#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yum s SER 2 N 0.00 2.80 0.05 1.61 0.01 -1.26 -5.02 113.70 111.89 2yum s SER 2 Ca 0.00 1.52 0.00 0.00 1.31 0.00 0.00 55.95 58.78 2yum s SER 2 Cb 0.00 -2.19 0.00 0.00 0.21 0.00 0.00 66.02 64.04 2yum s SER 2 CO 0.00 -3.07 0.00 -0.24 0.41 0.00 0.00 173.24 170.34 2yum n SER 3 N -4.17 0.35 0.00 2.44 2.88 -1.26 -5.10 113.62 108.77 2yum n SER 3 Ca 0.06 0.07 0.00 0.00 -1.33 0.00 0.00 58.87 57.67 2yum n SER 3 Cb 0.55 -0.09 0.00 0.00 -0.75 0.00 0.00 64.21 63.92 2yum n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yum n GLY 4 N 2.97 1.82 3.74 0.46 0.00 -1.26 -4.87 105.19 108.05 2yum n GLY 4 Ca 0.00 -0.34 -0.32 0.00 0.00 0.00 0.00 46.02 45.36 2yum n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yum s SER 5 N -4.00 4.38 0.08 1.61 0.01 -1.26 -4.98 113.70 109.54 2yum s SER 5 Ca 0.00 2.07 0.00 0.00 1.31 0.00 0.00 55.95 59.33 2yum s SER 5 Cb 0.00 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.68 2yum s SER 5 CO 0.00 -2.12 0.00 -1.20 0.41 0.00 0.00 173.24 170.33 2yum n SER 6 N -3.07 0.12 0.00 2.44 7.64 -1.26 -5.12 113.62 114.37 2yum n SER 6 Ca 0.11 0.13 0.00 0.00 1.01 0.00 0.00 58.87 60.12 2yum n SER 6 Cb 0.52 0.04 0.00 0.00 -1.01 0.00 0.00 64.21 63.76 2yum n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2yum n GLY 7 N 2.17 1.61 0.27 0.23 0.00 -1.26 -4.23 105.19 103.97 2yum n GLY 7 Ca 0.00 -0.53 -0.18 0.00 0.00 0.00 0.00 46.02 45.31 2yum n GLY 7 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2yum n ASN 8 N 5.11 1.70 -3.71 1.61 5.03 -1.26 -5.03 115.26 118.70 2yum n ASN 8 Ca 0.00 0.29 -0.11 0.00 0.87 0.00 0.00 54.58 55.63 2yum n ASN 8 Cb 0.00 -0.68 -0.12 0.00 -1.02 0.00 0.00 39.78 37.96 2yum n ASN 8 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2yum s GLN 9 N -2.56 0.30 0.12 3.52 0.00 -1.26 -5.16 119.66 114.63 2yum s GLN 9 Ca -0.29 0.66 0.04 0.00 -0.00 0.00 0.00 55.36 55.77 2yum s GLN 9 Cb 0.09 -0.06 -0.04 0.00 0.00 0.00 0.00 33.01 33.00 2yum s GLN 9 CO 0.39 -0.16 0.11 -0.51 0.00 0.00 0.00 175.29 175.12 2yum s LEU 10 N 1.29 3.80 0.65 2.60 1.43 -1.26 -5.08 118.68 122.11 2yum s LEU 10 Ca -0.09 -0.07 -0.17 0.00 -1.03 0.00 0.00 54.13 52.76 2yum s LEU 10 Cb -0.09 -2.44 -0.06 0.00 0.03 0.00 0.00 46.19 43.63 2yum s LEU 10 CO -0.10 0.12 0.59 0.79 0.23 0.00 0.00 176.35 177.98 2yum n TRP 11 N 0.06 -0.52 -2.38 0.29 7.02 -1.26 -4.99 117.44 115.64 2yum n TRP 11 Ca -0.08 0.39 -0.25 0.00 -1.02 0.00 0.00 57.50 56.54 2yum n TRP 11 Cb 0.53 -1.96 0.12 