#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yum n SER 2 N 0.00 -5.23 -2.07 1.61 7.64 -1.26 -4.89 113.62 109.42 2yum n SER 2 Ca 0.00 -0.52 -0.21 0.00 1.01 0.00 0.00 58.87 59.15 2yum n SER 2 Cb 0.00 -4.78 0.02 0.00 -1.01 0.00 0.00 64.21 58.44 2yum n SER 2 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2yum n SER 3 N -2.80 6.60 0.00 6.43 2.88 -1.26 -4.91 113.62 120.57 2yum n SER 3 Ca -0.05 -3.17 0.00 0.00 -1.33 0.00 0.00 58.87 54.31 2yum n SER 3 Cb 0.58 -1.09 0.00 0.00 -0.75 0.00 0.00 64.21 62.95 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 0.33 1.08 4.42 0.46 0.00 -1.26 -4.93 105.19 105.28 2yum n GLY 4 Ca 0.37 -0.74 -0.40 0.00 0.00 0.00 0.00 46.02 45.26 2yum n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2yum n SER 5 N 1.33 -1.29 -4.63 1.61 3.41 -1.26 -4.90 113.62 107.89 2yum n SER 5 Ca 0.00 -1.21 -0.33 0.00 -0.26 0.00 0.00 58.87 57.06 2yum n SER 5 Cb 0.00 -1.55 -0.10 0.00 -0.26 0.00 0.00 64.21 62.31 2yum n SER 5 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2yum s SER 6 N -3.39 4.88 -0.31 4.04 1.04 -1.26 -4.84 113.70 113.87 2yum s SER 6 Ca 0.67 -0.03 -0.03 0.00 0.48 0.00 0.00 55.95 57.04 2yum s SER 6 Cb -0.39 -1.24 0.00 0.00 0.10 0.00 0.00 66.02 64.49 2yum s SER 6 CO 0.99 0.32 0.10 0.61 0.98 0.00 0.00 173.24 176.24 2yum n GLY 7 N 1.75 -3.70 0.38 7.32 0.00 -1.26 -4.74 105.19 104.93 2yum n GLY 7 Ca -0.16 0.56 -0.17 0.00 0.00 0.00 0.00 46.02 46.25 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 2.69 -0.77 0.32 1.61 -0.73 -1.98 -2.61 115.58 114.11 2yum h ASN 8 Ca 0.00 -0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 2yum h ASN 8 Cb 0.17 0.20 0.00 0.00 0.27 0.00 0.00 38.32 38.96 2yum h ASN 8 CO 0.11 -0.48 0.00 0.00 -0.37 0.00 0.00 177.43 176.69 2yum n GLN 9 N -5.44 0.42 -2.85 6.67 3.00 -1.26 -4.79 117.38 113.13 2yum n GLN 9 Ca -0.13 0.06 -0.20 0.00 -0.01 0.00 0.00 57.00 56.72 2yum n GLN 9 Cb 0.38 -1.50 0.02 0.00 0.00 0.00 0.00 30.24 29.14 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 -2.44 3.48 -0.02 1.08 1.02 -0.98 -5.05 118.68 115.77 2yum s LEU 10 Ca 0.25 -0.14 -0.30 0.00 0.02 0.00 0.00 54.13 53.95 2yum s LEU 10 Cb 0.15 -2.81 -0.04 0.00 0.02 0.00 0.00 46.19 43.51 2yum s LEU 10 CO 0.33 -0.93 1.25 0.26 0.02 0.00 0.00 176.35 177.27 2yum s TRP 11 N -2.56 3.16 0.33 0.29 0.52 -1.26 -4.91 118.94 114.50 2yum s TRP 11 Ca 0.55 1.14 -0.01 0.00 0.02 0.00 0.00 56.10 57.80 2yum s TRP 11 Cb -0.10 -3.48 -0.04 0.00 -1.15 