#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 4.37 -0.31 1.61 0.01 -1.26 -4.98 113.70 113.13 2yum s SER 2 Ca 0.00 -0.62 0.08 0.00 1.31 0.00 0.00 55.95 56.72 2yum s SER 2 Cb 0.00 -1.72 0.46 0.00 0.21 0.00 0.00 66.02 64.97 2yum s SER 2 CO 0.00 -0.08 1.16 -1.54 0.41 0.00 0.00 173.24 173.19 2yum n SER 3 N 4.75 4.52 0.00 2.44 3.41 -1.26 -5.08 113.62 122.40 2yum n SER 3 Ca -0.17 -3.57 0.00 0.00 -0.26 0.00 0.00 58.87 54.87 2yum n SER 3 Cb 0.49 -0.38 0.00 0.00 -0.26 0.00 0.00 64.21 64.06 2yum n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2yum n GLY 4 N -0.64 0.22 3.36 5.00 0.00 -1.26 -4.92 105.19 106.94 2yum n GLY 4 Ca 0.39 -1.85 -0.45 0.00 0.00 0.00 0.00 46.02 44.12 2yum n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2yum s SER 5 N -4.00 6.17 0.20 1.61 1.04 -1.26 -5.02 113.70 112.44 2yum s SER 5 Ca 0.00 -1.49 -0.22 0.00 0.48 0.00 0.00 55.95 54.72 2yum s SER 5 Cb 0.00 -2.21 0.05 0.00 0.10 0.00 0.00 66.02 63.96 2yum s SER 5 CO 0.00 -0.78 0.62 -0.55 0.98 0.00 0.00 173.24 173.51 2yum s SER 6 N 3.08 -0.44 0.00 7.02 0.15 -1.26 -5.16 113.70 117.10 2yum s SER 6 Ca 0.05 -0.23 0.00 0.00 0.70 0.00 0.00 55.95 56.46 2yum s SER 6 Cb -0.26 0.63 0.00 0.00 -1.71 0.00 0.00 66.02 64.68 2yum s SER 6 CO 0.05 -1.09 0.00 0.61 1.20 0.00 0.00 173.24 174.02 2yum n GLY 7 N -0.40 3.75 0.04 9.45 0.00 -1.26 -5.02 105.19 111.76 2yum n GLY 7 Ca -0.12 -1.11 -0.02 0.00 0.00 0.00 0.00 46.02 44.76 2yum n GLY 7 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2yum h ASN 8 N 0.00 0.00 -2.49 1.61 -0.73 -2.04 -3.42 115.58 108.50 2yum h ASN 8 Ca 0.00 0.00 -0.72 0.00 1.87 0.00 0.00 56.30 57.45 2yum h ASN 8 Cb 0.00 0.00 -0.34 0.00 0.27 0.00 0.00 38.32 38.25 2yum h ASN 8 CO 0.00 0.47 0.23 0.00 -0.37 0.00 0.00 177.43 177.76 2yum n GLN 9 N -3.83 3.91 -4.05 6.67 3.00 -1.26 -5.03 117.38 116.79 2yum n GLN 9 Ca -0.04 -4.66 -0.22 0.00 -0.01 0.00 0.00 57.00 52.08 2yum n GLN 9 Cb 0.14 -2.39 -0.04 0.00 0.00 0.00 0.00 30.24 27.95 2yum n GLN 9 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 2yum s LEU 10 N -3.08 3.69 0.31 1.08 1.43 -1.26 -5.11 118.68 115.75 2yum s LEU 10 Ca 0.38 -0.36 -0.26 0.00 -1.03 0.00 0.00 54.13 52.85 2yum s LEU 10 Cb 0.14 -2.24 -0.10 0.00 0.03 0.00 0.00 46.19 44.02 2yum s LEU 10 CO -0.00 -0.13 0.94 0.26 0.23 0.00 0.00 176.35 177.65 2yum s TRP 11 N -2.20 3.71 0.09 0.29 0.52 -1.26 -5.06 118.94 115.03 2yum s TRP 11 Ca 0.35 1.78 -0.06 0.00 0.02 0.00 0.00 56.10 58.19 2yum s TRP 11 Cb -0.07 -2.92 -0.05 0.00 -1.15 0.00 0.00 33.47 29.28 2yum s TRP 11 CO 0.25 0.23 0.35 -0.08 0.02 0.00 0.00 176.95 177.72 2yum s THR 12 N -1.58 5.19 0.27 2.01 -1.32 -1.26 -4.93 115.64 114.01 2yum s THR 12 Ca 0.49 0.14 -0.05 0.00 -1.21 0.00 0.00 61.69 61.06 2yum s THR 12 Cb -0.19 -3.62 0.41 0.00 -1.51 0.00 0.00 72.50 67.60 2yum s THR 12 CO 0.24 0.17 1.44 0.55 -2.21 0.00 0.00 174.62 174.82 2yum n VAL 13 N 0.52 -0.39 -0.02 5.08 3.14 -1.26 -1.22 118.33 124.18 2yum n VAL 13 Ca -0.06 2.09 -0.02 0.00 -2.96 0.00 0.00 64.34 63.39 2yum n VAL 13 Cb 0.52 -2.93 -0.02 0.00 -1.06 0.00 0.00 33.84 30.35 2yum n VAL 13 CO 0.00 0.00 0.00 -0.33 -6.46 0.00 0.00 176.83 170.04 2yum h GLU 14 N 0.00 -0.06 -0.35 1.45 4.39 -2.01 -2.35 114.58 115.65 2yum h GLU 14 Ca 0.48 0.00 0.07 0.00 0.34 0.00 0.00 59.36 60.25 2yum h GLU 14 Cb 0.82 0.01 -0.09 0.00 -0.10 0.00 0.00 28.75 29.40 2yum h GLU 14 CO -0.92 -0.04 -0.33 0.93 -1.16 0.00 0.00 179.01 177.49 2yum h GLU 15 N -0.06 -0.27 -0.82 2.33 4.39 -1.56 -0.11 114.58 118.47 2yum h GLU 15 Ca 0.01 0.02 0.34 0.00 0.34 0.00 0.00 59.36 60.07 2yum h GLU 15 Cb 0.09 0.06 -0.15 0.00 -0.10 0.00 0.00 28.75 28.66 2yum h GLU 15 CO -0.09 -0.18 0.41 1.04 -1.16 0.00 0.00 179.01 179.03 2yum n GLN 16 N -5.41 -0.05 0.09 2.33 6.02 -0.66 -0.46 117.38 119.24 2yum n GLN 16 Ca 0.00 1.14 -0.04 0.00 -0.01 0.00 0.00 57.00 58.09 2yum n GLN 16 Cb 0.33 -2.03 -0.02 0.00 1.02 0.00 0.00 30.24 29.54 2yum n GLN 16 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.06 176.92 2yum h LYS 17 N 0.00 -0.26 -0.96 -1.09 1.57 -0.53 -2.50 116.57 112.79 2yum h LYS 17 Ca 0.68 0.02 0.30 0.00 -1.87 0.00 0.00 60.65 59.78 2yum h LYS 17 Cb 1.79 0.06 -0.17 0.00 0.08 0.00 0.00 32.23 34.00 2yum h LYS 17 CO -0.64 -0.17 0.28 -0.22 -0.57 0.00 0.00 179.45 178.12 2yum h LYS 18 N -0.55 0.10 -0.27 3.15 3.64 -0.70 0.47 116.57 122.42 2yum h LYS 18 Ca -0.03 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 2yum h LYS 18 Cb 0.21 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.99 2yum h LYS 18 CO 0.05 0.07 0.13 1.25 -2.27 0.00 0.00 179.45 178.67 2yum h LEU 19 N 0.10 0.35 -0.60 5.20 5.85 -0.84 0.48 115.31 125.86 2yum h LEU 19 Ca 0.66 -0.12 0.10 0.00 0.84 0.00 0.00 57.88 59.36 2yum h LEU 19 Cb 1.49 -0.09 -0.08 0.00 0.37 0.00 0.00 40.66 42.35 2yum h LEU 19 CO -0.77 0.37 0.18 -0.33 -0.34 0.00 0.00 178.44 177.56 2yum h GLU 20 N 0.30 0.33 0.09 1.25 5.08 0.39 0.20 114.58 122.23 2yum h GLU 20 Ca 0.09 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.43 