0.00 -2.42 0.00 0.00 31.31 27.58 2yum n TRP 11 CO 0.00 0.00 0.00 0.95 -2.02 0.00 0.00 177.69 176.62 2yum s THR 12 N -1.79 2.15 0.08 -0.99 -4.23 -1.26 -4.81 115.64 104.80 2yum s THR 12 Ca 0.68 -0.42 -0.21 0.00 -1.18 0.00 0.00 61.69 60.57 2yum s THR 12 Cb -0.39 -2.74 -0.10 0.00 1.34 0.00 0.00 72.50 70.61 2yum s THR 12 CO 0.55 0.00 1.62 1.62 -0.54 0.00 0.00 174.62 177.87 2yum h VAL 13 N -0.77 1.16 0.32 2.29 3.04 -1.98 0.30 116.25 120.61 2yum h VAL 13 Ca -0.40 -0.47 -0.02 0.00 -1.01 0.00 0.00 66.70 64.80 2yum h VAL 13 Cb 1.27 1.18 0.00 0.00 -2.01 0.00 0.00 31.29 31.73 2yum h VAL 13 CO 0.43 0.15 -0.15 -0.33 -1.01 0.00 0.00 177.57 176.65 2yum h GLU 14 N 0.10 -0.41 0.15 4.17 5.08 -2.00 -2.57 114.58 119.10 2yum h GLU 14 Ca 0.05 0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.43 2yum h GLU 14 Cb 0.18 0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.52 2yum h GLU 14 CO -0.00 -0.22 -0.07 0.93 -1.00 0.00 0.00 179.01 178.65 2yum h GLU 15 N -0.51 -0.19 -0.05 2.33 3.07 -1.94 -1.71 114.58 115.57 2yum h GLU 15 Ca -0.04 0.01 0.01 0.00 -0.50 0.00 0.00 59.36 58.84 2yum h GLU 15 Cb 0.38 0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.33 2yum h GLU 15 CO 0.07 -0.10 -0.05 1.96 -1.40 0.00 0.00 179.01 179.49 2yum h GLN 16 N -0.23 -0.02 -0.82 2.33 4.20 -0.37 0.27 115.11 120.46 2yum h GLN 16 Ca -0.02 0.00 0.21 0.00 0.06 0.00 0.00 58.65 58.90 2yum h GLN 16 Cb 0.18 0.01 -0.05 0.00 0.30 0.00 0.00 27.48 27.92 2yum h GLN 16 CO 0.03 -0.02 0.57 1.57 -0.67 0.00 0.00 178.83 180.32 2yum h LYS 17 N -0.03 0.20 -0.48 1.46 2.10 -1.49 0.24 116.57 118.57 2yum h LYS 17 Ca 0.01 -0.01 -0.04 0.00 -2.00 0.00 0.00 60.65 58.61 2yum h LYS 17 Cb 0.05 -0.04 -0.02 0.00 -0.90 0.00 0.00 32.23 31.32 2yum h LYS 17 CO -0.06 0.13 0.16 -0.22 -2.00 0.00 0.00 179.45 177.46 2yum h LYS 18 N 0.20 0.74 0.26 0.07 3.64 0.30 -2.66 116.57 119.13 2yum h LYS 18 Ca 0.41 -0.15 -0.01 0.00 -1.27 0.00 0.00 60.65 59.63 2yum h LYS 18 Cb 1.30 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 33.00 2yum h LYS 18 CO -0.08 0.69 -0.17 1.25 -2.27 0.00 0.00 179.45 178.86 2yum h LEU 19 N 0.64 -0.42 -0.47 5.20 5.85 0.15 -1.06 115.31 125.20 2yum h LEU 19 Ca 0.16 0.03 0.10 0.00 0.84 0.00 0.00 57.88 59.00 2yum h LEU 19 Cb 0.25 0.13 -0.10 0.00 0.37 0.00 0.00 40.66 41.31 2yum h LEU 19 CO -0.01 -0.27 -0.18 -0.33 -0.34 0.00 0.00 178.44 177.31 2yum h GLU 20 N -0.42 -0.08 -0.82 1.25 5.08 -1.44 0.23 114.58 118.37 2yum h GLU 20 Ca -0.02 0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.37 