0.00 0.00 33.47 28.70 2yum s TRP 11 CO 0.36 -1.58 0.55 -0.08 0.02 0.00 0.00 176.95 176.22 2yum s THR 12 N 2.01 5.09 0.26 2.01 -1.32 -1.26 -4.84 115.64 117.59 2yum s THR 12 Ca 0.58 -0.34 -0.05 0.00 -1.21 0.00 0.00 61.69 60.68 2yum s THR 12 Cb -0.27 -3.83 0.31 0.00 -1.51 0.00 0.00 72.50 67.20 2yum s THR 12 CO 0.25 -0.50 1.62 1.62 -2.21 0.00 0.00 174.62 175.40 2yum h VAL 13 N 0.90 0.27 -0.48 5.08 3.04 -1.95 0.26 116.25 123.38 2yum h VAL 13 Ca -0.49 -0.03 0.09 0.00 -1.01 0.00 0.00 66.70 65.26 2yum h VAL 13 Cb 1.21 0.17 -0.08 0.00 -2.01 0.00 0.00 31.29 30.59 2yum h VAL 13 CO 0.63 0.02 0.03 -0.33 -1.01 0.00 0.00 177.57 176.90 2yum h GLU 14 N 0.09 0.14 0.31 4.17 4.39 -1.98 -2.23 114.58 119.47 2yum h GLU 14 Ca 0.45 -0.01 -0.02 0.00 0.34 0.00 0.00 59.36 60.13 2yum h GLU 14 Cb 0.83 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.45 2yum h GLU 14 CO -0.72 0.09 -0.15 0.93 -1.16 0.00 0.00 179.01 178.00 2yum h GLU 15 N 0.14 -0.40 -0.68 2.33 5.08 -1.10 -2.70 114.58 117.25 2yum h GLU 15 Ca 0.24 0.03 0.06 0.00 -1.00 0.00 0.00 59.36 58.69 2yum h GLU 15 Cb 0.35 0.09 -0.08 0.00 0.50 0.00 0.00 28.75 29.61 2yum h GLU 15 CO -0.37 -0.07 -0.40 1.04 -1.00 0.00 0.00 179.01 178.21 2yum n GLN 16 N -5.10 -0.30 -0.06 2.33 6.02 0.63 -0.02 117.38 120.88 2yum n GLN 16 Ca -0.09 1.19 -0.08 0.00 -0.01 0.00 0.00 57.00 58.01 2yum n GLN 16 Cb 0.27 -1.75 -0.02 0.00 1.02 0.00 0.00 30.24 29.76 2yum n GLN 16 CO 0.00 0.00 0.00 1.57 -1.01 0.00 0.00 177.06 177.62 2yum h LYS 17 N 0.00 0.04 0.03 -1.09 2.10 -1.50 -0.90 116.57 115.25 2yum h LYS 17 Ca 0.11 -0.00 0.02 0.00 -2.00 0.00 0.00 60.65 58.78 2yum h LYS 17 Cb 0.28 -0.01 -0.05 0.00 -0.90 0.00 0.00 32.23 31.55 2yum h LYS 17 CO -0.64 0.02 -0.51 -0.22 -2.00 0.00 0.00 179.45 176.10 2yum h LYS 18 N 0.04 -0.65 0.14 0.07 3.64 -0.09 -1.46 116.57 118.26 2yum h LYS 18 Ca 0.12 0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.54 2yum h LYS 18 Cb 0.17 0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.12 2yum h LYS 18 CO -0.22 -0.43 -0.17 1.25 -2.27 0.00 0.00 179.45 177.61 2yum h LEU 19 N -0.68 -0.46 -0.78 5.20 5.85 -0.30 -0.62 115.31 123.52 2yum h LEU 19 Ca 0.02 0.04 0.32 0.00 0.84 0.00 0.00 57.88 59.09 2yum h LEU 19 Cb 0.72 0.16 -0.14 0.00 0.37 0.00 0.00 40.66 41.77 2yum h LEU 19 CO -0.33 -0.21 0.38 -0.62 -0.34 0.00 0.00 178.44 177.32 2yum n GLU 20 N -3.33 -0.05 0.04 1.25 1.02 -0.36 0.11 120.64 119.32 2yum n GLU 20 Ca -0.04 1.08 -0.12 0.00 -0.02 