2yum h GLU 20 Cb 0.11 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.29 2yum h GLU 20 CO -0.01 0.22 -0.05 1.96 -1.00 0.00 0.00 179.01 180.13 2yum h GLN 21 N 0.34 -0.12 -0.49 2.33 1.08 -1.14 -3.26 115.11 113.85 2yum h GLN 21 Ca 0.31 0.01 0.09 0.00 -1.45 0.00 0.00 58.65 57.61 2yum h GLN 21 Cb 0.41 0.03 -0.08 0.00 -0.05 0.00 0.00 27.48 27.79 2yum h GLN 21 CO -0.34 0.30 0.01 -0.07 -0.95 0.00 0.00 178.83 177.78 2yum h LEU 22 N -0.59 -0.19 -0.99 1.46 3.38 -0.53 -0.99 115.31 116.87 2yum h LEU 22 Ca -0.01 0.11 0.33 0.00 0.09 0.00 0.00 57.88 58.40 2yum h LEU 22 Cb 0.48 0.20 -0.18 0.00 0.09 0.00 0.00 40.66 41.25 2yum h LEU 22 CO 0.02 -0.06 0.26 -0.07 0.09 0.00 0.00 178.44 178.68 2yum h LEU 23 N 0.13 -0.10 0.02 1.67 3.38 -0.64 0.42 115.31 120.18 2yum h LEU 23 Ca 0.25 0.26 -0.15 0.00 0.09 0.00 0.00 57.88 58.34 2yum h LEU 23 Cb 0.37 0.38 0.01 0.00 0.09 0.00 0.00 40.66 41.51 2yum h LEU 23 CO -0.40 -0.37 -0.58 0.40 0.09 0.00 0.00 178.44 177.58 2yum h ILE 24 N 0.03 1.45 -0.98 1.22 2.04 -1.29 -3.28 117.51 116.70 2yum h ILE 24 Ca 0.70 -2.12 0.13 0.00 1.00 0.00 0.00 64.86 64.57 2yum h ILE 24 Cb 1.64 2.70 -0.08 0.00 -0.74 0.00 0.00 36.82 40.33 2yum h ILE 24 CO -0.83 0.61 0.62 0.50 0.00 0.00 0.00 178.15 179.04 2yum h LYS 25 N -0.19 0.89 -3.97 2.37 3.11 0.45 -3.31 116.57 115.93 2yum h LYS 25 Ca -0.08 -0.05 -0.75 0.00 -2.81 0.00 0.00 60.65 56.96 2yum h LYS 25 Cb 1.31 -0.20 -0.28 0.00 -1.00 0.00 0.00 32.23 32.06 2yum h LYS 25 CO 0.11 0.59 -0.18 0.71 -2.81 0.00 0.00 179.45 177.87 2yum s TYR 26 N -5.89 3.51 0.88 1.91 2.02 0.82 -5.07 117.35 115.52 2yum s TYR 26 Ca -0.11 -1.95 -0.11 0.00 -0.37 0.00 0.00 57.07 54.52 2yum s TYR 26 Cb 0.22 -3.62 0.12 0.00 -0.40 0.00 0.00 41.96 38.28 2yum s TYR 26 CO 0.80 -0.97 1.09 -1.25 -1.57 0.00 0.00 175.55 173.65 2yum s PRO 27 N 0.73 1.38 0.31 -1.71 0.04 -1.25 -4.79 135.00 129.72 2yum s PRO 27 Ca 0.11 0.86 -0.29 0.00 0.04 0.00 0.00 61.00 61.73 2yum s PRO 27 Cb -0.20 -1.82 -0.10 0.00 0.04 0.00 0.00 34.50 32.42 2yum s PRO 27 CO -0.03 -2.17 1.23 -1.25 0.04 0.00 0.00 177.00 174.82 2yum s PRO 28 N -4.93 4.45 0.31 0.56 0.04 -1.26 -4.93 135.00 129.24 2yum s PRO 28 Ca 0.63 2.05 0.03 0.00 0.04 0.00 0.00 61.00 63.75 2yum s PRO 28 Cb -0.18 -3.11 -0.04 0.00 0.04 0.00 0.00 34.50 31.21 2yum s PRO 28 CO 0.57 -0.04 0.13 -1.83 0.04 0.00 0.00 177.00 175.86 2yum s GLU 29 N -1.68 1.61 0.26 4.56 -1.05 -1.26 -5.04 118.70 116.10 2yum s GLU 29 Ca 0.47 -1.91 -0.08 0.00 -0.15 0.00 0.00 54.97 53.30 2yum s GLU 29 Cb -0.37 -0.31 0.43 0.00 -0.44 0.00 0.00 34.13 33.44 2yum s GLU 29 CO 0.48 -0.38 1.59 1.05 0.95 0.00 0.00 175.26 178.95 2yum h GLU 30 N 2.18 0.01 -4.44 -4.83 4.11 -2.06 -3.30 114.58 106.25 2yum h GLU 30 Ca -0.36 -0.00 -0.72 0.00 0.07 0.00 0.00 59.36 58.35 2yum h GLU 30 Cb 1.25 -0.00 -0.23 0.00 0.50 0.00 0.00 28.75 30.27 2yum h GLU 30 CO 0.57 0.01 -0.41 0.08 0.07 0.00 0.00 179.01 179.32 2yum s VAL 31 N -6.21 5.03 0.34 -1.06 1.01 -1.26 -4.94 120.40 113.31 2yum s VAL 31 Ca -0.14 -0.91 0.04 0.00 0.00 0.00 0.00 61.98 60.97 2yum s VAL 31 Cb 0.25 -3.90 0.17 0.00 0.00 0.00 0.00 36.38 32.90 2yum s VAL 31 CO 0.76 -0.41 1.89 -0.08 0.00 0.00 0.00 175.10 177.26 2yum h GLU 32 N 8.62 0.54 0.13 2.72 4.81 -2.00 -3.12 114.58 126.28 2yum h GLU 32 Ca -0.27 -0.10 0.01 0.00 -0.13 0.00 0.00 59.36 58.87 2yum h GLU 32 Cb 1.11 -0.08 -0.05 0.00 0.63 0.00 0.00 28.75 30.36 2yum h GLU 32 CO 0.77 0.54 -0.53 1.03 -0.73 0.00 0.00 179.01 180.10 2yum h SER 33 N 0.52 -1.59 -0.42 1.04 0.87 -1.93 -2.44 113.55 109.61 2yum h SER 33 Ca 0.12 0.17 0.09 0.00 -1.23 0.00 0.00 61.79 60.93 2yum h SER 33 Cb 0.28 0.58 -0.09 0.00 -0.44 0.00 0.00 62.40 62.74 2yum h SER 33 CO 0.00 -0.56 -0.23 0.03 -0.53 0.00 0.00 176.83 175.54 2yum h ARG 34 N -0.76 -0.15 -0.97 2.24 3.08 -1.97 -0.41 114.38 115.44 2yum h ARG 34 Ca -0.01 0.01 0.28 0.00 0.07 0.00 0.00 59.98 60.34 2yum h ARG 34 Cb 0.76 0.03 -0.18 0.00 0.08 0.00 0.00 29.97 30.67 2yum h ARG 34 CO -0.28 -0.10 0.13 -0.09 -1.07 0.00 0.00 179.97 178.56 2yum h ARG 35 N -0.15 0.04 -0.12 0.04 2.43 -1.42 0.38 114.38 115.58 2yum h ARG 35 Ca 0.20 -0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.32 2yum h ARG 35 Cb 0.47 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 30.00 2yum h ARG 35 CO -0.51 0.03 -0.12 -1.49 -1.51 0.00 0.00 179.97 176.37 2yum h TRP 36 N 0.04 0.35 -0.76 2.20 -0.00 -0.80 -2.76 115.95 114.23 2yum h TRP 36 Ca 0.62 -0.11 0.12 0.00 -0.00 0.00 0.00 58.89 59.53 2yum h TRP 36 Cb 1.34 -0.07 -0.08 0.00 -0.00 0.00 0.00 29.16 30.34 2yum h TRP 36 CO -0.39 0.70 0.36 0.37 -0.00 0.00 0.00 178.44 179.47 2yum h GLN 37 N -0.09 0.54 -0.34 0.49 5.75 0.49 0.87 115.11 122.81 2yum h GLN 37 Ca 0.02 -0.03 -0.01 0.00 -0.15 0.00 0.00 58.65 58.47 2yum h GLN 37 Cb 0.64 -0.12 -0.02 0.00 1.07 0.00 0.00 27.48 29.05 2yum h GLN 37 CO 0.03 0.36 0.16 0.87 -2.65 0.00 0.00 178.83 177.59 2yum h LYS 38 N 0.55 0.49 -0.69 1.69 1.57 -0.85 -2.56 116.57 116.79 