2yum h GLU 20 Cb 0.36 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.58 2yum h GLU 20 CO 0.02 -0.05 0.53 1.96 -1.00 0.00 0.00 179.01 180.47 2yum h GLN 21 N -0.08 1.01 0.06 2.33 7.50 -1.28 -2.33 115.11 122.32 2yum h GLN 21 Ca 0.22 -0.06 -0.00 0.00 0.50 0.00 0.00 58.65 59.31 2yum h GLN 21 Cb 0.43 -0.23 0.00 0.00 0.05 0.00 0.00 27.48 27.73 2yum h GLN 21 CO -0.53 0.67 -0.03 -0.07 -1.50 0.00 0.00 178.83 177.38 2yum h LEU 22 N 1.05 -0.07 -0.59 1.46 3.38 0.28 -0.74 115.31 120.07 2yum h LEU 22 Ca 0.32 -0.14 0.12 0.00 0.09 0.00 0.00 57.88 58.27 2yum h LEU 22 Cb -0.03 0.02 -0.10 0.00 0.09 0.00 0.00 40.66 40.64 2yum h LEU 22 CO -0.10 0.10 0.03 -0.07 0.09 0.00 0.00 178.44 178.48 2yum h LEU 23 N -0.23 -0.21 -0.49 1.67 3.38 -0.37 0.14 115.31 119.20 2yum h LEU 23 Ca -0.01 0.14 -0.06 0.00 0.09 0.00 0.00 57.88 58.04 2yum h LEU 23 Cb 0.20 0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 2yum h LEU 23 CO 0.01 -0.08 0.06 0.40 0.09 0.00 0.00 178.44 178.92 2yum h ILE 24 N 0.14 1.25 0.74 1.22 2.04 -1.31 -3.24 117.51 118.37 2yum h ILE 24 Ca 0.31 -0.96 -0.03 0.00 1.00 0.00 0.00 64.86 65.17 2yum h ILE 24 Cb 0.49 0.93 0.00 0.00 -0.74 0.00 0.00 36.82 37.50 2yum h ILE 24 CO -0.48 0.34 -0.42 0.50 0.00 0.00 0.00 178.15 178.09 2yum h LYS 25 N 0.69 -1.04 -6.27 2.37 3.64 0.23 -3.40 116.57 112.80 2yum h LYS 25 Ca 0.15 0.07 -0.57 0.00 -1.27 0.00 0.00 60.65 59.02 2yum h LYS 25 Cb 0.43 0.24 -0.06 0.00 -0.41 0.00 0.00 32.23 32.43 2yum h LYS 25 CO 0.01 -0.69 0.88 0.71 -2.27 0.00 0.00 179.45 178.09 2yum s TYR 26 N -6.00 3.01 0.56 1.91 1.51 0.35 -5.01 117.35 113.67 2yum s TYR 26 Ca -0.18 1.12 -0.19 0.00 -1.01 0.00 0.00 57.07 56.81 2yum s TYR 26 Cb 0.03 -3.66 -0.05 0.00 -0.11 0.00 0.00 41.96 38.17 2yum s TYR 26 CO 0.61 -1.12 1.13 -1.25 -1.11 0.00 0.00 175.55 173.81 2yum s PRO 27 N 3.70 3.27 -0.14 -1.71 0.04 -1.26 -4.77 135.00 134.13 2yum s PRO 27 Ca 0.49 1.57 -0.29 0.00 0.04 0.00 0.00 61.00 62.82 2yum s PRO 27 Cb -0.15 -2.00 -0.04 0.00 0.04 0.00 0.00 34.50 32.36 2yum s PRO 27 CO 0.16 -0.91 1.55 -1.25 0.04 0.00 0.00 177.00 176.59 2yum s PRO 28 N -3.42 4.05 0.36 0.56 0.04 -1.26 -4.97 135.00 130.37 2yum s PRO 28 Ca 0.72 1.88 0.06 0.00 0.04 0.00 0.00 61.00 63.69 2yum s PRO 28 Cb -0.23 -3.96 -0.01 0.00 0.04 0.00 0.00 34.50 30.35 2yum s PRO 28 CO 0.29 -0.98 0.51 -1.83 0.04 0.00 0.00 177.00 175.03 2yum s GLU 29 N 4.15 3.07 0.24 4.56 -1.05 -1.26 -4.99 118.70 123.42 2yum s GLU 29 Ca 0.69 -0.97 -0.08 0.00 -0.15 0.00 