0.00 0.00 57.16 58.06 2yum n GLU 20 Cb 0.15 -1.92 -0.09 0.00 -0.02 0.00 0.00 31.44 29.56 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 -0.15 -0.03 3.49 1.08 -0.62 -3.21 115.11 115.68 2yum h GLN 21 Ca 0.64 0.01 0.02 0.00 -1.45 0.00 0.00 58.65 57.87 2yum h GLN 21 Cb 1.68 0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 29.12 2yum h GLN 21 CO -0.61 0.29 -0.07 -0.07 -0.95 0.00 0.00 178.83 177.43 2yum h LEU 22 N -0.66 -0.19 -0.96 1.46 3.38 0.23 -0.14 115.31 118.42 2yum h LEU 22 Ca -0.02 0.03 0.29 0.00 0.09 0.00 0.00 57.88 58.28 2yum h LEU 22 Cb 0.51 0.09 -0.17 0.00 0.09 0.00 0.00 40.66 41.18 2yum h LEU 22 CO 0.03 -0.10 0.17 -0.07 0.09 0.00 0.00 178.44 178.56 2yum h LEU 23 N -0.10 -0.23 0.11 1.67 3.38 -0.57 0.45 115.31 120.01 2yum h LEU 23 Ca 0.04 0.26 -0.30 0.00 0.09 0.00 0.00 57.88 57.97 2yum h LEU 23 Cb 0.15 0.40 0.03 0.00 0.09 0.00 0.00 40.66 41.33 2yum h LEU 23 CO -0.09 -0.32 -1.24 0.40 0.09 0.00 0.00 178.44 177.28 2yum h ILE 24 N 0.05 1.29 -0.68 1.22 2.04 -1.44 -3.30 117.51 116.69 2yum h ILE 24 Ca 0.63 -2.46 0.10 0.00 1.00 0.00 0.00 64.86 64.13 2yum h ILE 24 Cb 1.38 2.68 -0.08 0.00 -0.74 0.00 0.00 36.82 40.07 2yum h ILE 24 CO -0.83 0.75 0.30 0.50 0.00 0.00 0.00 178.15 178.87 2yum h LYS 25 N 0.28 0.49 -5.41 2.37 3.11 0.16 -3.38 116.57 114.20 2yum h LYS 25 Ca -0.19 -0.03 -0.61 0.00 -2.81 0.00 0.00 60.65 57.01 2yum h LYS 25 Cb 1.91 -0.11 -0.12 0.00 -1.00 0.00 0.00 32.23 32.91 2yum h LYS 25 CO 0.24 0.33 0.03 0.71 -2.81 0.00 0.00 179.45 177.95 2yum s TYR 26 N -6.06 3.28 0.67 1.91 2.02 0.29 -5.06 117.35 114.39 2yum s TYR 26 Ca -0.13 0.70 -0.15 0.00 -0.37 0.00 0.00 57.07 57.12 2yum s TYR 26 Cb 0.18 -2.75 0.00 0.00 -0.40 0.00 0.00 41.96 38.99 2yum s TYR 26 CO 0.76 -0.28 1.11 -1.25 -1.57 0.00 0.00 175.55 174.31 2yum s PRO 27 N 2.33 2.76 1.06 -1.71 0.04 -1.26 -4.84 135.00 133.38 2yum s PRO 27 Ca 0.23 1.37 -0.14 0.00 0.04 0.00 0.00 61.00 62.49 2yum s PRO 27 Cb -0.16 -1.95 0.22 0.00 0.04 0.00 0.00 34.50 32.66 2yum s PRO 27 CO 0.09 -1.28 1.10 -1.25 0.04 0.00 0.00 177.00 175.70 2yum s PRO 28 N -4.16 -0.09 0.26 0.56 0.04 -1.26 -5.01 135.00 125.33 2yum s PRO 28 Ca 0.66 0.33 -0.21 0.00 0.04 0.00 0.00 61.00 61.83 2yum s PRO 28 Cb -0.20 -1.69 0.05 0.00 0.04 0.00 0.00 34.50 32.69 2yum s PRO 28 CO 0.43 -3.04 0.85 -1.83 0.04 0.00 0.00 177.00 173.44 2yum s GLU 29 N -5.08 1.67 0.21 4.56 -1.05 -1.26 -5.04 118.70 112.71 2yum s GLU 29 Ca 0.67 -0.99 -0.10 0.00 -0.15 0.00 