#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 0.52 -0.09 1.61 0.01 -1.26 -5.11 113.70 109.38 2yum s SER 2 Ca 0.00 -1.40 -0.11 0.00 1.31 0.00 0.00 55.95 55.75 2yum s SER 2 Cb 0.00 0.49 -0.04 0.00 0.21 0.00 0.00 66.02 66.68 2yum s SER 2 CO 0.00 -1.00 -0.21 -1.20 0.41 0.00 0.00 173.24 171.24 2yum n SER 3 N -0.70 1.37 0.00 2.44 7.64 -1.26 -5.13 113.62 117.98 2yum n SER 3 Ca 0.02 0.22 0.00 0.00 1.01 0.00 0.00 58.87 60.13 2yum n SER 3 Cb 0.64 -0.60 0.00 0.00 -1.01 0.00 0.00 64.21 63.24 2yum n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2yum n GLY 4 N 1.88 3.55 3.14 0.23 0.00 -1.26 -5.18 105.19 107.55 2yum n GLY 4 Ca -0.09 -0.65 -0.09 0.00 0.00 0.00 0.00 46.02 45.20 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 0.35 0.29 1.61 0.01 -1.26 -5.18 113.70 109.52 2yum s SER 5 Ca 0.00 -1.12 0.04 0.00 1.31 0.00 0.00 55.95 56.17 2yum s SER 5 Cb 0.00 0.27 -0.03 0.00 0.21 0.00 0.00 66.02 66.47 2yum s SER 5 CO 0.00 -0.70 0.20 -0.44 0.41 0.00 0.00 173.24 172.71 2yum s SER 6 N -3.00 1.30 0.00 2.44 0.01 -1.26 -5.13 113.70 108.05 2yum s SER 6 Ca 0.18 -1.60 0.00 0.00 1.31 0.00 0.00 55.95 55.84 2yum s SER 6 Cb 0.07 0.46 0.00 0.00 0.21 0.00 0.00 66.02 66.76 2yum s SER 6 CO -0.02 -0.95 0.00 0.61 0.41 0.00 0.00 173.24 173.29 2yum n GLY 7 N -0.53 -0.42 1.29 3.44 0.00 -1.26 -5.04 105.19 102.67 2yum n GLY 7 Ca 0.04 0.25 0.00 0.00 0.00 0.00 0.00 46.02 46.31 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 0.30 -3.57 1.61 5.15 -1.26 -4.99 115.26 112.50 2yum n ASN 8 Ca 0.00 0.00 -0.28 0.00 -0.60 0.00 0.00 54.58 53.70 2yum n ASN 8 Cb 0.00 0.00 -0.11 0.00 -0.53 0.00 0.00 39.78 39.14 2yum n ASN 8 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 2yum s GLN 9 N -1.85 1.41 0.45 1.20 -0.21 -1.26 -5.12 119.66 114.28 2yum s GLN 9 Ca 0.00 -2.48 0.06 0.00 0.02 0.00 0.00 55.36 52.96 2yum s GLN 9 Cb 0.00 -2.09 0.02 0.00 1.00 0.00 0.00 33.01 31.93 2yum s GLN 9 CO 0.00 -1.34 0.62 -0.51 -2.12 0.00 0.00 175.29 171.94 2yum s LEU 10 N -0.39 3.57 1.41 2.90 1.43 -1.26 -5.10 118.68 121.25 2yum s LEU 10 Ca 0.29 -0.29 -0.23 0.00 -1.03 0.00 0.00 54.13 52.87 2yum s LEU 10 Cb -0.01 -2.73 0.36 0.00 0.03 0.00 0.00 46.19 43.85 2yum s LEU 10 CO -0.17 -0.84 0.95 0.26 0.23 0.00 0.00 176.35 176.77 2yum s TRP 11 N -2.45 -0.62 0.02 0.29 0.52 -1.26 -5.07 118.94 110.36 2yum s TRP 11 Ca 0.55 0.53 -0.00 0.00 0.02 0.00 0.00 56.10 57.19 2yum s TRP 11 Cb -0.10 -2.97 -0.02 0.00 -1.15 0.00 0.00 33.47 29.23 2yum s TRP 