0.00 54.97 54.45 2yum s GLU 29 Cb -0.28 -2.78 0.38 0.00 -0.44 0.00 0.00 34.13 31.01 2yum s GLU 29 CO 0.26 -0.03 1.36 -0.85 0.95 0.00 0.00 175.26 176.95 2yum n GLU 30 N -1.73 -0.10 -3.25 -4.83 0.28 -1.26 -4.31 120.64 105.44 2yum n GLU 30 Ca 0.01 1.36 -0.32 0.00 -0.16 0.00 0.00 57.16 58.06 2yum n GLU 30 Cb 0.58 -2.03 -0.05 0.00 1.43 0.00 0.00 31.44 31.37 2yum n GLU 30 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 177.13 177.05 2yum s VAL 31 N -6.06 4.82 -0.15 3.84 1.01 -1.26 -5.01 120.40 117.59 2yum s VAL 31 Ca -0.13 0.65 0.05 0.00 0.00 0.00 0.00 61.98 62.55 2yum s VAL 31 Cb 0.23 -3.63 -0.23 0.00 0.00 0.00 0.00 36.38 32.75 2yum s VAL 31 CO 0.67 -0.17 0.23 1.21 0.00 0.00 0.00 175.10 177.04 2yum n GLU 32 N -0.38 0.69 0.07 2.72 2.13 -1.26 -4.05 120.64 120.56 2yum n GLU 32 Ca 0.02 0.19 -0.13 0.00 0.66 0.00 0.00 57.16 57.90 2yum n GLU 32 Cb 0.53 -1.64 -0.08 0.00 0.27 0.00 0.00 31.44 30.52 2yum n GLU 32 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 2yum h SER 33 N 0.02 -0.10 -0.43 4.31 4.64 -1.95 -3.00 113.55 117.04 2yum h SER 33 Ca -0.46 -0.07 0.08 0.00 -0.47 0.00 0.00 61.79 60.87 2yum h SER 33 Cb 2.04 0.03 -0.07 0.00 -0.31 0.00 0.00 62.40 64.08 2yum h SER 33 CO 0.03 0.01 -0.01 0.03 -0.87 0.00 0.00 176.83 176.02 2yum h ARG 34 N -0.20 0.09 -0.91 4.77 3.08 -1.98 -1.09 114.38 118.13 2yum h ARG 34 Ca -0.01 -0.01 0.26 0.00 0.07 0.00 0.00 59.98 60.29 2yum h ARG 34 Cb 0.17 -0.02 -0.14 0.00 0.08 0.00 0.00 29.97 30.05 2yum h ARG 34 CO 0.02 0.06 0.32 -0.09 -1.07 0.00 0.00 179.97 179.21 2yum h ARG 35 N 0.10 0.23 -0.24 0.04 2.43 -1.67 0.58 114.38 115.85 2yum h ARG 35 Ca 0.21 -0.01 -0.14 0.00 -0.81 0.00 0.00 59.98 59.23 2yum h ARG 35 Cb 0.31 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.80 2yum h ARG 35 CO -0.37 0.15 -0.44 -1.49 -1.51 0.00 0.00 179.97 176.32 2yum h TRP 36 N 0.24 0.70 -0.15 2.20 -0.00 -1.17 -2.93 115.95 114.84 2yum h TRP 36 Ca 0.60 -0.21 0.02 0.00 -0.00 0.00 0.00 58.89 59.30 2yum h TRP 36 Cb 1.26 -0.15 -0.02 0.00 -0.00 0.00 0.00 29.16 30.26 2yum h TRP 36 CO -0.20 0.92 0.02 1.96 -0.00 0.00 0.00 178.44 181.14 2yum h GLN 37 N 0.47 0.08 -0.53 0.49 1.08 0.72 0.61 115.11 118.03 2yum h GLN 37 Ca 0.03 -0.00 0.02 0.00 -1.45 0.00 0.00 58.65 57.25 2yum h GLN 37 Cb 0.95 -0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 28.33 2yum h GLN 37 CO 0.09 0.05 0.33 0.87 -0.95 0.00 0.00 178.83 179.22 2yum h LYS 38 N 0.08 0.65 0.52 1.46 1.57 -1.29 -2.30 116.57 117.27 2yum h LYS 38 Ca 0.07 