#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 4.61 -0.14 1.61 0.15 -1.26 -5.11 113.70 113.56 2yum s SER 2 Ca 0.00 -0.45 -0.00 0.00 0.70 0.00 0.00 55.95 56.20 2yum s SER 2 Cb 0.00 -0.02 0.03 0.00 -1.71 0.00 0.00 66.02 64.32 2yum s SER 2 CO 0.00 -1.67 -0.08 -0.94 1.20 0.00 0.00 173.24 171.75 2yum s SER 3 N -4.69 2.50 0.00 5.45 1.04 -1.26 -4.94 113.70 111.80 2yum s SER 3 Ca 0.64 -0.46 0.00 0.00 0.48 0.00 0.00 55.95 56.61 2yum s SER 3 Cb -0.06 -0.92 0.00 0.00 0.10 0.00 0.00 66.02 65.14 2yum s SER 3 CO 0.42 -0.13 0.00 0.61 0.98 0.00 0.00 173.24 175.12 2yum n GLY 4 N 4.89 0.00 2.96 7.32 0.00 -1.26 -5.12 105.19 113.99 2yum n GLY 4 Ca -0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.59 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 0.00 4.49 0.07 1.61 0.01 -1.26 -5.09 113.70 113.53 2yum s SER 5 Ca 0.00 -2.53 0.03 0.00 1.31 0.00 0.00 55.95 54.75 2yum s SER 5 Cb 0.00 -1.57 -0.03 0.00 0.21 0.00 0.00 66.02 64.62 2yum s SER 5 CO 0.00 -0.31 -0.09 -0.94 0.41 0.00 0.00 173.24 172.31 2yum s SER 6 N 0.38 1.14 0.00 2.44 1.04 -1.26 -5.14 113.70 112.30 2yum s SER 6 Ca 0.14 -0.74 0.00 0.00 0.48 0.00 0.00 55.95 55.83 2yum s SER 6 Cb -0.22 0.04 0.00 0.00 0.10 0.00 0.00 66.02 65.94 2yum s SER 6 CO -0.05 -0.28 0.00 0.61 0.98 0.00 0.00 173.24 174.50 2yum n GLY 7 N 0.82 1.11 0.95 7.32 0.00 -1.26 -5.06 105.19 109.08 2yum n GLY 7 Ca -0.18 -0.55 -0.01 0.00 0.00 0.00 0.00 46.02 45.28 2yum n GLY 7 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2yum n ASN 8 N 0.00 1.04 -2.45 1.61 2.85 -1.26 -4.80 115.26 112.25 2yum n ASN 8 Ca 0.00 0.14 -0.36 0.00 -0.11 0.00 0.00 54.58 54.25 2yum n ASN 8 Cb 0.00 -0.34 0.07 0.00 1.24 0.00 0.00 39.78 40.75 2yum n ASN 8 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2yum n GLN 9 N -3.45 2.73 -1.47 1.20 6.02 -1.26 -5.02 117.38 116.13 2yum n GLN 9 Ca -0.01 -3.37 -0.42 0.00 -0.01 0.00 0.00 57.00 53.19 2yum n GLN 9 Cb 0.04 -2.29 0.01 0.00 1.02 0.00 0.00 30.24 29.03 2yum n GLN 9 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.06 175.94 2yum n LEU 10 N -0.83 0.28 -4.51 1.08 0.00 -1.26 -4.93 117.00 106.84 2yum n LEU 10 Ca 0.60 0.92 -0.29 0.00 0.00 0.00 0.00 56.01 57.25 2yum n LEU 10 Cb 0.57 -1.14 0.24 0.00 0.00 0.00 0.00 43.42 43.09 2yum n LEU 10 CO 0.72 -2.73 0.53 0.26 0.00 0.00 0.00 177.39 176.18 2yum s TRP 11 N -1.44 1.26 0.10 1.96 0.52 -1.26 -5.05 118.94 115.03 2yum s TRP 11 Ca 0.63 1.01 0.09 0.00 0.02 0.00 0.00 56.10 57.86 2yum s TRP 