0.00 54.97 54.39 2yum s GLU 29 Cb -0.16 0.53 0.29 0.00 -0.44 0.00 0.00 34.13 34.35 2yum s GLU 29 CO 0.57 -0.77 1.68 1.49 0.95 0.00 0.00 175.26 179.18 2yum h GLU 30 N 2.00 0.17 -4.70 -4.83 4.22 -2.06 -3.36 114.58 106.02 2yum h GLU 30 Ca -0.25 -0.01 -0.69 0.00 0.08 0.00 0.00 59.36 58.49 2yum h GLU 30 Cb 1.24 -0.04 -0.23 0.00 0.50 0.00 0.00 28.75 30.22 2yum h GLU 30 CO 0.30 0.11 -0.54 0.08 -2.18 0.00 0.00 179.01 176.78 2yum s VAL 31 N -6.13 4.56 0.25 0.32 1.01 -1.26 -4.95 120.40 114.20 2yum s VAL 31 Ca -0.13 -0.61 0.08 0.00 0.00 0.00 0.00 61.98 61.32 2yum s VAL 31 Cb 0.18 -3.42 -0.05 0.00 0.00 0.00 0.00 36.38 33.10 2yum s VAL 31 CO 0.74 -0.05 1.57 1.05 0.00 0.00 0.00 175.10 178.40 2yum h GLU 32 N 8.38 0.09 -0.45 2.72 4.11 -2.01 -3.22 114.58 124.20 2yum h GLU 32 Ca -0.29 -0.07 0.08 0.00 0.07 0.00 0.00 59.36 59.15 2yum h GLU 32 Cb 1.13 0.01 -0.07 0.00 0.50 0.00 0.00 28.75 30.32 2yum h GLU 32 CO 0.63 0.70 0.03 1.03 0.07 0.00 0.00 179.01 181.47 2yum h SER 33 N 0.06 -0.13 0.36 3.06 0.87 -1.95 0.66 113.55 116.47 2yum h SER 33 Ca -0.01 0.10 -0.05 0.00 -1.23 0.00 0.00 61.79 60.60 2yum h SER 33 Cb 1.15 0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 63.27 2yum h SER 33 CO 0.09 -0.03 -0.25 0.08 -0.53 0.00 0.00 176.83 176.19 2yum h ARG 34 N 0.14 0.00 -0.26 2.24 0.11 -1.98 -2.72 114.38 111.91 2yum h ARG 34 Ca 0.22 0.00 -0.09 0.00 0.10 0.00 0.00 59.98 60.22 2yum h ARG 34 Cb 0.32 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.39 2yum h ARG 34 CO -0.35 0.25 -0.18 -0.09 0.10 0.00 0.00 179.97 179.70 2yum h ARG 35 N 0.00 0.58 -0.50 0.08 2.43 -0.95 -3.06 114.38 112.96 2yum h ARG 35 Ca -0.00 -0.28 -0.05 0.00 -0.81 0.00 0.00 59.98 58.84 2yum h ARG 35 Cb 0.50 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.02 2yum h ARG 35 CO 0.03 0.86 0.12 -1.49 -1.51 0.00 0.00 179.97 177.98 2yum h TRP 36 N 0.30 0.78 -0.29 2.20 -0.00 -0.94 -2.84 115.95 115.16 2yum h TRP 36 Ca 0.05 -0.07 0.03 0.00 -0.00 0.00 0.00 58.89 58.91 2yum h TRP 36 Cb 0.72 -0.23 -0.03 0.00 -0.00 0.00 0.00 29.16 29.61 2yum h TRP 36 CO 0.07 0.66 0.09 0.37 -0.00 0.00 0.00 178.44 179.63 2yum h GLN 37 N 0.74 0.20 -0.39 0.49 5.75 -1.41 0.78 115.11 121.26 2yum h GLN 37 Ca 0.16 -0.01 0.02 0.00 -0.15 0.00 0.00 58.65 58.67 2yum h GLN 37 Cb 0.28 -0.05 -0.03 0.00 1.07 0.00 0.00 27.48 28.75 2yum h GLN 37 CO -0.00 0.13 0.22 0.87 -2.65 0.00 0.00 178.83 177.40 2yum h LYS 38 N 0.21 0.43 -0.49 1.69 1.57 -1.41 -1.89 116.57 