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.78 2yum h LYS 38 Cb 0.06 -0.15 0.01 0.00 0.08 0.00 0.00 32.23 32.23 2yum h LYS 38 CO -0.09 0.43 -0.25 0.82 -0.57 0.00 0.00 179.45 179.79 2yum h ILE 39 N 0.67 0.47 -0.66 1.86 2.04 -1.29 -3.11 117.51 117.50 2yum h ILE 39 Ca 0.21 -0.13 0.12 0.00 1.00 0.00 0.00 64.86 66.06 2yum h ILE 39 Cb -0.02 0.53 -0.13 0.00 -0.74 0.00 0.00 36.82 36.46 2yum h ILE 39 CO -0.07 0.02 -0.26 0.00 0.00 0.00 0.00 178.15 177.84 2yum h ALA 40 N -0.34 0.22 -0.80 1.87 0.00 -0.77 -1.26 119.26 118.18 2yum h ALA 40 Ca -0.07 0.22 0.11 0.00 0.00 0.00 0.00 54.91 55.17 2yum h ALA 40 Cb 0.57 0.66 -0.12 0.00 0.00 0.00 0.00 17.79 18.91 2yum h ALA 40 CO 0.12 -0.54 -0.37 -3.47 0.00 0.00 0.00 179.25 174.99 2yum n ASP 41 N -5.46 -0.63 0.14 0.00 -0.08 -0.88 -0.08 116.55 109.57 2yum n ASP 41 Ca 0.07 1.41 -0.14 0.00 -1.51 0.00 0.00 54.79 54.61 2yum n ASP 41 Cb 0.36 -0.28 -0.07 0.00 2.34 0.00 0.00 41.12 43.48 2yum n ASP 41 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 2yum h GLU 42 N 0.00 -0.61 -0.15 -0.67 4.39 -1.30 -2.82 114.58 113.42 2yum h GLU 42 Ca 0.23 0.04 0.05 0.00 0.34 0.00 0.00 59.36 60.02 2yum h GLU 42 Cb 0.43 0.14 -0.06 0.00 -0.10 0.00 0.00 28.75 29.15 2yum h GLU 42 CO -0.78 -0.40 -0.31 -0.07 -1.16 0.00 0.00 179.01 176.28 2yum h LEU 43 N -0.63 -0.98 0.00 1.33 3.38 -0.39 -3.46 115.31 114.57 2yum h LEU 43 Ca 0.02 0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.13 2yum h LEU 43 Cb 0.64 0.42 0.00 0.00 0.09 0.00 0.00 40.66 41.81 2yum h LEU 43 CO -0.19 -0.35 0.00 0.61 0.09 0.00 0.00 178.44 178.60 2yum n GLY 44 N -1.41 2.15 0.11 0.83 0.00 0.62 -4.68 105.19 102.82 2yum n GLY 44 Ca -0.03 -0.41 -0.18 0.00 0.00 0.00 0.00 46.02 45.40 2yum n GLY 44 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2yum h ASN 45 N 0.00 0.38 -4.32 1.61 -0.73 -1.89 -3.47 115.58 107.17 2yum h ASN 45 Ca 0.00 -0.91 -0.46 0.00 1.87 0.00 0.00 56.30 56.80 2yum h ASN 45 Cb 0.00 -0.12 0.11 0.00 0.27 0.00 0.00 38.32 38.58 2yum h ASN 45 CO 0.00 1.26 0.38 -0.13 -0.37 0.00 0.00 177.43 178.57 2yum s ARG 46 N -2.61 1.71 0.06 6.67 1.81 -1.26 -5.11 118.95 120.22 2yum s ARG 46 Ca -0.15 -0.08 -0.00 0.00 -1.72 0.00 0.00 55.73 53.79 2yum s ARG 46 Cb 0.01 -1.97 -0.04 0.00 -0.45 0.00 0.00 34.95 32.50 2yum s ARG 46 CO 0.80 -1.71 -0.04 0.95 -0.68 0.00 0.00 175.30 174.61 2yum s THR 47 N -3.59 0.34 0.17 0.02 -4.23 -1.26 -4.75 115.64 102.35 2yum s THR 47 Ca 0.64 -1.69 -0.11 0.00 -1.18 0.00 0.00 61.69 59.34 2yum s THR 47 Cb -0.09 -1.36 