11 Cb -0.60 -3.13 -0.04 0.00 -1.15 0.00 0.00 33.47 28.56 2yum s TRP 11 CO 0.58 -3.83 -0.23 -0.08 0.02 0.00 0.00 176.95 173.41 2yum s THR 12 N -2.58 2.49 0.20 2.01 -1.32 -1.26 -4.96 115.64 110.21 2yum s THR 12 Ca 0.68 -1.53 -0.04 0.00 -1.21 0.00 0.00 61.69 59.59 2yum s THR 12 Cb -0.22 -2.09 0.31 0.00 -1.51 0.00 0.00 72.50 69.00 2yum s THR 12 CO 0.62 0.18 1.08 0.52 -2.21 0.00 0.00 174.62 174.81 2yum n VAL 13 N 1.13 -0.29 0.18 5.08 0.31 -1.26 0.16 118.33 123.63 2yum n VAL 13 Ca -0.17 1.57 -0.15 0.00 -0.01 0.00 0.00 64.34 65.59 2yum n VAL 13 Cb 0.53 -2.20 -0.09 0.00 -0.91 0.00 0.00 33.84 31.17 2yum n VAL 13 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 2yum h GLU 14 N 0.00 -0.74 -0.88 5.55 5.08 -2.00 -1.89 114.58 119.69 2yum h GLU 14 Ca 0.35 0.05 0.07 0.00 -1.00 0.00 0.00 59.36 58.84 2yum h GLU 14 Cb 0.58 0.17 -0.07 0.00 0.50 0.00 0.00 28.75 29.93 2yum h GLU 14 CO -0.70 -0.49 0.55 0.93 -1.00 0.00 0.00 179.01 178.29 2yum h GLU 15 N -0.77 0.94 -0.03 2.33 4.39 -0.69 -0.29 114.58 120.46 2yum h GLU 15 Ca -0.03 -0.06 0.01 0.00 0.34 0.00 0.00 59.36 59.62 2yum h GLU 15 Cb 0.71 -0.21 -0.02 0.00 -0.10 0.00 0.00 28.75 29.12 2yum h GLU 15 CO -0.15 0.62 -0.20 1.96 -1.16 0.00 0.00 179.01 180.09 2yum h GLN 16 N 0.97 -0.21 -0.95 2.33 4.20 -0.15 0.34 115.11 121.64 2yum h GLN 16 Ca 0.40 0.01 0.02 0.00 0.06 0.00 0.00 58.65 59.14 2yum h GLN 16 Cb 0.23 0.05 -0.05 0.00 0.30 0.00 0.00 27.48 28.01 2yum h GLN 16 CO -0.19 -0.14 0.62 1.57 -0.67 0.00 0.00 178.83 180.02 2yum h LYS 17 N -0.22 1.22 -0.76 1.46 2.10 -1.23 -2.22 116.57 116.91 2yum h LYS 17 Ca 0.01 -0.07 0.09 0.00 -2.00 0.00 0.00 60.65 58.68 2yum h LYS 17 Cb 0.25 -0.27 -0.07 0.00 -0.90 0.00 0.00 32.23 31.24 2yum h LYS 17 CO -0.15 0.81 0.41 -0.22 -2.00 0.00 0.00 179.45 178.29 2yum h LYS 18 N 1.25 0.67 0.80 0.07 3.64 -0.47 -2.73 116.57 119.80 2yum h LYS 18 Ca 0.36 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.66 2yum h LYS 18 Cb -0.10 -0.15 0.01 0.00 -0.41 0.00 0.00 32.23 31.58 2yum h LYS 18 CO -0.09 0.44 -0.38 1.25 -2.27 0.00 0.00 179.45 178.40 2yum h LEU 19 N 0.69 -0.90 -0.83 5.20 5.85 0.24 -2.66 115.31 122.91 2yum h LEU 19 Ca 0.37 0.03 0.27 0.00 0.84 0.00 0.00 57.88 59.39 2yum h LEU 19 Cb 0.36 0.23 -0.15 0.00 0.37 0.00 0.00 40.66 41.47 2yum h LEU 19 CO -0.26 -0.54 0.17 -0.62 -0.34 0.00 0.00 178.44 176.86 2yum n GLU 20 N -5.46 -0.06 0.39 1.25 1.02 -0.97 -0.11 120.64 116.71 2yum n GLU 20 Ca -0.13 1.20 -0.16 0.00 -0.02 0.00 