11 CO 0.34 -4.92 -0.01 -0.08 0.02 0.00 0.00 176.95 172.30 2yum s THR 12 N -2.37 0.09 0.21 2.01 -1.32 -1.26 -5.01 115.64 107.99 2yum s THR 12 Ca 0.69 -0.75 0.04 0.00 -1.21 0.00 0.00 61.69 60.46 2yum s THR 12 Cb -0.12 -0.23 0.27 0.00 -1.51 0.00 0.00 72.50 70.91 2yum s THR 12 CO 0.57 -0.41 1.03 0.52 -2.21 0.00 0.00 174.62 174.12 2yum n VAL 13 N 1.83 -0.27 0.00 5.08 0.31 -1.26 -0.26 118.33 123.75 2yum n VAL 13 Ca -0.22 1.42 -0.02 0.00 -0.01 0.00 0.00 64.34 65.50 2yum n VAL 13 Cb 0.56 -2.11 -0.02 0.00 -0.91 0.00 0.00 33.84 31.36 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 -0.09 -0.65 5.55 5.08 -1.99 -1.67 114.58 120.80 2yum h GLU 14 Ca 0.43 0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.77 2yum h GLU 14 Cb 0.95 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 30.19 2yum h GLU 14 CO -0.59 -0.06 0.31 0.93 -1.00 0.00 0.00 179.01 178.60 2yum h GLU 15 N -0.10 0.92 0.00 2.33 4.39 -1.12 0.19 114.58 121.20 2yum h GLU 15 Ca 0.00 -0.12 0.00 0.00 0.34 0.00 0.00 59.36 59.58 2yum h GLU 15 Cb 0.11 -0.17 0.00 0.00 -0.10 0.00 0.00 28.75 28.59 2yum h GLU 15 CO -0.07 0.71 0.00 1.04 -1.16 0.00 0.00 179.01 179.54 2yum n GLN 16 N -4.34 0.00 -0.04 2.33 6.02 0.64 0.61 117.38 122.60 2yum n GLN 16 Ca 0.06 0.85 -0.15 0.00 -0.01 0.00 0.00 57.00 57.75 2yum n GLN 16 Cb 0.13 -1.49 -0.08 0.00 1.02 0.00 0.00 30.24 29.82 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 0.48 -0.97 -1.09 2.10 -1.34 -3.02 116.57 112.74 2yum h LYS 17 Ca 0.00 -0.36 0.27 0.00 -2.00 0.00 0.00 60.65 58.56 2yum h LYS 17 Cb 0.00 0.06 -0.05 0.00 -0.90 0.00 0.00 32.23 31.35 2yum h LYS 17 CO 0.00 0.98 0.68 -0.22 -2.00 0.00 0.00 179.45 178.90 2yum h LYS 18 N 0.08 0.08 0.13 0.07 3.64 -0.51 -1.68 116.57 118.38 2yum h LYS 18 Ca -0.02 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 2yum h LYS 18 Cb 1.03 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.83 2yum h LYS 18 CO 0.09 0.05 -0.06 1.25 -2.27 0.00 0.00 179.45 178.50 2yum h LEU 19 N 0.08 -0.15 -0.94 5.20 5.85 0.24 -3.02 115.31 122.57 2yum h LEU 19 Ca 0.47 -0.27 0.28 0.00 0.84 0.00 0.00 57.88 59.20 2yum h LEU 19 Cb 1.74 0.04 -0.16 0.00 0.37 0.00 0.00 40.66 42.65 2yum h LEU 19 CO -0.05 0.43 0.30 -0.33 -0.34 0.00 0.00 178.44 178.45 2yum h GLU 20 N -0.98 0.16 0.00 1.25 5.08 -1.20 0.22 114.58 119.11 2yum h GLU 20 Ca -0.02 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2yum h GLU 20 Cb 0.42 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.63 2yum h