2yum h LYS 38 Ca 0.40 -0.08 -0.02 0.00 -1.87 0.00 0.00 60.65 59.08 2yum h LYS 38 Cb 0.53 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.72 2yum h LYS 38 CO -0.34 0.46 0.35 0.82 -0.57 0.00 0.00 179.45 180.17 2yum h ILE 39 N 0.41 1.22 0.40 1.86 2.04 -0.98 -3.13 117.51 119.34 2yum h ILE 39 Ca 0.12 -0.61 -0.01 0.00 1.00 0.00 0.00 64.86 65.36 2yum h ILE 39 Cb 0.13 0.36 -0.03 0.00 -0.74 0.00 0.00 36.82 36.54 2yum h ILE 39 CO -0.01 0.26 -0.47 0.00 0.00 0.00 0.00 178.15 177.93 2yum h ALA 40 N 1.17 -1.01 -0.74 1.87 0.00 -0.66 -2.83 119.26 117.06 2yum h ALA 40 Ca 0.24 -0.16 0.09 0.00 0.00 0.00 0.00 54.91 55.08 2yum h ALA 40 Cb 0.09 0.69 -0.10 0.00 0.00 0.00 0.00 17.79 18.47 2yum h ALA 40 CO -0.03 -1.11 -0.36 -3.47 0.00 0.00 0.00 179.25 174.27 2yum n ASP 41 N -5.53 -0.63 -0.03 0.00 2.03 -0.98 0.30 116.55 111.70 2yum n ASP 41 Ca -0.11 1.30 -0.11 0.00 0.52 0.00 0.00 54.79 56.39 2yum n ASP 41 Cb 0.43 -0.23 -0.05 0.00 -0.72 0.00 0.00 41.12 40.55 2yum n ASP 41 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 2yum h GLU 42 N 0.00 -0.40 0.09 -0.67 4.39 -1.55 -2.63 114.58 113.80 2yum h GLU 42 Ca 0.18 0.03 0.02 0.00 0.34 0.00 0.00 59.36 59.93 2yum h GLU 42 Cb 0.37 0.09 -0.05 0.00 -0.10 0.00 0.00 28.75 29.06 2yum h GLU 42 CO -0.71 -0.27 -0.52 -0.07 -1.16 0.00 0.00 179.01 176.28 2yum h LEU 43 N -0.42 -1.56 0.00 1.33 3.38 0.02 -3.47 115.31 114.59 2yum h LEU 43 Ca 0.10 0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.24 2yum h LEU 43 Cb 0.59 0.58 0.00 0.00 0.09 0.00 0.00 40.66 41.93 2yum h LEU 43 CO -0.43 -0.54 0.00 0.61 0.09 0.00 0.00 178.44 178.16 2yum n GLY 44 N -1.48 2.86 0.08 0.83 0.00 -0.24 -4.77 105.19 102.47 2yum n GLY 44 Ca -0.08 -0.73 -0.10 0.00 0.00 0.00 0.00 46.02 45.11 2yum n GLY 44 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 2yum h ASN 45 N 0.00 -0.06 -3.85 1.61 -1.07 -1.90 -3.47 115.58 106.85 2yum h ASN 45 Ca 0.00 -0.54 -0.46 0.00 0.07 0.00 0.00 56.30 55.37 2yum h ASN 45 Cb 0.00 0.01 0.17 0.00 -2.07 0.00 0.00 38.32 36.43 2yum h ASN 45 CO 0.00 0.66 0.18 -0.13 0.07 0.00 0.00 177.43 178.21 2yum s ARG 46 N -2.50 0.47 0.05 4.14 1.81 -1.26 -5.07 118.95 116.58 2yum s ARG 46 Ca -0.12 0.75 -0.01 0.00 -1.72 0.00 0.00 55.73 54.62 2yum s ARG 46 Cb -0.01 -1.72 -0.03 0.00 -0.45 0.00 0.00 34.95 32.73 2yum s ARG 46 CO 0.45 -2.76 -0.02 -0.08 -0.68 0.00 0.00 175.30 172.22 2yum s THR 47 N -2.84 0.20 0.49 0.02 -1.32 -1.26 -4.71 115.64 106.23 2yum s THR 47 Ca 0.65 -1.64 0.36 