0.00 57.16 58.05 2yum n GLU 20 Cb 0.42 -2.00 -0.08 0.00 -0.02 0.00 0.00 31.44 29.77 2yum n GLU 20 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 2yum h GLN 21 N 0.00 -0.98 -0.79 3.49 1.08 -1.40 -3.20 115.11 113.31 2yum h GLN 21 Ca 0.57 0.07 0.16 0.00 -1.45 0.00 0.00 58.65 58.00 2yum h GLN 21 Cb 1.33 0.22 -0.15 0.00 -0.05 0.00 0.00 27.48 28.84 2yum h GLN 21 CO -0.73 -0.65 -0.19 -0.07 -0.95 0.00 0.00 178.83 176.25 2yum h LEU 22 N -1.25 -0.72 -0.93 1.46 3.38 -0.15 0.11 115.31 117.21 2yum h LEU 22 Ca -0.10 0.24 0.23 0.00 0.09 0.00 0.00 57.88 58.33 2yum h LEU 22 Cb 0.79 0.48 -0.18 0.00 0.09 0.00 0.00 40.66 41.84 2yum h LEU 22 CO 0.17 -0.26 -0.08 0.18 0.09 0.00 0.00 178.44 178.54 2yum n LEU 23 N -5.51 -0.20 0.11 1.67 4.77 -0.35 -0.20 117.00 117.29 2yum n LEU 23 Ca 0.11 1.60 -0.13 0.00 -0.03 0.00 0.00 56.01 57.56 2yum n LEU 23 Cb 0.40 -0.54 -0.08 0.00 -2.33 0.00 0.00 43.42 40.87 2yum n LEU 23 CO -0.02 -1.58 0.60 0.40 -1.33 0.00 0.00 177.39 175.45 2yum h ILE 24 N 0.00 0.87 -0.95 -0.08 2.04 -0.86 -3.12 117.51 115.42 2yum h ILE 24 Ca 0.52 -0.65 0.21 0.00 1.00 0.00 0.00 64.86 65.94 2yum h ILE 24 Cb 0.97 1.24 -0.11 0.00 -0.74 0.00 0.00 36.82 38.18 2yum h ILE 24 CO -0.91 0.14 0.52 0.50 0.00 0.00 0.00 178.15 178.40 2yum h LYS 25 N -0.62 0.58 -4.10 2.37 3.64 -0.29 -3.30 116.57 114.85 2yum h LYS 25 Ca -0.03 -0.03 -0.76 0.00 -1.27 0.00 0.00 60.65 58.56 2yum h LYS 25 Cb 0.45 -0.13 -0.25 0.00 -0.41 0.00 0.00 32.23 31.89 2yum h LYS 25 CO 0.05 0.38 -0.22 0.71 -2.27 0.00 0.00 179.45 178.10 2yum s TYR 26 N -5.86 3.29 1.01 1.91 2.02 0.66 -5.07 117.35 115.32 2yum s TYR 26 Ca -0.11 -1.38 -0.13 0.00 -0.37 0.00 0.00 57.07 55.09 2yum s TYR 26 Cb 0.25 -3.77 0.20 0.00 -0.40 0.00 0.00 41.96 38.24 2yum s TYR 26 CO 0.79 -1.02 1.09 -1.25 -1.57 0.00 0.00 175.55 173.60 2yum s PRO 27 N 1.52 0.30 0.95 -1.71 0.04 -1.25 -4.75 135.00 130.10 2yum s PRO 27 Ca 0.04 0.47 -0.12 0.00 0.04 0.00 0.00 61.00 61.43 2yum s PRO 27 Cb -0.29 -1.73 0.16 0.00 0.04 0.00 0.00 34.50 32.68 2yum s PRO 27 CO 0.02 -2.81 1.09 -1.25 0.04 0.00 0.00 177.00 174.09 2yum s PRO 28 N -4.97 0.86 0.35 0.56 0.04 -1.26 -4.98 135.00 125.60 2yum s PRO 28 Ca 0.66 0.68 -0.10 0.00 0.04 0.00 0.00 61.00 62.28 2yum s PRO 28 Cb -0.19 -1.77 0.04 0.00 0.04 0.00 0.00 34.50 32.62 2yum s PRO 28 CO 0.58 -2.48 0.64 -0.85 0.04 0.00 0.00 177.00 174.93 2yum n GLU 29 N -4.02 0.92 -0.23 4.56 0.00 -1.26 -5.05 120.64 115.56 2yum n GLU 29 Ca 0.06 -2.22 -0.07 0.00 