GLU 20 CO 0.03 0.11 -0.00 1.96 -1.00 0.00 0.00 179.01 180.11 2yum h GLN 21 N 0.17 -0.00 -0.31 2.33 1.08 -1.48 -3.10 115.11 113.79 2yum h GLN 21 Ca 0.64 0.00 0.06 0.00 -1.45 0.00 0.00 58.65 57.90 2yum h GLN 21 Cb 1.40 0.00 -0.06 0.00 -0.05 0.00 0.00 27.48 28.77 2yum h GLN 21 CO -0.71 0.16 -0.09 -0.07 -0.95 0.00 0.00 178.83 177.17 2yum h LEU 22 N -0.16 -0.31 -0.95 1.46 3.38 -0.49 -1.70 115.31 116.55 2yum h LEU 22 Ca -0.00 0.10 0.27 0.00 0.09 0.00 0.00 57.88 58.34 2yum h LEU 22 Cb 0.16 0.20 -0.17 0.00 0.09 0.00 0.00 40.66 40.94 2yum h LEU 22 CO 0.00 -0.11 0.13 -0.07 0.09 0.00 0.00 178.44 178.48 2yum h LEU 23 N -0.01 -0.27 -0.41 1.67 3.38 -1.09 0.60 115.31 119.18 2yum h LEU 23 Ca 0.15 0.25 -0.06 0.00 0.09 0.00 0.00 57.88 58.31 2yum h LEU 23 Cb 0.24 0.40 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 2yum h LEU 23 CO -0.33 -0.30 0.01 0.40 0.09 0.00 0.00 178.44 178.31 2yum h ILE 24 N 0.06 1.26 -0.54 1.22 2.04 -1.31 -3.09 117.51 117.15 2yum h ILE 24 Ca 0.60 -1.00 0.01 0.00 1.00 0.00 0.00 64.86 65.47 2yum h ILE 24 Cb 1.27 1.10 -0.03 0.00 -0.74 0.00 0.00 36.82 38.42 2yum h ILE 24 CO -0.82 0.34 0.35 0.50 0.00 0.00 0.00 178.15 178.52 2yum h LYS 25 N 0.55 0.69 -4.57 2.37 3.64 0.45 -3.37 116.57 116.33 2yum h LYS 25 Ca 0.12 -0.04 -0.72 0.00 -1.27 0.00 0.00 60.65 58.74 2yum h LYS 25 Cb 0.47 -0.15 -0.21 0.00 -0.41 0.00 0.00 32.23 31.92 2yum h LYS 25 CO 0.02 0.45 -0.10 0.71 -2.27 0.00 0.00 179.45 178.26 2yum s TYR 26 N -6.15 3.13 0.82 1.91 2.02 0.32 -5.06 117.35 114.33 2yum s TYR 26 Ca -0.13 -0.85 -0.11 0.00 -0.37 0.00 0.00 57.07 55.61 2yum s TYR 26 Cb 0.13 -3.55 0.08 0.00 -0.40 0.00 0.00 41.96 38.22 2yum s TYR 26 CO 0.74 -1.01 1.09 -1.25 -1.57 0.00 0.00 175.55 173.56 2yum s PRO 27 N 2.17 1.90 0.03 -1.71 0.04 -1.26 -4.75 135.00 131.43 2yum s PRO 27 Ca 0.09 1.05 -0.30 0.00 0.04 0.00 0.00 61.00 61.87 2yum s PRO 27 Cb -0.23 -1.87 -0.06 0.00 0.04 0.00 0.00 34.50 32.38 2yum s PRO 27 CO 0.08 -1.86 1.42 -1.25 0.04 0.00 0.00 177.00 175.43 2yum s PRO 28 N -4.92 4.29 0.52 0.56 0.04 -1.26 -4.99 135.00 129.25 2yum s PRO 28 Ca 0.62 2.02 0.05 0.00 0.04 0.00 0.00 61.00 63.73 2yum s PRO 28 Cb -0.17 -3.50 0.02 0.00 0.04 0.00 0.00 34.50 30.89 2yum s PRO 28 CO 0.56 -0.55 0.32 -1.83 0.04 0.00 0.00 177.00 175.54 2yum s GLU 29 N 2.11 2.25 0.16 4.56 -1.05 -1.26 -5.04 118.70 120.44 2yum s GLU 29 Ca 0.65 -2.06 -0.16 0.00 -0.15 0.00 0.00 54.97 53.25 2yum s GLU 29 Cb -0.33 -2.00 0.10 0.00 -0.44 0.00 0.00 34.13 