0.00 -1.21 0.00 0.00 61.69 59.85 2yum s THR 47 Cb -0.20 -1.34 0.54 0.00 -1.51 0.00 0.00 72.50 69.99 2yum s THR 47 CO 0.59 -0.91 1.26 0.00 -2.21 0.00 0.00 174.62 173.35 2yum n ALA 48 N 0.31 1.37 -0.10 11.08 0.00 -1.26 -0.29 120.51 131.62 2yum n ALA 48 Ca -0.15 0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.76 2yum n ALA 48 Cb 0.60 -0.82 0.00 0.00 0.00 0.00 0.00 19.45 19.23 2yum n ALA 48 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2yum n LYS 49 N -3.42 0.00 -0.30 0.00 3.00 -1.26 -2.13 118.16 114.06 2yum n LYS 49 Ca 0.32 0.45 0.18 0.00 -0.00 0.00 0.00 58.31 59.26 2yum n LYS 49 Cb 1.60 -1.08 0.45 0.00 0.00 0.00 0.00 35.03 36.00 2yum n LYS 49 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.40 179.36 2yum h GLN 50 N 0.00 0.50 0.04 1.64 7.50 -1.44 -0.93 115.11 122.41 2yum h GLN 50 Ca 0.00 -0.03 -0.00 0.00 0.50 0.00 0.00 58.65 59.12 2yum h GLN 50 Cb 0.00 -0.11 0.00 0.00 0.05 0.00 0.00 27.48 27.42 2yum h GLN 50 CO 0.00 0.33 -0.02 0.28 -1.50 0.00 0.00 178.83 177.92 2yum h VAL 51 N 0.51 1.08 -0.36 -0.54 2.07 -0.78 -1.77 116.25 116.46 2yum h VAL 51 Ca 0.53 -0.36 0.07 0.00 0.82 0.00 0.00 66.70 67.77 2yum h VAL 51 Cb 1.17 1.31 -0.07 0.00 -1.52 0.00 0.00 31.29 32.19 2yum h VAL 51 CO -0.26 0.09 -0.08 0.00 0.02 0.00 0.00 177.57 177.34 2yum h ALA 52 N 0.75 0.25 0.00 1.67 0.00 -0.65 0.21 119.26 121.50 2yum h ALA 52 Ca -0.01 0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 2yum h ALA 52 Cb 0.19 0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 2yum h ALA 52 CO 0.01 -0.45 -0.11 0.66 0.00 0.00 0.00 179.25 179.36 2yum h SER 53 N 0.01 0.00 0.11 0.00 4.64 -1.36 -0.69 113.55 116.26 2yum h SER 53 Ca 0.17 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 61.22 2yum h SER 53 Cb 0.26 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.38 2yum h SER 53 CO -0.36 0.11 -1.11 -0.61 -0.87 0.00 0.00 176.83 173.98 2yum h GLN 54 N 0.00 0.63 -0.15 4.77 5.75 -0.03 -3.10 115.11 122.98 2yum h GLN 54 Ca -0.00 -0.74 -0.06 0.00 -0.15 0.00 0.00 58.65 57.70 2yum h GLN 54 Cb 0.21 0.23 -0.00 0.00 1.07 0.00 0.00 27.48 28.99 2yum h GLN 54 CO 0.01 1.32 -0.14 0.28 -2.65 0.00 0.00 178.83 177.65 2yum h VAL 55 N 0.32 1.34 -0.86 2.39 2.07 -0.16 -3.03 116.25 118.33 2yum h VAL 55 Ca -0.15 -1.30 0.12 0.00 0.82 0.00 0.00 66.70 66.19 2yum h VAL 55 Cb 1.77 1.86 -0.06 0.00 -1.52 0.00 0.00 31.29 33.34 2yum h VAL 55 CO 0.21 0.38 0.56 0.06 0.02 0.00 0.00 177.57 178.80 2yum h GLN 56 N -0.00 0.72 -0.78 1.57 