0.00 0.00 0.00 57.16 54.92 2yum n GLU 29 Cb 0.56 2.54 0.03 0.00 0.00 0.00 0.00 31.44 34.58 2yum n GLU 29 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.13 178.18 2yum h GLU 30 N 0.00 0.97 -4.83 3.44 4.11 -2.07 -3.40 114.58 112.81 2yum h GLU 30 Ca -0.29 -0.20 -0.68 0.00 0.07 0.00 0.00 59.36 58.26 2yum h GLU 30 Cb 1.13 -0.15 -0.18 0.00 0.50 0.00 0.00 28.75 30.05 2yum h GLU 30 CO 0.38 0.85 -0.35 0.08 0.07 0.00 0.00 179.01 180.04 2yum s VAL 31 N -5.45 5.20 -0.08 -1.06 1.01 -1.26 -4.95 120.40 113.81 2yum s VAL 31 Ca -0.13 -0.14 -0.00 0.00 0.00 0.00 0.00 61.98 61.71 2yum s VAL 31 Cb 0.13 -3.83 0.05 0.00 0.00 0.00 0.00 36.38 32.74 2yum s VAL 31 CO 0.81 -0.13 1.94 1.21 0.00 0.00 0.00 175.10 178.94 2yum n GLU 32 N 5.31 1.19 0.05 2.72 4.07 -1.26 -3.79 120.64 128.93 2yum n GLU 32 Ca -0.10 -0.38 0.00 0.00 -0.06 0.00 0.00 57.16 56.62 2yum n GLU 32 Cb 0.49 -1.15 0.00 0.00 -0.06 0.00 0.00 31.44 30.72 2yum n GLU 32 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 2yum n SER 33 N 1.16 0.29 -0.05 4.31 2.88 -1.26 -4.75 113.62 116.21 2yum n SER 33 Ca 0.07 0.15 0.17 0.00 -1.33 0.00 0.00 58.87 57.93 2yum n SER 33 Cb 0.53 -0.01 0.61 0.00 -0.75 0.00 0.00 64.21 64.59 2yum n SER 33 CO 0.00 0.00 0.00 0.08 -1.23 0.00 0.00 175.04 173.89 2yum h ARG 34 N 0.00 0.17 -0.59 -1.46 0.11 -2.01 -0.77 114.38 109.84 2yum h ARG 34 Ca 0.00 -0.01 -0.01 0.00 0.10 0.00 0.00 59.98 60.06 2yum h ARG 34 Cb 0.28 -0.04 -0.03 0.00 1.11 0.00 0.00 29.97 31.30 2yum h ARG 34 CO 0.00 0.11 0.33 -0.09 0.10 0.00 0.00 179.97 180.42 2yum h ARG 35 N 0.18 0.82 -0.34 0.08 2.43 -1.87 -1.95 114.38 113.73 2yum h ARG 35 Ca 0.28 -0.09 -0.10 0.00 -0.81 0.00 0.00 59.98 59.26 2yum h ARG 35 Cb 0.85 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 30.23 2yum h ARG 35 CO -0.05 0.62 -0.17 -1.49 -1.51 0.00 0.00 179.97 177.37 2yum h TRP 36 N 0.80 0.82 -0.03 2.20 -0.00 -1.45 -2.79 115.95 115.49 2yum h TRP 36 Ca 0.21 -0.20 0.03 0.00 -0.00 0.00 0.00 58.89 58.92 2yum h TRP 36 Cb 0.03 -0.19 -0.04 0.00 -0.00 0.00 0.00 29.16 28.96 2yum h TRP 36 CO -0.01 0.92 -0.19 0.37 -0.00 0.00 0.00 178.44 179.53 2yum h GLN 37 N 0.48 -0.28 0.14 0.49 5.75 -1.20 0.15 115.11 120.64 2yum h GLN 37 Ca 0.07 0.02 0.02 0.00 -0.15 0.00 0.00 58.65 58.61 2yum h GLN 37 Cb 0.71 0.06 -0.04 0.00 1.07 0.00 0.00 27.48 29.28 2yum h GLN 37 CO 0.05 -0.18 -0.33 0.87 -2.65 0.00 0.00 178.83 176.59 2yum h LYS 38 N -0.29 -0.55 -0.49 1.69 1.57 -1.37 -1.92 116.57 115.22 2yum h LYS 