0.29 116.42 118.38 1ucv h ASP 15 Ca 0.64 0.01 0.07 0.00 -0.39 0.00 0.00 57.03 57.36 1ucv h ASP 15 Cb 1.74 -0.16 -0.07 0.00 0.68 0.00 0.00 39.33 41.53 1ucv h ASP 15 CO -0.32 0.49 0.60 -1.28 -1.61 0.00 0.00 179.24 177.13 1ucv h SER 16 N 0.90 0.95 -0.45 2.28 0.87 0.26 -0.03 113.55 118.33 1ucv h SER 16 Ca 0.38 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.96 1ucv h SER 16 Cb 0.31 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 62.08 1ucv h SER 16 CO -0.15 0.60 0.00 2.30 -0.53 0.00 0.00 176.83 179.05 1ucv n ILE 17 N -4.56 1.91 -3.19 2.23 -5.35 -0.57 -4.90 119.36 104.93 1ucv n ILE 17 Ca 0.14 -1.01 -0.23 0.00 -0.27 0.00 0.00 62.75 61.39 1ucv n ILE 17 Cb 0.19 -0.24 0.01 0.00 -1.74 0.00 0.00 39.64 37.86 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 0.55 -4.04 -0.00 6.28 1.74 -0.02 -4.82 116.66 116.34 1ucv n ARG 18 Ca 0.21 0.67 0.00 0.00 -0.77 0.00 0.00 57.85 57.96 1ucv n ARG 18 Cb 0.90 -5.44 0.00 0.00 -1.02 0.00 0.00 32.46 26.90 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 -3.84 0.19 0.26 5.56 2.81 0.90 -4.69 117.12 118.31 1ucv n MET 19 Ca -0.06 -0.81 0.10 0.00 -1.81 0.00 0.00 57.70 55.12 1ucv n MET 19 Cb 0.58 -1.01 0.53 0.00 -0.71 0.00 0.00 33.22 32.61 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 0.09 0.00 2.00 3.03 0.00 -1.67 0.20 103.07 106.71 1ucv h GLY 20 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 1ucv h GLY 20 CO 0.00 0.00 -0.08 0.07 0.00 0.00 0.00 176.54 176.53 1ucv h ARG 21 N 0.00 0.00 -0.00 4.80 0.11 -1.89 -0.56 114.38 116.83 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 0.08 -0.50 0.66 0.10 0.00 0.00 179.97 180.31 1ucv n TYR 22 N -3.78 0.00 -0.31 4.08 4.01 0.71 -4.24 117.16 117.63 1ucv n TYR 22 Ca -0.02 0.00 0.16 0.00 -0.16 0.00 0.00 57.90 57.88 1ucv n TYR 22 Cb 0.17 -0.18 0.35 0.00 -0.31 0.00 0.00 39.34 39.38 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 0.40 0.30 -0.38 -0.72 0.11 -1.18 0.91 114.38 113.81 1ucv h ARG 23 Ca 0.00 -0.02 0.07 0.00 0.10 0.00 0.00 59.98 60.14 1ucv h ARG 23 Cb 0.51 -0.07 -0.02 0.00 1.11 0.00 0.00 29.97 31.51 1ucv h ARG 23 CO 0.00 0.20 0.26 -0.44 0.10 0.00 0.00 179.97 180.09 1ucv h ASP 24 N 0.30 0.16 0.33 0.08 3.32 -1.76 -2.52 116.42 116.34 1ucv h ASP 24 Ca 0.61 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.65 1ucv h ASP 24 Cb 1.27 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.79 1ucv h ASP 24 CO -0.60 0.10 -0.16 0.45 -1.72 0.00 0.00 179.24 177.31 