3.07 -1.25 0.29 115.11 118.73 2yum h GLN 56 Ca 0.02 -0.04 0.00 0.00 0.09 0.00 0.00 58.65 58.72 2yum h GLN 56 Cb 0.67 -0.16 0.00 0.00 0.08 0.00 0.00 27.48 28.07 2yum h GLN 56 CO 0.04 0.48 0.00 1.63 0.09 0.00 0.00 178.83 181.06 2yum n LYS 57 N -4.54 2.87 -0.02 0.06 5.02 -1.17 -2.42 118.16 117.96 2yum n LYS 57 Ca 0.16 -1.54 -0.04 0.00 -2.02 0.00 0.00 58.31 54.87 2yum n LYS 57 Cb 0.39 -1.85 -0.02 0.00 -0.02 0.00 0.00 35.03 33.53 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 0.32 0.00 -0.03 2.13 4.02 0.95 -4.26 117.16 120.29 2yum n TYR 58 Ca 0.14 0.00 -0.11 0.00 -0.01 0.00 0.00 57.90 57.92 2yum n TYR 58 Cb 0.70 -0.16 -0.14 0.00 -0.02 0.00 0.00 39.34 39.72 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 -3.05 0.87 0.01 -0.72 3.01 -0.85 -4.10 117.46 112.63 2yum n PHE 59 Ca -0.08 0.29 -0.07 0.00 1.01 0.00 0.00 57.45 58.59 2yum n PHE 59 Cb 0.57 -1.15 -0.12 0.00 -0.01 0.00 0.00 39.48 38.76 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 0.01 1.02 0.00 4.37 2.04 -1.69 -3.20 117.51 120.06 2yum h ILE 60 Ca -0.35 -2.78 -0.01 0.00 1.00 0.00 0.00 64.86 62.71 2yum h ILE 60 Cb 2.05 2.48 -0.00 0.00 -0.74 0.00 0.00 36.82 40.61 2yum h ILE 60 CO 0.07 0.58 -0.06 0.07 0.00 0.00 0.00 178.15 178.81 2yum h LYS 61 N 0.00 0.00 0.13 2.37 2.10 -1.73 -2.51 116.57 116.92 2yum h LYS 61 Ca -0.19 0.00 -0.33 0.00 -2.00 0.00 0.00 60.65 58.13 2yum h LYS 61 Cb 1.88 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 33.20 2yum h LYS 61 CO 0.09 0.06 -1.70 1.37 -2.00 0.00 0.00 179.45 177.27 2yum h LEU 62 N 0.00 0.42 -9.17 7.07 8.10 -1.71 -3.47 115.31 116.55 2yum h LEU 62 Ca -0.00 -0.68 -0.72 0.00 0.11 0.00 0.00 57.88 56.59 2yum h LEU 62 Cb 0.12 -0.14 0.05 0.00 -0.44 0.00 0.00 40.66 40.26 2yum h LEU 62 CO 0.01 1.58 0.38 0.41 -4.11 0.00 0.00 178.44 176.71 2yum n THR 63 N -3.46 0.02 0.07 0.15 -1.04 -0.95 -4.89 114.28 104.19 2yum n THR 63 Ca -0.22 -0.00 -0.11 0.00 -2.04 0.00 0.00 64.05 61.67 2yum n THR 63 Cb 1.05 -0.61 -0.08 0.00 -1.82 0.00 0.00 70.33 68.88 2yum n THR 63 CO 0.00 0.00 0.00 0.11 -0.64 0.00 0.00 175.07 174.54 2yum h LYS 64 N 4.34 -0.23 -7.51 -2.82 1.57 -1.91 -3.45 116.57 106.56 2yum h LYS 64 Ca -0.48 0.02 -0.45 0.00 -1.87 0.00 0.00 60.65 57.86 2yum h LYS 64 Cb 1.36 0.05 0.14 0.00 0.08 0.00 0.00 32.23 33.86 2yum h LYS 64 CO 0.76 0.18 0.30 0.00 -0.57 0.00 0.00 179.45 180.12 2yum s ALA 65 N -3.94 1.71 -1.36 3.86 0.00 -1.26 -4.19 121.76 116.58 2yum s ALA 65 Ca -0.13 -0.62 -0.03 0.00 0.00 