38 Ca 0.07 0.04 0.07 0.00 -1.87 0.00 0.00 60.65 58.96 2yum h LYS 38 Cb 0.38 0.12 -0.06 0.00 0.08 0.00 0.00 32.23 32.75 2yum h LYS 38 CO -0.20 -0.36 0.14 0.82 -0.57 0.00 0.00 179.45 179.28 2yum h ILE 39 N -0.57 0.79 -0.30 1.86 2.04 -1.26 -2.44 117.51 117.63 2yum h ILE 39 Ca 0.03 -0.10 0.07 0.00 1.00 0.00 0.00 64.86 65.85 2yum h ILE 39 Cb 0.59 0.47 -0.08 0.00 -0.74 0.00 0.00 36.82 37.06 2yum h ILE 39 CO -0.18 0.05 -0.29 0.00 0.00 0.00 0.00 178.15 177.73 2yum h ALA 40 N 1.35 -0.19 -0.79 1.87 0.00 -0.26 0.33 119.26 121.56 2yum h ALA 40 Ca 0.24 0.08 0.15 0.00 0.00 0.00 0.00 54.91 55.38 2yum h ALA 40 Cb 0.28 0.61 -0.10 0.00 0.00 0.00 0.00 17.79 18.58 2yum h ALA 40 CO -0.27 -0.71 0.34 0.22 0.00 0.00 0.00 179.25 178.82 2yum h ASP 41 N -0.27 0.34 -0.35 0.00 3.58 -0.89 -1.00 116.42 117.82 2yum h ASP 41 Ca 0.15 0.11 -0.03 0.00 0.42 0.00 0.00 57.03 57.68 2yum h ASP 41 Cb 0.51 0.08 -0.01 0.00 1.72 0.00 0.00 39.33 41.62 2yum h ASP 41 CO -0.45 0.12 0.12 -0.33 -2.88 0.00 0.00 179.24 175.81 2yum h GLU 42 N 0.48 0.53 -0.99 0.28 4.39 -0.84 -2.77 114.58 115.66 2yum h GLU 42 Ca 0.44 -0.11 0.20 0.00 0.34 0.00 0.00 59.36 60.23 2yum h GLU 42 Cb 0.68 -0.08 -0.10 0.00 -0.10 0.00 0.00 28.75 29.15 2yum h GLU 42 CO -0.41 0.55 0.62 -0.07 -1.16 0.00 0.00 179.01 178.54 2yum h LEU 43 N 0.41 0.70 0.00 1.33 3.38 0.34 -3.47 115.31 118.00 2yum h LEU 43 Ca 0.11 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.17 2yum h LEU 43 Cb 0.24 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.94 2yum h LEU 43 CO -0.00 0.25 0.00 0.61 0.09 0.00 0.00 178.44 179.38 2yum n GLY 44 N -1.38 2.24 0.11 0.83 0.00 -0.92 -4.73 105.19 101.34 2yum n GLY 44 Ca 0.23 -0.63 -0.13 0.00 0.00 0.00 0.00 46.02 45.49 2yum n GLY 44 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2yum n ASN 45 N 0.00 0.70 -4.53 1.61 5.15 -1.26 -4.83 115.26 112.10 2yum n ASN 45 Ca 0.00 -0.04 -0.41 0.00 -0.60 0.00 0.00 54.58 53.53 2yum n ASN 45 Cb 0.00 0.50 0.02 0.00 -0.53 0.00 0.00 39.78 39.77 2yum n ASN 45 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2yum n ARG 46 N -2.93 0.90 -4.34 1.20 5.12 -1.26 -5.00 116.66 110.35 2yum n ARG 46 Ca -0.37 0.33 -0.24 0.00 -1.93 0.00 0.00 57.85 55.64 2yum n ARG 46 Cb 1.10 -1.79 -0.08 0.00 -1.16 0.00 0.00 32.46 30.53 2yum n ARG 46 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 2yum s THR 47 N -1.42 3.01 0.18 0.55 -4.23 -1.26 -4.21 115.64 108.27 2yum s THR 47 Ca 0.65 -2.04 -0.12 0.00 -1.18 0.00 0.00 