116.68 2yum h LYS 38 Ca 0.13 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.87 2yum h LYS 38 Cb 0.11 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.30 2yum h LYS 38 CO -0.14 0.29 0.25 0.82 -0.57 0.00 0.00 179.45 180.09 2yum h ILE 39 N 0.44 1.18 0.25 1.86 2.04 -1.24 -3.12 117.51 118.92 2yum h ILE 39 Ca 0.16 -0.49 0.01 0.00 1.00 0.00 0.00 64.86 65.54 2yum h ILE 39 Cb 0.03 0.61 -0.03 0.00 -0.74 0.00 0.00 36.82 36.68 2yum h ILE 39 CO -0.09 0.20 -0.35 0.00 0.00 0.00 0.00 178.15 177.91 2yum h ALA 40 N 1.09 -0.69 -0.73 1.87 0.00 -0.50 -2.82 119.26 117.49 2yum h ALA 40 Ca 0.17 -0.09 0.07 0.00 0.00 0.00 0.00 54.91 55.06 2yum h ALA 40 Cb 0.09 0.54 -0.09 0.00 0.00 0.00 0.00 17.79 18.33 2yum h ALA 40 CO -0.02 -0.94 -0.42 -3.47 0.00 0.00 0.00 179.25 174.40 2yum n ASP 41 N -5.45 -0.74 -0.10 0.00 -0.08 -0.74 0.83 116.55 110.27 2yum n ASP 41 Ca -0.08 1.29 -0.06 0.00 -1.51 0.00 0.00 54.79 54.43 2yum n ASP 41 Cb 0.35 -0.18 0.01 0.00 2.34 0.00 0.00 41.12 43.64 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 -0.02 -0.85 -0.67 4.39 -1.56 -1.30 114.58 114.57 2yum h GLU 42 Ca 0.13 0.00 0.07 0.00 0.34 0.00 0.00 59.36 59.90 2yum h GLU 42 Cb 0.31 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 28.90 2yum h GLU 42 CO -0.69 -0.01 0.52 -0.07 -1.16 0.00 0.00 179.01 177.60 2yum h LEU 43 N -0.02 0.81 0.00 1.33 3.38 0.68 -3.45 115.31 118.03 2yum h LEU 43 Ca 0.18 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.17 2yum h LEU 43 Cb 0.29 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.89 2yum h LEU 43 CO -0.38 0.51 0.00 0.61 0.09 0.00 0.00 178.44 179.27 2yum n GLY 44 N -1.33 1.06 0.07 0.83 0.00 0.90 -4.48 105.19 102.24 2yum n GLY 44 Ca 0.12 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.02 2yum n GLY 44 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2yum h ASN 45 N 0.00 -0.02 -3.79 1.61 2.35 -1.88 -3.46 115.58 110.39 2yum h ASN 45 Ca 0.00 -0.68 -0.49 0.00 -0.55 0.00 0.00 56.30 54.58 2yum h ASN 45 Cb 0.00 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.40 2yum h ASN 45 CO 0.00 0.69 0.18 -0.13 -1.65 0.00 0.00 177.43 176.52 2yum s ARG 46 N -3.29 3.68 0.22 0.81 1.81 -1.26 -5.10 118.95 115.83 2yum s ARG 46 Ca -0.17 0.46 0.11 0.00 -1.72 0.00 0.00 55.73 54.41 2yum s ARG 46 Cb -0.00 -2.32 -0.05 0.00 -0.45 0.00 0.00 34.95 32.13 2yum s ARG 46 CO 0.65 -0.19 -0.20 0.95 -0.68 0.00 0.00 175.30 175.82 2yum s THR 47 N -2.64 2.53 0.54 0.02 -4.23 -1.26 -4.58 