0.19 0.00 1.34 0.00 0.00 72.50 72.58 2yum s THR 47 CO 0.49 -0.87 1.10 0.00 -0.54 0.00 0.00 174.62 174.80 2yum n ALA 48 N 0.33 -0.05 -0.02 3.99 0.00 -1.26 -0.02 120.51 123.47 2yum n ALA 48 Ca -0.15 0.72 0.00 0.00 0.00 0.00 0.00 53.44 54.01 2yum n ALA 48 Cb 0.60 -0.34 0.00 0.00 0.00 0.00 0.00 19.45 19.71 2yum n ALA 48 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2yum n LYS 49 N -5.06 0.00 -0.56 0.00 4.76 -1.26 -0.57 118.16 115.47 2yum n LYS 49 Ca 0.08 0.53 0.45 0.00 -2.87 0.00 0.00 58.31 56.50 2yum n LYS 49 Cb 0.29 -1.49 0.76 0.00 -1.84 0.00 0.00 35.03 32.76 2yum n LYS 49 CO 0.00 0.00 0.00 1.96 -1.37 0.00 0.00 177.40 177.99 2yum h GLN 50 N 0.00 0.03 -0.03 1.97 4.20 -1.59 1.22 115.11 120.91 2yum h GLN 50 Ca 0.00 -0.00 -0.26 0.00 0.06 0.00 0.00 58.65 58.45 2yum h GLN 50 Cb 0.00 -0.01 0.02 0.00 0.30 0.00 0.00 27.48 27.79 2yum h GLN 50 CO 0.00 0.02 -0.99 0.28 -0.67 0.00 0.00 178.83 177.47 2yum h VAL 51 N 0.03 1.28 -0.23 -0.54 2.07 -0.03 -3.18 116.25 115.64 2yum h VAL 51 Ca 0.84 -2.19 0.03 0.00 0.82 0.00 0.00 66.70 66.21 2yum h VAL 51 Cb 3.15 2.30 -0.03 0.00 -1.52 0.00 0.00 31.29 35.19 2yum h VAL 51 CO -0.14 0.68 0.03 0.00 0.02 0.00 0.00 177.57 178.16 2yum h ALA 52 N 0.43 0.23 -0.50 1.67 0.00 0.40 -0.56 119.26 120.94 2yum h ALA 52 Ca -0.11 0.05 0.07 0.00 0.00 0.00 0.00 54.91 54.91 2yum h ALA 52 Cb 1.64 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 19.44 2yum h ALA 52 CO 0.20 -0.39 0.18 1.03 0.00 0.00 0.00 179.25 180.26 2yum h SER 53 N 0.12 0.18 -0.29 0.00 0.87 -1.51 -2.19 113.55 110.72 2yum h SER 53 Ca 0.11 0.06 -0.01 0.00 -1.23 0.00 0.00 61.79 60.72 2yum h SER 53 Cb 0.11 0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 62.10 2yum h SER 53 CO -0.15 0.13 0.16 -0.61 -0.53 0.00 0.00 176.83 175.83 2yum h GLN 54 N 0.35 0.40 -0.95 2.24 5.75 -1.43 -2.68 115.11 118.80 2yum h GLN 54 Ca 0.24 -0.05 0.18 0.00 -0.15 0.00 0.00 58.65 58.87 2yum h GLN 54 Cb 0.25 -0.08 -0.10 0.00 1.07 0.00 0.00 27.48 28.62 2yum h GLN 54 CO -0.24 0.35 0.54 0.28 -2.65 0.00 0.00 178.83 177.10 2yum h VAL 55 N 0.35 0.69 -0.38 2.39 2.07 -0.53 -0.89 116.25 119.94 2yum h VAL 55 Ca 0.10 -0.24 0.06 0.00 0.82 0.00 0.00 66.70 67.45 2yum h VAL 55 Cb 0.07 -0.06 -0.05 0.00 -1.52 0.00 0.00 31.29 29.73 2yum h VAL 55 CO -0.02 0.13 0.06 1.56 0.02 0.00 0.00 177.57 179.32 2yum h GLN 56 N 0.69 0.17 -0.98 1.57 4.20 -1.06 0.19 115.11 119.89 2yum h GLN 56 Ca 0.54 -0.01 -0.09 0.00 0.06 0.00 0.00 58.65 59.16 2yum h GLN 56 Cb 0.84 -0.04 -0.05 0.00 