61.69 59.00 2yum s THR 47 Cb -0.56 -2.71 0.22 0.00 1.34 0.00 0.00 72.50 70.79 2yum s THR 47 CO 0.56 -0.34 1.17 0.00 -0.54 0.00 0.00 174.62 175.48 2yum n ALA 48 N -0.85 -0.04 -0.00 3.99 0.00 -1.26 -0.99 120.51 121.36 2yum n ALA 48 Ca -0.05 0.77 0.00 0.00 0.00 0.00 0.00 53.44 54.16 2yum n ALA 48 Cb 0.60 -0.37 0.00 0.00 0.00 0.00 0.00 19.45 19.68 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 -5.14 0.00 -0.33 0.00 4.76 -1.26 -0.18 118.16 116.01 2yum n LYS 49 Ca 0.09 0.58 0.31 0.00 -2.87 0.00 0.00 58.31 56.41 2yum n LYS 49 Cb 0.32 -1.50 0.54 0.00 -1.84 0.00 0.00 35.03 32.55 2yum n LYS 49 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 2yum n GLN 50 N -2.15 -0.04 -0.03 1.97 1.13 -0.44 0.13 117.38 117.95 2yum n GLN 50 Ca 0.00 1.13 -0.14 0.00 -1.94 0.00 0.00 57.00 56.05 2yum n GLN 50 Cb 0.00 -2.12 -0.11 0.00 0.11 0.00 0.00 30.24 28.13 2yum n GLN 50 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 2yum h VAL 51 N 0.00 1.50 -0.64 5.09 2.07 -0.66 -2.70 116.25 120.92 2yum h VAL 51 Ca 0.74 -1.73 0.04 0.00 0.82 0.00 0.00 66.70 66.58 2yum h VAL 51 Cb 2.16 2.56 -0.05 0.00 -1.52 0.00 0.00 31.29 34.44 2yum h VAL 51 CO -0.54 0.47 0.37 0.00 0.02 0.00 0.00 177.57 177.89 2yum h ALA 52 N 0.34 0.84 0.00 1.67 0.00 0.44 0.42 119.26 122.97 2yum h ALA 52 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2yum h ALA 52 Cb 0.86 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2yum h ALA 52 CO 0.03 0.08 0.00 0.45 0.00 0.00 0.00 179.25 179.81 2yum n SER 53 N -4.76 0.28 -0.01 0.00 2.88 0.35 -2.56 113.62 109.81 2yum n SER 53 Ca 0.07 0.56 -0.06 0.00 -1.33 0.00 0.00 58.87 58.10 2yum n SER 53 Cb 0.13 -0.62 -0.13 0.00 -0.75 0.00 0.00 64.21 62.84 2yum n SER 53 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 2yum n GLN 54 N -1.80 0.63 -0.02 -1.46 -0.06 0.01 -4.26 117.38 110.43 2yum n GLN 54 Ca 0.04 0.27 -0.16 0.00 -2.00 0.00 0.00 57.00 55.15 2yum n GLN 54 Cb 0.24 -1.79 -0.10 0.00 -4.06 0.00 0.00 30.24 24.52 2yum n GLN 54 CO 0.00 0.00 0.00 0.28 -0.20 0.00 0.00 177.06 177.14 2yum h VAL 55 N 0.00 1.46 -0.94 1.69 2.07 -0.93 -2.60 116.25 117.00 2yum h VAL 55 Ca -0.26 -1.90 0.25 0.00 0.82 0.00 0.00 66.70 65.61 2yum h VAL 55 Cb 1.91 2.53 -0.17 0.00 -1.52 0.00 0.00 31.29 34.04 2yum h VAL 55 CO 0.07 0.54 0.05 0.06 0.02 0.00 0.00 177.57 178.32 2yum h GLN 56 N -0.23 0.05 -0.00 1.57 3.07 -1.70 0.11 115.11 117.98 2yum h GLN 56 Ca -0.04 -0.00 -0.04 0.00 0.09 0.00 0.00 58.65 58.66 2yum h GLN 