115.64 106.02 2yum s THR 47 Ca 0.51 -2.11 0.31 0.00 -1.18 0.00 0.00 61.69 59.22 2yum s THR 47 Cb -0.10 -2.26 0.46 0.00 1.34 0.00 0.00 72.50 71.93 2yum s THR 47 CO 0.39 -0.22 1.26 0.00 -0.54 0.00 0.00 174.62 175.51 2yum n ALA 48 N -0.09 1.17 -0.01 3.99 0.00 -1.26 -0.73 120.51 123.58 2yum n ALA 48 Ca -0.10 0.40 -0.00 0.00 0.00 0.00 0.00 53.44 53.74 2yum n ALA 48 Cb 0.57 -0.70 -0.00 0.00 0.00 0.00 0.00 19.45 19.32 2yum n ALA 48 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2yum h LYS 49 N 0.00 0.00 -1.25 0.00 3.11 -1.94 -3.04 116.57 113.46 2yum h LYS 49 Ca 0.58 0.00 0.36 0.00 -2.81 0.00 0.00 60.65 58.78 2yum h LYS 49 Cb 2.92 0.00 -0.07 0.00 -1.00 0.00 0.00 32.23 34.09 2yum h LYS 49 CO -0.01 0.00 0.87 1.96 -2.81 0.00 0.00 179.45 179.47 2yum h GLN 50 N -0.27 0.08 -0.30 1.90 7.50 -1.39 0.45 115.11 123.09 2yum h GLN 50 Ca 0.00 -0.01 -0.13 0.00 0.50 0.00 0.00 58.65 59.01 2yum h GLN 50 Cb 0.01 -0.02 -0.00 0.00 0.05 0.00 0.00 27.48 27.52 2yum h GLN 50 CO 0.00 0.06 -0.32 0.28 -1.50 0.00 0.00 178.83 177.34 2yum h VAL 51 N 0.09 1.30 -0.35 -0.54 2.07 -1.06 -3.02 116.25 114.73 2yum h VAL 51 Ca 0.63 -1.49 0.03 0.00 0.82 0.00 0.00 66.70 66.69 2yum h VAL 51 Cb 2.29 1.56 -0.03 0.00 -1.52 0.00 0.00 31.29 33.59 2yum h VAL 51 CO -0.10 0.48 0.15 0.00 0.02 0.00 0.00 177.57 178.12 2yum h ALA 52 N 0.71 0.42 -0.46 1.67 0.00 0.02 -0.63 119.26 120.99 2yum h ALA 52 Ca 0.05 0.03 0.06 0.00 0.00 0.00 0.00 54.91 55.04 2yum h ALA 52 Cb 0.90 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.62 2yum h ALA 52 CO 0.08 -0.23 0.16 0.66 0.00 0.00 0.00 179.25 179.92 2yum h SER 53 N 0.32 0.17 -0.53 0.00 4.64 -1.48 -2.17 113.55 114.50 2yum h SER 53 Ca 0.15 0.05 -0.02 0.00 -0.47 0.00 0.00 61.79 61.50 2yum h SER 53 Cb 0.09 0.04 -0.02 0.00 -0.31 0.00 0.00 62.40 62.20 2yum h SER 53 CO -0.13 0.13 0.24 -0.61 -0.87 0.00 0.00 176.83 175.58 2yum h GLN 54 N 0.33 0.77 -0.88 4.77 5.75 -1.33 -2.43 115.11 122.09 2yum h GLN 54 Ca 0.22 -0.13 0.22 0.00 -0.15 0.00 0.00 58.65 58.81 2yum h GLN 54 Cb 0.22 -0.13 -0.05 0.00 1.07 0.00 0.00 27.48 28.58 2yum h GLN 54 CO -0.22 0.66 0.60 0.28 -2.65 0.00 0.00 178.83 177.50 2yum h VAL 55 N 0.71 0.63 -0.71 2.39 2.07 -0.49 0.37 116.25 121.22 2yum h VAL 55 Ca 0.18 -0.08 0.04 0.00 0.82 0.00 0.00 66.70 67.66 2yum h VAL 55 Cb 0.15 0.38 -0.05 0.00 -1.52 0.00 0.00 31.29 30.26 2yum h VAL 55 CO -0.02 0.04 0.44 1.56 0.02 0.00 0.00 177.57 179.61 2yum h GLN 56 N 0.23 0.82 -0.74 1.57 