1ucv h HIS 25 N 0.18 -0.42 -0.80 4.55 3.86 0.56 -3.12 115.15 119.97 1ucv h HIS 25 Ca 0.17 -0.01 0.19 0.00 -1.16 0.00 0.00 60.37 59.57 1ucv h HIS 25 Cb 0.45 0.14 -0.13 0.00 1.06 0.00 0.00 27.41 28.93 1ucv h HIS 25 CO -0.00 -0.09 0.14 0.74 0.86 0.00 0.00 177.93 179.59 1ucv h PHE 26 N -0.78 0.20 -0.32 2.45 -1.00 -1.27 0.79 116.94 117.00 1ucv h PHE 26 Ca -0.05 0.05 0.09 0.00 2.81 0.00 0.00 57.97 60.88 1ucv h PHE 26 Cb 0.51 0.04 -0.01 0.00 3.61 0.00 0.00 35.95 40.10 1ucv h PHE 26 CO 0.02 -0.19 0.25 0.00 -1.61 0.00 0.00 178.31 176.78 1ucv h ALA 27 N 1.71 2.25 0.11 2.45 0.00 -0.52 0.49 119.26 125.75 1ucv h ALA 27 Ca 0.47 -0.01 -0.27 0.00 0.00 0.00 0.00 54.91 55.10 1ucv h ALA 27 Cb 0.88 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1ucv h ALA 27 CO -0.62 -0.41 -1.20 0.00 0.00 0.00 0.00 179.25 177.01 1ucv h ALA 28 N 1.81 0.13 -0.01 0.00 0.00 0.61 -3.21 119.26 118.61 1ucv h ALA 28 Ca 0.15 -0.87 0.00 0.00 0.00 0.00 0.00 54.91 54.20 1ucv h ALA 28 Cb 0.64 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1ucv h ALA 28 CO -0.00 0.97 0.00 0.41 0.00 0.00 0.00 179.25 180.63 1ucv n GLY 29 N 1.46 -0.97 1.01 0.00 0.00 -0.28 -4.81 105.19 101.60 1ucv n GLY 29 Ca -0.08 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.91 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 0.57 0.72 3.02 -0.02 0.00 -1.00 -5.05 105.19 103.42 1ucv n GLY 30 Ca 0.03 -0.28 -0.31 0.00 0.00 0.00 0.00 46.02 45.46 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 3.29 -0.09 1.61 1.51 0.16 -4.91 117.35 116.93 1ucv s TYR 31 Ca 0.00 -2.51 0.02 0.00 -1.01 0.00 0.00 57.07 53.58 1ucv s TYR 31 Cb 0.00 -2.28 -0.03 0.00 -0.11 0.00 0.00 41.96 39.54 1ucv s TYR 31 CO 0.00 -0.90 0.09 0.45 -1.11 0.00 0.00 175.55 174.09 1ucv n SER 32 N 4.41 1.26 -4.61 2.29 2.88 -1.26 -0.41 113.62 118.18 1ucv n SER 32 Ca -0.06 -0.41 -0.27 0.00 -1.33 0.00 0.00 58.87 56.80 1ucv n SER 32 Cb 0.42 1.03 -0.11 0.00 -0.75 0.00 0.00 64.21 64.80 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 -1.51 3.76 -0.02 -3.46 0.01 -1.26 -3.49 113.70 107.73 1ucv s SER 33 Ca 0.00 -1.37 -0.18 0.00 1.31 0.00 0.00 55.95 55.71 1ucv s SER 33 Cb 0.02 -0.38 -0.33 0.00 0.21 0.00 0.00 66.02 65.54 1ucv s SER 33 CO 0.10 -0.46 0.89 -0.07 0.41 0.00 0.00 173.24 174.11 1ucv h LEU 34 N 1.80 0.63 -1.92 2.44 -0.00 -1.92 -3.00 115.31 113.34 1ucv h LEU 34 Ca -0.44 -0.93 0.37 0.00 -0.00 0.00 0.00 57.88 56.88 1ucv h LEU 34 Cb 1.24 -0.21 -0.06 0.00 -0.00 0.00 