0.00 0.00 51.96 51.18 2yum s ALA 65 Cb 0.01 -3.00 0.02 0.00 0.00 0.00 0.00 23.12 20.15 2yum s ALA 65 CO 0.50 -2.41 0.73 0.41 0.00 0.00 0.00 175.76 174.99 2yum n GLY 66 N -2.24 -0.32 3.20 0.00 0.00 -1.26 -4.98 105.19 99.59 2yum n GLY 66 Ca 0.08 0.14 -0.32 0.00 0.00 0.00 0.00 46.02 45.92 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 -3.62 2.10 -0.41 -0.61 -1.09 -1.26 -5.07 121.20 111.24 2yum s ILE 67 Ca 0.13 -0.99 -0.28 0.00 -2.23 0.00 0.00 60.65 57.28 2yum s ILE 67 Cb -0.07 -1.82 -0.01 0.00 -1.58 0.00 0.00 42.46 38.98 2yum s ILE 67 CO 0.82 0.55 1.74 -2.16 -1.23 0.00 0.00 174.94 174.66 2yum s PRO 68 N 0.57 3.23 0.15 2.79 0.04 -1.26 -4.92 135.00 135.59 2yum s PRO 68 Ca -0.13 1.15 -0.21 0.00 0.04 0.00 0.00 61.00 61.85 2yum s PRO 68 Cb -0.17 -4.21 -0.13 0.00 0.04 0.00 0.00 34.50 30.04 2yum s PRO 68 CO 0.04 -1.99 0.39 1.55 0.04 0.00 0.00 177.00 177.03 2yum n VAL 69 N 7.31 1.51 -1.37 -0.36 3.14 -1.26 -4.73 118.33 122.56 2yum n VAL 69 Ca 0.21 -0.38 -0.41 0.00 -2.96 0.00 0.00 64.34 60.81 2yum n VAL 69 Cb 0.48 0.00 0.01 0.00 -1.06 0.00 0.00 33.84 33.27 2yum n VAL 69 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 2yum n SER 70 N 1.52 -1.99 -4.27 6.55 7.64 -1.26 -4.99 113.62 116.82 2yum n SER 70 Ca 0.14 0.80 -0.21 0.00 1.01 0.00 0.00 58.87 60.61 2yum n SER 70 Cb 0.19 -1.01 -0.12 0.00 -1.01 0.00 0.00 64.21 62.27 2yum n SER 70 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2yum s GLY 71 N -1.01 1.17 0.44 0.23 0.00 -1.26 -5.03 107.32 101.86 2yum s GLY 71 Ca 0.62 -1.29 0.30 0.00 0.00 0.00 0.00 44.72 44.35 2yum s GLY 71 CO 0.60 -1.33 1.89 -0.56 0.00 0.00 0.00 173.10 173.70 2yum h PRO 72 N 3.70 0.00 -6.02 2.90 0.13 -2.03 -3.44 132.00 127.24 2yum h PRO 72 Ca -0.42 0.00 -0.70 0.00 -0.87 0.00 0.00 66.00 64.01 2yum h PRO 72 Cb 1.19 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.31 2yum h PRO 72 CO 0.46 0.00 1.31 0.45 -0.23 0.00 0.00 178.00 180.00 2yum n SER 73 N -2.75 1.96 -3.31 1.44 2.88 -1.26 -4.89 113.62 107.70 2yum n SER 73 Ca 0.01 0.57 -0.13 0.00 -1.33 0.00 0.00 58.87 58.00 2yum n SER 73 Cb 0.27 -1.18 -0.03 0.00 -0.75 0.00 0.00 64.21 62.51 2yum n SER 73 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2yum s SER 74 N 6.44 0.59 0.00 -3.46 0.15 -1.26 -5.18 113.70 110.97 2yum s SER 74 Ca 1.09 -1.33 0.22 0.00 0.70 0.00 0.00 55.95 56.63 2yum s SER 74 Cb -1.00 0.68 1.30 0.00 -1.71 0.00 0.00 66.02 65.30 2yum s SER 74 CO 0.55 -1.34 1.67 0.61 1.20 0.00 0.00 173.24 175.93