31.45 2yum s GLU 29 CO 0.28 -0.52 1.69 1.49 0.95 0.00 0.00 175.26 179.15 2yum h GLU 30 N 0.91 0.08 -5.28 -4.83 4.81 -2.05 -3.38 114.58 104.85 2yum h GLU 30 Ca -0.39 -0.00 -0.63 0.00 -0.13 0.00 0.00 59.36 58.21 2yum h GLU 30 Cb 1.30 -0.02 -0.14 0.00 0.63 0.00 0.00 28.75 30.52 2yum h GLU 30 CO 0.61 0.05 -0.05 0.08 -0.73 0.00 0.00 179.01 178.97 2yum s VAL 31 N -6.19 5.05 0.15 0.32 1.01 -1.26 -4.96 120.40 114.53 2yum s VAL 31 Ca -0.13 0.57 -0.13 0.00 0.00 0.00 0.00 61.98 62.29 2yum s VAL 31 Cb 0.14 -3.89 0.04 0.00 0.00 0.00 0.00 36.38 32.66 2yum s VAL 31 CO 0.71 -0.07 1.65 -0.08 0.00 0.00 0.00 175.10 177.31 2yum h GLU 32 N 8.27 0.85 0.46 2.72 4.57 -2.02 -3.06 114.58 126.37 2yum h GLU 32 Ca -0.29 -0.21 -0.01 0.00 -1.18 0.00 0.00 59.36 57.67 2yum h GLU 32 Cb 1.13 -0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 29.59 2yum h GLU 32 CO 0.74 0.82 -0.46 1.03 -1.18 0.00 0.00 179.01 179.95 2yum h SER 33 N 0.73 -1.27 -0.84 1.04 0.87 -1.95 -2.52 113.55 109.62 2yum h SER 33 Ca 0.16 0.10 0.20 0.00 -1.23 0.00 0.00 61.79 61.02 2yum h SER 33 Cb 0.36 0.42 -0.15 0.00 -0.44 0.00 0.00 62.40 62.59 2yum h SER 33 CO 0.01 -0.62 -0.04 0.03 -0.53 0.00 0.00 176.83 175.68 2yum h ARG 34 N -0.93 0.06 -0.04 2.24 3.08 -1.98 -1.35 114.38 115.45 2yum h ARG 34 Ca -0.05 -0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.01 2yum h ARG 34 Cb 0.82 -0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.82 2yum h ARG 34 CO -0.07 0.04 -0.33 -0.09 -1.07 0.00 0.00 179.97 178.45 2yum h ARG 35 N 0.06 -0.37 -0.76 0.04 2.43 -1.35 -1.53 114.38 112.89 2yum h ARG 35 Ca 0.46 0.03 0.18 0.00 -0.81 0.00 0.00 59.98 59.83 2yum h ARG 35 Cb 0.84 0.08 -0.13 0.00 -0.42 0.00 0.00 29.97 30.34 2yum h ARG 35 CO -0.79 -0.25 0.05 -1.49 -1.51 0.00 0.00 179.97 175.99 2yum h TRP 36 N -0.39 0.03 -0.63 2.20 -0.00 -1.05 0.12 115.95 116.23 2yum h TRP 36 Ca 0.01 0.05 0.12 0.00 -0.00 0.00 0.00 58.89 59.08 2yum h TRP 36 Cb 0.43 0.11 -0.09 0.00 -0.00 0.00 0.00 29.16 29.61 2yum h TRP 36 CO -0.49 -0.22 0.14 0.37 -0.00 0.00 0.00 178.44 178.24 2yum h GLN 37 N 0.13 0.26 0.85 0.49 5.75 -0.60 0.17 115.11 122.16 2yum h GLN 37 Ca 0.43 -0.02 -0.04 0.00 -0.15 0.00 0.00 58.65 58.87 2yum h GLN 37 Cb 0.76 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 29.25 2yum h GLN 37 CO -0.64 0.17 -0.49 0.87 -2.65 0.00 0.00 178.83 176.09 2yum h LYS 38 N 0.27 -1.20 -0.50 1.69 1.57 0.17 -1.48 116.57 117.08 2yum h LYS 38 Ca 0.33 0.08 0.10 0.00 -1.87 0.00 0.00 60.65 