56 Cb 1.10 -0.01 0.00 0.00 0.08 0.00 0.00 27.48 28.65 2yum h GLN 56 CO 0.08 0.03 -0.14 0.87 0.09 0.00 0.00 178.83 179.76 2yum h LYS 57 N 0.05 0.10 -0.82 0.06 1.57 -1.75 0.59 116.57 116.37 2yum h LYS 57 Ca 0.57 -0.10 0.24 0.00 -1.87 0.00 0.00 60.65 59.48 2yum h LYS 57 Cb 1.14 0.03 -0.03 0.00 0.08 0.00 0.00 32.23 33.45 2yum h LYS 57 CO -0.85 0.87 1.12 1.88 -0.57 0.00 0.00 179.45 181.89 2yum h TYR 58 N -0.63 0.00 0.00 -1.35 -1.99 -0.58 0.48 116.97 112.90 2yum h TYR 58 Ca -0.02 0.00 -0.08 0.00 2.00 0.00 0.00 58.73 60.64 2yum h TYR 58 Cb 0.91 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.63 2yum h TYR 58 CO 0.19 0.00 -1.29 1.19 -0.00 0.00 0.00 178.16 178.25 2yum n PHE 59 N -3.16 0.00 0.40 4.88 3.01 -0.83 -4.52 117.46 117.24 2yum n PHE 59 Ca 0.18 0.00 -0.02 0.00 1.01 0.00 0.00 57.45 58.62 2yum n PHE 59 Cb 1.37 -0.20 0.09 0.00 -0.01 0.00 0.00 39.48 40.73 2yum n PHE 59 CO 0.00 0.00 0.00 -0.89 1.01 0.00 0.00 176.76 176.88 2yum n ILE 60 N -2.61 1.23 0.00 4.37 5.41 0.21 -3.49 119.36 124.47 2yum n ILE 60 Ca -0.09 -0.48 0.00 0.00 1.00 0.00 0.00 62.75 63.18 2yum n ILE 60 Cb 0.60 -0.64 0.00 0.00 -0.71 0.00 0.00 39.64 38.89 2yum n ILE 60 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.55 177.72 2yum n LYS 61 N 0.10 2.43 0.00 0.38 0.00 0.15 -4.70 118.16 116.53 2yum n LYS 61 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.44 2yum n LYS 61 Cb 0.69 -0.81 0.00 0.00 0.00 0.00 0.00 35.03 34.91 2yum n LYS 61 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.40 178.87 2yum n LEU 62 N -1.38 0.07 -1.58 3.14 -0.00 -1.23 -3.85 117.00 112.18 2yum n LEU 62 Ca 0.00 -0.03 -0.03 0.00 -0.00 0.00 0.00 56.01 55.94 2yum n LEU 62 Cb 0.28 -0.03 0.01 0.00 -0.00 0.00 0.00 43.42 43.67 2yum n LEU 62 CO 0.00 0.02 1.05 1.07 -0.00 0.00 0.00 177.39 179.53 2yum n THR 63 N -0.46 2.16 -2.91 1.47 5.66 -1.26 -4.72 114.28 114.22 2yum n THR 63 Ca 0.00 -0.73 -0.19 0.00 -3.05 0.00 0.00 64.05 60.08 2yum n THR 63 Cb 0.02 -1.48 0.00 0.00 -1.55 0.00 0.00 70.33 67.33 2yum n THR 63 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 2yum n LYS 64 N 1.30 -3.22 -3.75 1.09 4.76 -1.26 -2.07 118.16 115.01 2yum n LYS 64 Ca 0.06 0.65 -0.28 0.00 -2.87 0.00 0.00 58.31 55.87 2yum n LYS 64 Cb 0.52 -5.35 -0.06 0.00 -1.84 0.00 0.00 35.03 28.29 2yum n LYS 64 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2yum n ALA 65 N -2.98 -1.18 -1.51 7.82 0.00 -1.25 -4.76 120.51 116.64 2yum n ALA 65 Ca -0.10 -0.21 -0.24 0.00 