0.30 0.00 0.00 27.48 28.53 2yum h GLN 56 CO -0.39 0.11 0.11 1.63 -0.67 0.00 0.00 178.83 179.62 2yum n LYS 57 N -5.12 1.42 0.00 1.46 5.02 -0.36 -1.75 118.16 118.84 2yum n LYS 57 Ca 0.02 -0.67 0.00 0.00 -2.02 0.00 0.00 58.31 55.64 2yum n LYS 57 Cb 0.18 -1.36 0.00 0.00 -0.02 0.00 0.00 35.03 33.83 2yum n LYS 57 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2yum n TYR 58 N 0.14 0.00 -0.04 2.13 4.02 -0.02 -4.67 117.16 118.71 2yum n TYR 58 Ca 0.11 0.00 -0.07 0.00 -0.01 0.00 0.00 57.90 57.93 2yum n TYR 58 Cb 0.68 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.97 2yum n TYR 58 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 2yum n PHE 59 N -1.55 0.00 -0.04 -0.72 3.01 -0.72 -4.60 117.46 112.84 2yum n PHE 59 Ca 0.00 0.00 -0.14 0.00 1.01 0.00 0.00 57.45 58.32 2yum n PHE 59 Cb 0.31 -0.32 -0.02 0.00 -0.01 0.00 0.00 39.48 39.44 2yum n PHE 59 CO 0.00 0.00 0.00 0.82 1.01 0.00 0.00 176.76 178.59 2yum h ILE 60 N -0.10 1.29 -0.82 4.37 2.04 -1.54 -3.18 117.51 119.58 2yum h ILE 60 Ca -0.20 -1.81 0.14 0.00 1.00 0.00 0.00 64.86 63.99 2yum h ILE 60 Cb 1.26 1.74 -0.09 0.00 -0.74 0.00 0.00 36.82 38.99 2yum h ILE 60 CO -0.06 0.58 0.40 0.50 0.00 0.00 0.00 178.15 179.56 2yum h LYS 61 N 0.58 0.56 -0.70 2.37 3.64 -1.80 -0.26 116.57 120.96 2yum h LYS 61 Ca -0.00 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.31 2yum h LYS 61 Cb 1.20 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.86 2yum h LYS 61 CO 0.13 0.37 0.31 -0.07 -2.27 0.00 0.00 179.45 177.92 2yum h LEU 62 N 0.58 0.93 0.77 5.20 3.38 -1.80 -3.18 115.31 121.19 2yum h LEU 62 Ca 0.44 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 58.23 2yum h LEU 62 Cb 0.63 -0.24 0.01 0.00 0.09 0.00 0.00 40.66 41.15 2yum h LEU 62 CO -0.37 0.82 -0.37 0.74 0.09 0.00 0.00 178.44 179.35 2yum h THR 63 N 0.98 0.17 -6.85 0.22 2.02 -1.10 -3.46 112.91 104.89 2yum h THR 63 Ca 0.24 -0.12 -0.57 0.00 0.77 0.00 0.00 66.41 66.72 2yum h THR 63 Cb 0.15 0.20 -0.15 0.00 -1.74 0.00 0.00 68.15 66.61 2yum h THR 63 CO -0.03 0.01 -0.93 1.17 0.37 0.00 0.00 175.52 176.11 2yum n LYS 64 N -5.50 -1.92 -2.46 6.66 3.00 -0.44 -4.94 118.16 112.56 2yum n LYS 64 Ca -0.14 0.22 -0.12 0.00 -0.00 0.00 0.00 58.31 58.27 2yum n LYS 64 Cb 0.42 -4.01 0.01 0.00 0.00 0.00 0.00 35.03 31.45 2yum n LYS 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2yum n ALA 65 N -4.50 0.48 -0.24 3.14 0.00 -1.26 -4.93 120.51 113.19 2yum n ALA 65 Ca -0.31 -1.08 0.28 0.00 0.00 0.00 0.00 53.44 52.33 2yum n ALA 65 Cb 