59.29 2yum h LYS 38 Cb 0.51 0.27 -0.08 0.00 0.08 0.00 0.00 32.23 33.01 2yum h LYS 38 CO -0.42 -0.80 0.03 0.82 -0.57 0.00 0.00 179.45 178.51 2yum h ILE 39 N -1.25 0.64 0.03 1.86 2.04 -1.03 -2.47 117.51 117.33 2yum h ILE 39 Ca -0.12 -0.05 0.03 0.00 1.00 0.00 0.00 64.86 65.72 2yum h ILE 39 Cb 0.99 0.47 -0.05 0.00 -0.74 0.00 0.00 36.82 37.48 2yum h ILE 39 CO 0.14 0.03 -0.43 0.00 0.00 0.00 0.00 178.15 177.89 2yum h ALA 40 N 1.43 -0.70 -0.91 1.87 0.00 -0.55 -1.84 119.26 118.56 2yum h ALA 40 Ca 0.26 -0.05 0.23 0.00 0.00 0.00 0.00 54.91 55.34 2yum h ALA 40 Cb 0.38 0.75 -0.17 0.00 0.00 0.00 0.00 17.79 18.74 2yum h ALA 40 CO -0.39 -0.97 -0.07 -3.47 0.00 0.00 0.00 179.25 174.35 2yum n ASP 41 N -5.45 -0.18 -0.01 0.00 2.03 -0.57 0.82 116.55 113.19 2yum n ASP 41 Ca -0.06 1.55 -0.10 0.00 0.52 0.00 0.00 54.79 56.69 2yum n ASP 41 Cb 0.37 -0.53 -0.05 0.00 -0.72 0.00 0.00 41.12 40.20 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 0.09 0.23 -0.67 4.39 -1.26 -3.05 114.58 114.30 2yum h GLU 42 Ca 0.51 -0.01 -0.01 0.00 0.34 0.00 0.00 59.36 60.19 2yum h GLU 42 Cb 0.97 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.60 2yum h GLU 42 CO -0.88 0.06 -0.11 -0.07 -1.16 0.00 0.00 179.01 176.84 2yum h LEU 43 N 0.09 -0.26 0.00 1.33 3.38 0.73 -3.47 115.31 117.11 2yum h LEU 43 Ca 0.05 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2yum h LEU 43 Cb 0.03 0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.84 2yum h LEU 43 CO -0.05 -0.11 0.00 0.61 0.09 0.00 0.00 178.44 178.98 2yum n GLY 44 N -0.99 2.40 0.21 0.83 0.00 0.71 -4.67 105.19 103.68 2yum n GLY 44 Ca -0.09 -0.48 -0.12 0.00 0.00 0.00 0.00 46.02 45.33 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 0.70 -3.97 1.61 2.35 -1.91 -3.45 115.58 110.92 2yum h ASN 45 Ca 0.00 -0.39 -0.50 0.00 -0.55 0.00 0.00 56.30 54.86 2yum h ASN 45 Cb 0.00 -0.19 0.05 0.00 0.05 0.00 0.00 38.32 38.23 2yum h ASN 45 CO 0.00 0.93 0.27 -0.13 -1.65 0.00 0.00 177.43 176.85 2yum s ARG 46 N -4.69 3.53 0.31 0.81 1.81 -1.26 -5.10 118.95 114.36 2yum s ARG 46 Ca -0.13 0.46 0.04 0.00 -1.72 0.00 0.00 55.73 54.38 2yum s ARG 46 Cb 0.09 -2.22 -0.06 0.00 -0.45 0.00 0.00 34.95 32.31 2yum s ARG 46 CO 0.81 -0.42 0.04 0.95 -0.68 0.00 0.00 175.30 176.00 2yum s THR 47 N -2.97 1.23 0.59 0.02 -4.23 -1.26 -4.63 115.64 104.38 2yum s THR 47 Ca 0.51 -2.01 0.30 0.00 -1.18 0.00 0.00 61.69 59.31 2yum s THR 47 Cb -0.11 -2.73 0.42 0.00 1.34 0.00 0.00 72.50 71.42 2yum s THR 47 CO 0.49 -0.05 1.73 0.00 -0.54 0.00 0.00 174.62 176.25 2yum h ALA 48 N 2.15 2.56 0.01 3.99 0.00 -1.87 0.04 119.26 126.14 2yum h ALA 48 Ca -0.41 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.48 2yum h ALA 48 Cb 1.24 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.09 2yum h ALA 48 CO 0.69 -1.13 -0.00 0.87 0.00 0.00 0.00 179.25 179.68 2yum h LYS 49 N 0.00 -0.01 -0.98 0.00 1.79 -1.94 -2.14 116.57 113.29 2yum h LYS 49 Ca 0.35 0.00 0.28 0.00 -2.18 0.00 0.00 60.65 59.11 2yum h LYS 49 Cb 1.84 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 32.45 2yum h LYS 49 CO -0.00 -0.01 0.79 1.96 -1.08 0.00 0.00 179.45 181.11 2yum h GLN 50 N -0.42 0.00 0.19 3.15 7.50 -1.81 0.43 115.11 124.15 2yum h GLN 50 Ca -0.00 0.00 -0.32 0.00 0.50 0.00 0.00 58.65 58.83 2yum h GLN 50 Cb 0.01 0.00 0.02 0.00 0.05 0.00 0.00 27.48 27.56 2yum h GLN 50 CO 0.00 0.00 -1.45 0.28 -1.50 0.00 0.00 178.83 176.16 2yum h VAL 51 N 0.00 1.29 -0.03 -0.54 2.07 -1.12 -2.82 116.25 115.10 2yum h VAL 51 Ca 0.46 -2.80 -0.00 0.00 0.82 0.00 0.00 66.70 65.18 2yum h VAL 51 Cb 2.04 2.94 -0.00 0.00 -1.52 0.00 0.00 31.29 34.75 2yum h VAL 51 CO -0.00 0.84 0.02 0.00 0.02 0.00 0.00 177.57 178.45 2yum h ALA 52 N 0.33 0.04 -0.48 1.67 0.00 0.54 0.63 119.26 121.98 2yum h ALA 52 Ca -0.23 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.58 2yum h ALA 52 Cb 2.08 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.84 2yum h ALA 52 CO 0.23 -0.44 -0.02 0.77 0.00 0.00 0.00 179.25 179.78 2yum h SER 53 N 0.01 0.85 -0.30 0.00 0.02 -1.48 -2.99 113.55 109.66 2yum h SER 53 Ca 0.01 -0.32 -0.00 0.00 -0.84 0.00 0.00 61.79 60.64 2yum h SER 53 Cb 0.03 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.33 2yum h SER 53 CO -0.00 0.96 0.18 -0.61 -1.14 0.00 0.00 176.83 176.22 2yum h GLN 54 N 0.72 0.40 -0.92 3.45 5.75 -1.34 -2.47 115.11 120.71 2yum h GLN 54 Ca 0.13 -0.04 0.16 0.00 -0.15 0.00 0.00 58.65 58.75 2yum h GLN 54 Cb 0.54 -0.08 -0.08 0.00 1.07 0.00 0.00 27.48 28.93 2yum h GLN 54 CO 0.03 0.31 0.59 0.28 -2.65 0.00 0.00 178.83 177.39 2yum h VAL 55 N 0.38 0.80 -0.26 2.39 2.07 -0.80 -1.34 116.25 119.48 2yum h VAL 55 Ca 0.11 -0.23 0.03 0.00 0.82 0.00 0.00 66.70 67.42 2yum h VAL 55 Cb 0.02 0.05 -0.03 0.00 -1.52 0.00 0.00 31.29 29.81 2yum h VAL 55 CO -0.02 0.12 0.08 1.56 0.02 0.00 0.00 177.57 179.33 2yum h GLN 56 N 0.68 0.18 -0.95 1.57 1.08 -1.30 -0.66 115.11 115.73 2yum h GLN 56 Ca 0.48 -0.01 -0.04 0.00 -1.45 0.00 0.00 58.65 57.63 2yum h GLN 56 Cb 