1.08 -1.10 -0.28 115.11 116.69 2yum h GLN 56 Ca 0.44 -0.05 0.00 0.00 -1.45 0.00 0.00 58.65 57.60 2yum h GLN 56 Cb 1.37 -0.19 0.00 0.00 -0.05 0.00 0.00 27.48 28.62 2yum h GLN 56 CO -0.11 0.54 0.00 1.63 -0.95 0.00 0.00 178.83 179.95 2yum n LYS 57 N -4.68 2.88 -0.00 1.46 4.01 0.09 -1.81 118.16 120.11 2yum n LYS 57 Ca 0.08 -1.59 0.00 0.00 -0.51 0.00 0.00 58.31 56.29 2yum n LYS 57 Cb 0.10 -1.83 -0.01 0.00 -0.51 0.00 0.00 35.03 32.79 2yum n LYS 57 CO 0.00 0.00 0.00 0.66 -1.11 0.00 0.00 177.40 176.95 2yum n TYR 58 N 0.36 0.00 0.00 2.13 4.02 -0.22 -4.55 117.16 118.90 2yum n TYR 58 Ca 0.14 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.03 2yum n TYR 58 Cb 0.69 -0.03 0.00 0.00 -0.02 0.00 0.00 39.34 39.98 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 -1.77 0.00 0.52 -0.72 3.01 -0.58 -4.65 117.46 113.28 2yum n PHE 59 Ca -0.01 0.00 0.13 0.00 1.01 0.00 0.00 57.45 58.58 2yum n PHE 59 Cb 0.26 0.01 0.44 0.00 -0.01 0.00 0.00 39.48 40.18 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 0.00 0.00 -0.03 4.37 2.04 -1.53 -2.88 117.51 119.48 2yum h ILE 60 Ca 0.00 -0.41 -0.20 0.00 1.00 0.00 0.00 64.86 65.26 2yum h ILE 60 Cb 0.95 1.31 0.01 0.00 -0.74 0.00 0.00 36.82 38.36 2yum h ILE 60 CO 0.00 0.00 -0.75 0.50 0.00 0.00 0.00 178.15 177.90 2yum h LYS 61 N 0.00 0.56 -0.08 2.37 3.64 -1.77 -3.30 116.57 117.98 2yum h LYS 61 Ca 0.00 -0.56 -0.23 0.00 -1.27 0.00 0.00 60.65 58.58 2yum h LYS 61 Cb 0.61 0.15 0.01 0.00 -0.41 0.00 0.00 32.23 32.59 2yum h LYS 61 CO 0.00 1.19 -0.87 1.37 -2.27 0.00 0.00 179.45 178.86 2yum h LEU 62 N 0.16 0.84 -9.20 5.20 8.10 -1.81 -3.45 115.31 115.14 2yum h LEU 62 Ca -0.08 -0.60 -0.71 0.00 0.11 0.00 0.00 57.88 56.59 2yum h LEU 62 Cb 1.42 -0.25 0.04 0.00 -0.44 0.00 0.00 40.66 41.43 2yum h LEU 62 CO 0.15 1.39 0.58 0.35 -4.11 0.00 0.00 178.44 176.80 2yum n THR 63 N -3.88 0.10 0.13 0.15 -2.24 -1.09 -4.87 114.28 102.58 2yum n THR 63 Ca -0.08 -0.02 -0.13 0.00 -2.27 0.00 0.00 64.05 61.55 2yum n THR 63 Cb 0.79 -0.88 -0.08 0.00 -2.10 0.00 0.00 70.33 68.07 2yum n THR 63 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 2yum h LYS 64 N 5.31 -0.63 -6.38 -0.78 1.57 -1.89 -3.42 116.57 110.35 2yum h LYS 64 Ca -0.47 0.04 -0.55 0.00 -1.87 0.00 0.00 60.65 57.80 2yum h LYS 64 Cb 1.34 0.14 -0.04 0.00 0.08 0.00 0.00 32.23 33.75 2yum h LYS 64 CO 0.83 -0.42 0.03 0.00 -0.57 0.00 0.00 179.45 179.32 2yum s ALA 65 N -5.25 3.52 0.00 3.86 0.00 -1.26 -4.53 121.76 118.10 