0.00 40.66 41.64 1ucv h LEU 34 CO 0.80 1.58 0.90 1.23 -0.00 0.00 0.00 178.44 182.95 1ucv h GLY 35 N -0.04 0.15 0.56 0.83 0.00 -1.91 0.67 103.07 103.33 1ucv h GLY 35 Ca -0.22 -0.02 -0.10 0.00 0.00 0.00 0.00 47.33 46.98 1ucv h GLY 35 CO 0.20 -0.03 -1.62 1.15 0.00 0.00 0.00 176.54 176.25 1ucv n MET 36 N -4.21 0.64 0.10 4.80 0.00 -1.24 -4.15 117.12 113.05 1ucv n MET 36 Ca 0.28 0.04 -0.04 0.00 0.00 0.00 0.00 57.70 57.98 1ucv n MET 36 Cb 1.31 -1.69 0.13 0.00 0.00 0.00 0.00 33.22 32.97 1ucv n MET 36 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 175.97 176.25 1ucv h VAL 37 N 0.00 1.40 0.00 3.17 2.07 0.40 -2.88 116.25 120.41 1ucv h VAL 37 Ca -0.13 -2.01 -0.01 0.00 0.82 0.00 0.00 66.70 65.37 1ucv h VAL 37 Cb 1.35 2.04 -0.00 0.00 -1.52 0.00 0.00 31.29 33.16 1ucv h VAL 37 CO 0.02 0.59 -0.05 -0.07 0.02 0.00 0.00 177.57 178.08 1ucv h LEU 38 N 0.13 0.00 -3.30 2.57 -0.00 -1.23 -1.66 115.31 111.82 1ucv h LEU 38 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.87 1ucv h LEU 38 Cb 1.10 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.76 1ucv h LEU 38 CO 0.09 0.05 0.00 -2.11 -0.00 0.00 0.00 178.44 176.47 1ucv n ARG 39 N -3.27 4.51 -3.84 1.13 1.85 -1.09 -4.93 116.66 111.02 1ucv n ARG 39 Ca -0.01 -2.85 -0.21 0.00 -1.00 0.00 0.00 57.85 53.78 1ucv n ARG 39 Cb 0.23 -2.19 -0.03 0.00 -1.05 0.00 0.00 32.46 29.43 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 -2.57 3.01 0.35 2.89 -1.94 -0.63 -5.08 119.30 115.33 1ucv s MET 40 Ca 0.49 -1.06 -0.01 0.00 -1.71 0.00 0.00 55.69 53.40 1ucv s MET 40 Cb 0.38 -2.66 0.01 0.00 2.01 0.00 0.00 34.83 34.56 1ucv s MET 40 CO 0.15 0.23 0.48 -1.71 -0.01 0.00 0.00 175.02 174.16 1ucv n ASN 41 N -1.39 -1.32 -0.32 3.03 5.15 -1.26 -4.97 115.26 114.18 1ucv n ASN 41 Ca -0.04 -2.91 0.17 0.00 -0.60 0.00 0.00 54.58 51.19 1ucv n ASN 41 Cb 0.58 2.49 0.34 0.00 -0.53 0.00 0.00 39.78 42.66 1ucv n ASN 41 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1ucv h ALA 42 N 2.03 1.39 -0.32 5.20 0.00 -1.98 0.51 119.26 126.10 1ucv h ALA 42 Ca -0.27 0.28 0.03 0.00 0.00 0.00 0.00 54.91 54.95 1ucv h ALA 42 Cb 1.19 0.43 -0.03 0.00 0.00 0.00 0.00 17.79 19.38 1ucv h ALA 42 CO 0.37 -0.60 0.12 1.96 0.00 0.00 0.00 179.25 181.10 1ucv h GLN 43 N 0.09 0.25 0.41 0.00 1.08 -1.98 0.30 115.11 115.26 1ucv h GLN 43 Ca 0.62 -0.02 -0.02 0.00 -1.45 0.00 0.00 58.65 57.79 1ucv h GLN 43 Cb 1.36 -0.06 0.00 0.00 -0.05 0.00 0.00 27.48 28.74 1ucv h GLN 43 CO -0.78 0.17 -0.20 -0.44 -0.95 0.00 0.00 178.83 176.63 1ucv h ASP 44 N 0.26 -0.46 -0.28 1.46 3.32 -0.59 -2.88 116.42 117.24 1ucv h ASP 44 Ca 0.14 -0.08 0.07 0.00 0.02 0.00 0.00 57.03 57.18 1ucv h ASP 44 Cb 0.10 0.12 -0.08 0.00 0.22 0.00 0.00 39.33 39.70 1ucv h ASP 44 CO -0.14 -0.03 -0.29 0.58 -1.72 0.00 0.00 179.24 177.64 1ucv h VAL 45 N -1.06 0.30 -0.95 -1.35 2.07 -0.38 -0.41 116.25 114.46 1ucv h VAL 45 Ca -0.06 0.00 0.21 0.00 0.82 0.00 0.00 66.70 67.67 1ucv h VAL 45 Cb 0.51 0.30 -0.11 0.00 -1.52 0.00 0.00 31.29 30.47 1ucv h VAL 45 CO 0.09 0.00 0.53 -0.09 0.02 0.00 0.00 177.57 178.12 1ucv h ARG 46 N -0.28 0.59 -0.82 1.57 9.65 -0.50 0.22 114.38 124.81 1ucv h ARG 46 Ca 0.14 -0.04 0.05 0.00 -1.10 0.00 0.00 59.98 59.03 1ucv h ARG 46 Cb 0.51 -0.13 -0.05 0.00 -1.39 0.00 0.00 29.97 28.91 1ucv h ARG 46 CO -0.44 0.39 0.53 0.00 2.80 0.00 0.00 179.97 183.25 1ucv h ALA 47 N 1.67 1.54 -0.08 2.80 0.00 -0.85 -0.53 119.26 123.82 1ucv h ALA 47 Ca 0.58 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.48 1ucv h ALA 47 Cb 0.99 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 1ucv h ALA 47 CO -0.44 0.36 0.08 -0.07 0.00 0.00 0.00 179.25 179.18 1ucv h LEU 48 N 0.96 0.00 0.00 0.00 3.38 -0.22 -3.45 115.31 115.98 1ucv h LEU 48 Ca 0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.30 1ucv h LEU 48 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1ucv h LEU 48 CO -0.11 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.03 1ucv n GLY 49 N -1.37 1.48 3.57 0.83 0.00 -0.21 -4.84 105.19 104.65 1ucv n GLY 49 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 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 -1.29 3.56 -0.01 -0.61 1.09 -1.25 -4.72 121.20 117.97 1ucv s ILE 50 Ca 0.00 0.44 0.02 0.00 -1.10 0.00 0.00 60.65 60.01 1ucv s ILE 50 Cb 0.00 -4.13 -0.02 0.00 -1.06 0.00 0.00 42.46 37.25 1ucv s ILE 50 CO 0.00 -0.97 0.01 0.35 -0.10 0.00 0.00 174.94 174.23 1ucv n THR 51 N 7.07 0.10 -1.44 2.92 -2.24 -1.26 -3.99 114.28 115.43 1ucv n THR 51 Ca 0.17 -0.07 -0.50 0.00 -2.27 0.00 0.00 64.05 61.38 1ucv n THR 51 Cb 0.50 -0.75 -0.07 0.00 -2.10 0.00 0.00 70.33 67.90 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 -1.99 2.09 -0.33 3.22 4.77 -1.26 -4.60 117.00 118.90 1ucv n LEU 52 Ca -0.02 0.39 -0.04 0.00 -0.03 0.00 0.00 56.01 56.30 1ucv n LEU 52 Cb 0.48 -1.26 -0.02 0.00 -2.33 0.00 0.00 43.42 40.30 1ucv n LEU 52 CO 0.04 -0.75 0.45 0.23 -1.33 0.00 0.00 177.39 176.02 1ucv n MET 53 N 8.22 -0.27 -0.33 3.23 2.81 -1.26 0.14 117.12 129.66 1ucv n MET 53 Ca 0.42 1.27 0.27 0.00 -1.81 0.00 0.00 57.70 57.84 1ucv n MET 53 Cb 0.23 -1.87 0.52 0.00 -0.71 0.00 0.00 33.22 31.39 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 2.13 0.00 3.03 0.00 -2.00 0.13 103.07 106.36 1ucv h GLY 54 Ca 0.22 -0.19 -0.03 0.00 0.00 0.00 0.00 47.33 47.33 1ucv h GLY 54 CO -0.80 -0.62 -0.58 0.45 0.00 0.00 0.00 176.54 174.98 1ucv h HIS 55 N 0.19 0.00 -0.98 5.60 3.86 0.87 -3.32 115.15 121.36 1ucv h HIS 55 Ca 0.78 0.00 0.39 0.00 -1.16 0.00 0.00 60.37 60.38 1ucv h HIS 55 Cb 1.89 0.00 -0.18 0.00 1.06 0.00 0.00 27.41 30.19 1ucv h HIS 55 CO -0.02 0.20 0.45 1.04 0.86 0.00 0.00 177.93 180.46 1ucv n GLN 56 N -4.60 -0.06 -0.13 2.45 6.02 0.16 0.23 117.38 121.45 1ucv n GLN 56 Ca -0.10 1.38 -0.05 0.00 -0.01 0.00 0.00 57.00 58.21 1ucv n GLN 56 Cb 0.31 -2.42 0.13 0.00 1.02 0.00 0.00 30.24 29.28 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 0.85 0.61 -1.09 1.57 -0.93 -1.50 116.57 116.09 1ucv h LYS 57 Ca 0.80 -0.24 -0.03 0.00 -1.87 0.00 0.00 60.65 59.31 1ucv h LYS 57 Cb 2.06 -0.09 0.01 0.00 0.08 0.00 0.00 32.23 34.28 1ucv h LYS 57 CO -0.78 0.85 -0.30 0.87 -0.57 0.00 0.00 179.45 179.53 1ucv h LYS 58 N 0.79 -0.80 0.11 3.15 6.56 0.27 0.53 116.57 127.20 1ucv h LYS 58 Ca 0.15 0.05 0.02 0.00 -1.06 0.00 0.00 60.65 59.81 1ucv h LYS 58 Cb 0.48 0.18 -0.05 0.00 -0.57 0.00 0.00 32.23 32.27 1ucv h LYS 58 CO 0.02 -0.53 -0.45 0.82 -2.06 0.00 0.00 179.45 177.26 1ucv h ILE 59 N -1.02 0.12 0.82 1.86 2.04 -1.38 0.68 117.51 120.62 1ucv h ILE 59 Ca -0.08 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.74 1ucv h ILE 59 Cb 0.63 0.12 0.01 0.00 -0.74 0.00 0.00 36.82 36.83 1ucv h ILE 59 CO 0.14 0.00 -0.41 -0.07 0.00 0.00 0.00 178.15 177.81 1ucv h LEU 60 N -0.68 -0.97 -2.04 1.44 3.38 -1.36 -1.73 115.31 113.35 1ucv h LEU 60 Ca 0.02 0.04 0.13 0.00 0.09 0.00 0.00 57.88 58.15 1ucv h LEU 60 Cb 0.70 0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.69 1ucv h LEU 60 CO -0.26 -0.68 0.36 1.23 0.09 0.00 0.00 178.44 179.18 1ucv h GLY 61 N -1.12 0.00 2.00 0.83 0.00 0.20 0.27 103.07 105.25 1ucv h GLY 61 Ca -0.11 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.12 1ucv h GLY 61 CO 0.17 0.00 -0.47 0.23 0.00 0.00 0.00 176.54 176.48 1ucv h SER 62 N 0.00 0.00 0.00 0.19 0.87 0.84 -3.26 113.55 112.20 1ucv h SER 62 Ca 0.21 0.00 -0.15 0.00 -1.23 0.00 0.00 61.79 60.62 1ucv h SER 62 Cb 0.93 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.87 