0.69 0.40 0.43 0.00 0.00 0.00 0.00 19.45 20.97 2yum n ALA 65 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2yum n GLY 66 N 1.63 -0.72 2.36 0.00 0.00 -1.26 -4.62 105.19 102.58 2yum n GLY 66 Ca 0.02 0.37 -0.38 0.00 0.00 0.00 0.00 46.02 46.02 2yum n GLY 66 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2yum n ILE 67 N -3.15 0.38 -1.10 -0.61 5.41 -1.26 -4.90 119.36 114.13 2yum n ILE 67 Ca 0.23 -0.10 -0.30 0.00 1.00 0.00 0.00 62.75 63.59 2yum n ILE 67 Cb 1.46 0.00 0.23 0.00 -0.71 0.00 0.00 39.64 40.62 2yum n ILE 67 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 2yum s PRO 68 N -0.19 -0.87 -0.17 0.38 0.04 -1.26 -5.06 135.00 127.88 2yum s PRO 68 Ca 0.57 0.06 0.00 0.00 0.04 0.00 0.00 61.00 61.67 2yum s PRO 68 Cb -0.80 -1.63 0.03 0.00 0.04 0.00 0.00 34.50 32.15 2yum s PRO 68 CO 0.39 -3.50 -0.12 0.54 0.04 0.00 0.00 177.00 174.35 2yum s VAL 69 N -3.00 1.53 0.09 -0.36 0.11 -1.26 -5.11 120.40 112.41 2yum s VAL 69 Ca 0.70 -0.74 0.03 0.00 -2.93 0.00 0.00 61.98 59.03 2yum s VAL 69 Cb -0.12 -1.52 -0.04 0.00 -1.53 0.00 0.00 36.38 33.17 2yum s VAL 69 CO 0.56 0.33 0.11 -0.44 -3.33 0.00 0.00 175.10 172.33 2yum s SER 70 N 1.48 5.65 0.00 3.54 0.01 -1.26 -5.11 113.70 118.01 2yum s SER 70 Ca 0.03 0.01 -0.05 0.00 1.31 0.00 0.00 55.95 57.25 2yum s SER 70 Cb -0.14 -1.55 -0.04 0.00 0.21 0.00 0.00 66.02 64.49 2yum s SER 70 CO -0.09 0.15 0.24 -0.83 0.41 0.00 0.00 173.24 173.12 2yum s GLY 71 N -2.53 2.22 0.10 3.44 0.00 -1.26 -4.98 107.32 104.31 2yum s GLY 71 Ca 0.30 -0.65 -0.15 0.00 0.00 0.00 0.00 44.72 44.22 2yum s GLY 71 CO 0.23 -0.50 1.42 -0.56 0.00 0.00 0.00 173.10 173.69 2yum h PRO 72 N 3.88 0.69 -0.01 2.90 0.13 -1.99 -2.03 132.00 135.56 2yum h PRO 72 Ca -0.49 -0.36 0.00 0.00 -0.87 0.00 0.00 66.00 64.27 2yum h PRO 72 Cb 1.19 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.33 2yum h PRO 72 CO 0.67 0.97 -0.01 1.03 -0.23 0.00 0.00 178.00 180.44 2yum h SER 73 N 0.42 -0.02 0.00 1.44 0.87 -2.07 -3.40 113.55 110.79 2yum h SER 73 Ca 0.05 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.61 2yum h SER 73 Cb 0.85 0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.81 2yum h SER 73 CO 0.07 -0.00 -0.63 -1.54 -0.53 0.00 0.00 176.83 174.20 2yum n SER 74 N -2.77 2.66 0.00 6.23 3.41 -1.25 -5.32 113.62 116.57 2yum n SER 74 Ca -0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2yum n SER 74 Cb 0.00 0.07 0.00 0.00 -0.26 0.00 0.00 64.21 64.03 2yum n SER 74 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49