2yum s ALA 65 Ca -0.13 0.10 0.00 0.00 0.00 0.00 0.00 51.96 51.93 2yum s ALA 65 Cb 0.04 -2.72 0.00 0.00 0.00 0.00 0.00 23.12 20.44 2yum s ALA 65 CO 0.47 0.37 0.00 0.41 0.00 0.00 0.00 175.76 177.01 2yum n GLY 66 N 1.29 1.10 3.22 0.00 0.00 -1.26 -5.06 105.19 104.48 2yum n GLY 66 Ca -0.07 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.00 -0.01 0.41 -0.61 1.01 -1.26 -4.89 121.20 113.86 2yum s ILE 67 Ca 0.00 0.02 -0.07 0.00 0.00 0.00 0.00 60.65 60.60 2yum s ILE 67 Cb 0.00 -0.48 0.10 0.00 0.01 0.00 0.00 42.46 42.09 2yum s ILE 67 CO 0.00 0.01 0.37 -0.81 0.00 0.00 0.00 174.94 174.50 2yum n PRO 68 N 3.12 -1.74 -3.98 2.79 -0.04 -1.26 -5.09 135.00 128.80 2yum n PRO 68 Ca -0.15 -0.59 -0.14 0.00 -0.04 0.00 0.00 63.50 62.59 2yum n PRO 68 Cb 0.57 -0.55 -0.14 0.00 -0.04 0.00 0.00 33.50 33.34 2yum n PRO 68 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2yum s VAL 69 N -1.66 0.16 -0.29 0.52 1.01 -1.26 -5.15 120.40 113.73 2yum s VAL 69 Ca 0.24 -0.08 -0.25 0.00 0.00 0.00 0.00 61.98 61.89 2yum s VAL 69 Cb -0.02 -0.15 0.15 0.00 0.00 0.00 0.00 36.38 36.36 2yum s VAL 69 CO 0.18 0.05 1.19 -0.55 0.00 0.00 0.00 175.10 175.98 2yum s SER 70 N -0.00 -0.29 0.52 3.32 0.15 -1.26 -5.19 113.70 110.95 2yum s SER 70 Ca 0.00 0.57 0.02 0.00 0.70 0.00 0.00 55.95 57.24 2yum s SER 70 Cb -0.01 0.58 0.02 0.00 -1.71 0.00 0.00 66.02 64.90 2yum s SER 70 CO -0.00 -0.10 0.20 0.61 1.20 0.00 0.00 173.24 175.15 2yum n GLY 71 N 1.98 3.16 0.16 9.45 0.00 -1.26 -5.06 105.19 113.62 2yum n GLY 71 Ca -0.12 -2.33 -0.13 0.00 0.00 0.00 0.00 46.02 43.44 2yum n GLY 71 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yum h PRO 72 N 0.00 0.46 -6.13 1.61 0.13 -2.03 -3.46 132.00 122.59 2yum h PRO 72 Ca -0.38 -0.25 -0.53 0.00 -0.87 0.00 0.00 66.00 63.97 2yum h PRO 72 Cb 1.26 0.01 -0.07 0.00 0.13 0.00 0.00 31.00 32.33 2yum h PRO 72 CO 0.62 0.82 -0.53 -1.54 -0.23 0.00 0.00 178.00 177.14 2yum s SER 73 N -6.26 4.83 -0.50 1.44 1.04 -1.26 -5.08 113.70 107.91 2yum s SER 73 Ca -0.14 -0.68 -0.23 0.00 0.48 0.00 0.00 55.95 55.38 2yum s SER 73 Cb 0.06 -0.82 0.04 0.00 0.10 0.00 0.00 66.02 65.40 2yum s SER 73 CO 0.78 -0.27 0.83 -0.55 0.98 0.00 0.00 173.24 175.01 2yum s SER 74 N -3.86 6.36 0.00 7.02 0.15 -1.26 -5.15 113.70 116.96 2yum s SER 74 Ca 0.38 -0.29 0.00 0.00 0.70 0.00 0.00 55.95 56.73 2yum s SER 74 Cb -0.04 -2.40 0.00 0.00 -1.71 0.00 0.00 66.02 61.88 2yum s SER 74 CO 0.23 -1.04 0.00 0.61 1.20 0.00 0.00 173.24 174.25