1ucv h SER 62 CO -0.00 0.47 -0.80 0.40 -0.53 0.00 0.00 176.83 176.37 1ucv h ILE 63 N 0.00 1.25 -1.34 2.23 2.04 0.34 -3.02 117.51 119.01 1ucv h ILE 63 Ca -0.00 -2.25 0.39 0.00 1.00 0.00 0.00 64.86 63.99 1ucv h ILE 63 Cb 1.19 2.68 -0.06 0.00 -0.74 0.00 0.00 36.82 39.89 1ucv h ILE 63 CO 0.06 0.44 0.96 0.06 0.00 0.00 0.00 178.15 179.66 1ucv h GLN 64 N -0.97 0.02 0.01 2.37 -0.00 -1.11 0.74 115.11 116.16 1ucv h GLN 64 Ca -0.22 -0.00 -0.29 0.00 -0.00 0.00 0.00 58.65 58.15 1ucv h GLN 64 Cb 1.21 -0.00 -0.04 0.00 -0.00 0.00 0.00 27.48 28.64 1ucv h GLN 64 CO -0.12 0.01 -1.62 0.00 -0.00 0.00 0.00 178.83 177.09 1ucv h THR 65 N 0.02 0.96 -0.41 1.86 1.03 -1.68 -2.59 112.91 112.10 1ucv h THR 65 Ca 0.64 -2.78 -0.08 0.00 -0.01 0.00 0.00 66.41 64.18 1ucv h THR 65 Cb 2.53 2.49 -0.02 0.00 -1.07 0.00 0.00 68.15 72.09 1ucv h THR 65 CO -0.03 0.58 -0.08 0.24 -0.01 0.00 0.00 175.52 176.23 1ucv h MET 66 N 0.01 0.70 0.10 0.00 2.86 0.56 -2.54 114.93 116.62 1ucv h MET 66 Ca -0.25 -0.21 -0.33 0.00 -2.06 0.00 0.00 59.70 56.85 1ucv h MET 66 Cb 1.98 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 33.55 1ucv h MET 66 CO 0.09 0.77 -1.74 0.07 1.06 0.00 0.00 176.91 177.16 1ucv h ARG 67 N 0.65 0.22 -0.55 1.72 0.11 -1.27 -3.29 114.38 111.97 1ucv h ARG 67 Ca 0.12 -0.38 0.08 0.00 0.10 0.00 0.00 59.98 59.90 1ucv h ARG 67 Cb 0.51 0.14 -0.03 0.00 1.11 0.00 0.00 29.97 31.70 1ucv h ARG 67 CO 0.03 1.04 0.37 0.00 0.10 0.00 0.00 179.97 181.51 1ucv h ALA 68 N 0.42 1.96 0.00 0.08 0.00 -1.41 0.49 119.26 120.80 1ucv h ALA 68 Ca -0.32 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.55 1ucv h ALA 68 Cb 2.03 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.72 1ucv h ALA 68 CO 0.12 -0.06 -0.14 -0.56 0.00 0.00 0.00 179.25 178.61 1ucv h GLN 69 N 0.43 0.00 0.00 0.00 3.07 -1.58 -3.14 115.11 113.89 1ucv h GLN 69 Ca 0.25 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.99 1ucv h GLN 69 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.97 1ucv h GLN 69 CO -0.07 0.13 0.00 1.28 0.09 0.00 0.00 178.83 180.26 1ucv n LEU 70 N -3.13 0.74 -0.70 0.06 4.77 0.15 -2.54 117.00 116.34 1ucv n LEU 70 Ca 0.03 0.64 0.09 0.00 -0.03 0.00 0.00 56.01 56.74 1ucv n LEU 70 Cb 0.58 -0.49 0.23 0.00 -2.33 0.00 0.00 43.42 41.41 1ucv n LEU 70 CO 0.36 -0.45 0.67 0.35 -1.33 0.00 0.00 177.39 176.99 1ucv n THR 71 N -2.27 2.11 -0.70 -5.08 -2.24 -1.14 -5.04 114.28 99.92 1ucv n THR 71 Ca 0.03 -1.88 -0.31 0.00 -2.27 0.00 0.00 64.05 59.62 1ucv n THR 71 Cb 0.30 -0.19 0.17 0.00 -2.10 0.00 0.00 70.33 68.51 1ucv n THR 71 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1ucv s SER 72 N -2.04 2.73 -0.02 3.42 0.15 -1.05 -4.97 113.70 111.92 1ucv s SER 72 Ca 0.38 2.08 -0.11 0.00 0.70 0.00 0.00 55.95 59.01 1ucv s SER 72 Cb 0.31 -2.53 -0.32 0.00 -1.71 0.00 0.00 66.02 61.77 1ucv s SER 72 CO 0.08 -3.21 0.79 0.00 1.20 0.00 0.00 173.24 172.11 1ucv h THR 73 N -1.94 1.07 -1.82 6.45 1.03 -1.94 -3.48 112.91 112.28 1ucv h THR 73 Ca -0.46 -2.62 0.01 0.00 -0.01 0.00 0.00 66.41 63.33 1ucv h THR 73 Cb 1.28 2.84 -0.23 0.00 -1.07 0.00 0.00 68.15 70.96 1ucv h THR 73 CO 0.43 0.84 0.27 -1.58 -0.01 0.00 0.00 175.52 175.47 1ucv s GLN 74 N -2.59 0.68 0.00 0.00 2.00 -1.26 -5.07 119.66 113.43 1ucv s GLN 74 Ca -0.13 0.83 0.00 0.00 -2.00 0.00 0.00 55.36 54.06 1ucv s GLN 74 Cb 0.05 0.33 0.00 0.00 0.80 0.00 0.00 33.01 34.19 1ucv s GLN 74 CO 0.88 -0.08 0.00 0.41 -0.50 0.00 0.00 175.29 175.99 1ucv n GLY 75 N 2.57 0.71 3.18 2.59 0.00 -1.26 -5.16 105.19 107.81 1ucv n GLY 75 Ca -0.14 -0.72 -0.09 0.00 0.00 0.00 0.00 46.02 45.08 1ucv n GLY 75 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ucv s SER 76 N -0.94 0.27 0.00 1.61 0.01 -1.26 -5.01 113.70 108.38 1ucv s SER 76 Ca 0.00 -0.94 0.00 0.00 1.31 0.00 0.00 55.95 56.32 1ucv s SER 76 Cb 0.00 0.30 0.00 0.00 0.21 0.00 0.00 66.02 66.53 1ucv s SER 76 CO 0.00 -0.72 0.00 0.61 0.41 0.00 0.00 173.24 173.54 1ucv n GLY 77 N -0.04 0.15 0.23 3.44 0.00 -1.26 -4.98 105.19 102.73 1ucv n GLY 77 Ca -0.11 -0.41 0.01 0.00 0.00 0.00 0.00 46.02 45.51 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 0.28 -3.16 1.61 0.11 -2.07 -3.38 132.00 125.39 1ucv h PRO 78 Ca 0.00 -0.02 -0.49 0.00 0.11 0.00 0.00 66.00 65.61 1ucv h PRO 78 Cb 0.63 -0.06 -0.41 0.00 0.11 0.00 0.00 31.00 31.27 1ucv h PRO 78 CO 0.00 0.18 -0.76 0.45 -0.21 0.00 0.00 178.00 177.67 1ucv s SER 79 N -5.31 2.69 -0.21 -2.05 0.15 -1.26 -5.13 113.70 102.59 1ucv s SER 79 Ca -0.13 -0.78 -0.08 0.00 0.70 0.00 0.00 55.95 55.66 1ucv s SER 79 Cb 0.18 -0.36 -0.04 0.00 -1.71 0.00 0.00 66.02 64.08 1ucv s SER 79 CO 0.74 -0.35 0.08 -0.94 1.20 0.00 0.00 173.24 173.97 1ucv s SER 80 N 2.05 5.66 0.00 5.45 1.04 -1.26 -5.28 113.70 121.35 1ucv s SER 80 Ca 0.02 0.04 0.15 0.00 0.48 0.00 0.00 55.95 56.65 1ucv s SER 80 Cb -0.16 -1.99 0.12 0.00 0.10 0.00 0.00 66.02 64.09 1ucv s SER 80 CO -0.13 0.12 0.98 0.61 0.98 0.00 0.00 173.24 175.80