0.00 0.00 0.00 53.44 52.89 2yum n ALA 65 Cb 0.59 -1.39 0.11 0.00 0.00 0.00 0.00 19.45 18.76 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 -1.34 5.59 3.29 0.00 0.00 -0.88 -4.95 105.19 106.90 2yum n GLY 66 Ca -0.03 -1.98 -0.13 0.00 0.00 0.00 0.00 46.02 43.89 2yum n GLY 66 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2yum s ILE 67 N -4.21 -0.00 -0.01 -0.61 1.01 -1.26 -5.14 121.20 110.99 2yum s ILE 67 Ca 0.56 0.01 -0.30 0.00 0.00 0.00 0.00 60.65 60.92 2yum s ILE 67 Cb 0.46 -0.57 -0.06 0.00 0.01 0.00 0.00 42.46 42.30 2yum s ILE 67 CO 0.02 0.01 1.45 -2.16 0.00 0.00 0.00 174.94 174.26 2yum s PRO 68 N 0.37 4.26 -0.14 2.79 0.04 -1.26 -4.94 135.00 136.11 2yum s PRO 68 Ca -0.01 2.02 -0.11 0.00 0.04 0.00 0.00 61.00 62.94 2yum s PRO 68 Cb -0.04 -3.63 -0.04 0.00 0.04 0.00 0.00 34.50 30.83 2yum s PRO 68 CO -0.01 -0.63 -0.21 0.28 0.04 0.00 0.00 177.00 176.47 2yum n VAL 69 N 4.81 1.36 -3.80 -0.36 0.31 -1.26 -4.96 118.33 114.43 2yum n VAL 69 Ca 0.14 0.22 -0.34 0.00 -0.01 0.00 0.00 64.34 64.35 2yum n VAL 69 Cb 0.43 -2.34 -0.05 0.00 -0.91 0.00 0.00 33.84 30.97 2yum n VAL 69 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 2yum s SER 70 N -5.66 6.46 0.00 4.52 0.15 -1.26 -5.02 113.70 112.89 2yum s SER 70 Ca -0.17 0.49 0.00 0.00 0.70 0.00 0.00 55.95 56.97 2yum s SER 70 Cb 0.02 -2.06 0.00 0.00 -1.71 0.00 0.00 66.02 62.27 2yum s SER 70 CO 0.25 0.23 0.00 0.61 1.20 0.00 0.00 173.24 175.53 2yum n GLY 71 N 0.91 -1.36 3.56 9.45 0.00 -1.26 -5.09 105.19 111.39 2yum n GLY 71 Ca -0.10 0.73 -0.29 0.00 0.00 0.00 0.00 46.02 46.36 2yum n GLY 71 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2yum s PRO 72 N 0.00 2.57 -0.20 1.61 0.04 -1.26 -4.76 135.00 132.99 2yum s PRO 72 Ca 0.00 -0.11 -0.22 0.00 0.04 0.00 0.00 61.00 60.72 2yum s PRO 72 Cb 0.00 -4.93 -0.20 0.00 0.04 0.00 0.00 34.50 29.41 2yum s PRO 72 CO 0.00 -3.25 0.27 1.03 0.04 0.00 0.00 177.00 175.09 2yum h SER 73 N 12.04 0.02 -5.51 6.66 0.87 -2.03 -3.49 113.55 122.11 2yum h SER 73 Ca 0.02 -0.57 -0.21 0.00 -1.23 0.00 0.00 61.79 59.81 2yum h SER 73 Cb 1.04 -0.00 -0.15 0.00 -0.44 0.00 0.00 62.40 62.84 2yum h SER 73 CO 1.21 1.46 -0.61 -0.55 -0.53 0.00 0.00 176.83 177.81 2yum s SER 74 N -6.81 0.20 0.00 6.23 0.15 -1.26 -5.38 113.70 106.84 2yum s SER 74 Ca -0.28 -1.29 0.00 0.00 0.70 0.00 0.00 55.95 55.08 2yum s SER 74 Cb 0.05 0.35 0.00 0.00 -1.71 0.00 0.00 66.02 64.71 2yum s SER 74 CO 0.61 -0.81 0.00 0.61 1.20 0.00 0.00 173.24 174.85