0.80 -0.04 -0.02 0.00 -0.05 0.00 0.00 27.48 28.17 2yum h GLN 56 CO -0.23 0.12 0.05 1.63 -0.95 0.00 0.00 178.83 179.44 2yum n LYS 57 N -5.05 1.58 0.00 1.46 5.02 -0.53 -1.75 118.16 118.89 2yum n LYS 57 Ca -0.01 -0.61 0.00 0.00 -2.02 0.00 0.00 58.31 55.67 2yum n LYS 57 Cb 0.10 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.61 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 -0.06 2.13 4.02 -0.33 -4.60 117.16 118.46 2yum n TYR 58 Ca 0.08 0.00 -0.11 0.00 -0.01 0.00 0.00 57.90 57.86 2yum n TYR 58 Cb 0.54 0.00 -0.05 0.00 -0.02 0.00 0.00 39.34 39.81 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 -2.04 0.00 -0.03 -0.72 3.01 -0.75 -4.66 117.46 112.27 2yum n PHE 59 Ca 0.00 0.00 -0.13 0.00 1.01 0.00 0.00 57.45 58.33 2yum n PHE 59 Cb 0.45 -0.46 -0.10 0.00 -0.01 0.00 0.00 39.48 39.36 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 -0.21 1.46 -0.90 4.37 2.04 -1.54 -3.25 117.51 119.50 2yum h ILE 60 Ca -0.29 -1.43 0.29 0.00 1.00 0.00 0.00 64.86 64.42 2yum h ILE 60 Cb 1.36 2.39 -0.17 0.00 -0.74 0.00 0.00 36.82 39.66 2yum h ILE 60 CO -0.11 0.38 0.17 1.17 0.00 0.00 0.00 178.15 179.76 2yum n LYS 61 N -4.75 -0.07 -0.33 2.37 4.81 -1.11 0.14 118.16 119.22 2yum n LYS 61 Ca -0.09 1.31 0.04 0.00 -0.87 0.00 0.00 58.31 58.70 2yum n LYS 61 Cb 0.32 -2.16 0.11 0.00 0.02 0.00 0.00 35.03 33.32 2yum n LYS 61 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 2yum n LEU 62 N -5.22 -0.39 -4.25 3.14 4.77 -1.22 -4.54 117.00 109.28 2yum n LEU 62 Ca 0.25 1.58 -0.43 0.00 -0.03 0.00 0.00 56.01 57.38 2yum n LEU 62 Cb 0.84 -0.45 -0.01 0.00 -2.33 0.00 0.00 43.42 41.47 2yum n LEU 62 CO -0.04 -1.49 -0.27 1.07 -1.33 0.00 0.00 177.39 175.32 2yum n THR 63 N -5.46 1.12 -1.41 -5.08 5.66 0.12 -4.67 114.28 104.56 2yum n THR 63 Ca 0.13 -0.49 -0.52 0.00 -3.05 0.00 0.00 64.05 60.12 2yum n THR 63 Cb 0.44 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.16 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 1.19 0.00 -2.80 1.09 5.02 -1.26 -4.88 118.16 116.52 2yum n LYS 64 Ca 0.13 0.00 -0.40 0.00 -2.02 0.00 0.00 58.31 56.02 2yum n LYS 64 Cb 0.34 -1.23 -0.06 0.00 -0.02 0.00 0.00 35.03 34.06 2yum n LYS 64 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2yum s ALA 65 N -0.44 3.35 0.00 7.82 0.00 -1.26 -4.62 121.76 126.61 2yum s ALA 65 Ca 0.76 0.55 0.00 0.00 0.00 0.00 0.00 51.96 53.27 2yum s ALA 65 Cb -1.08 -3.16 0.00 0.00 0.00 0.00 0.00 23.12 18.88 2yum s ALA 65 CO 0.55 0.20 0.00 0.41 0.00 0.00 0.00 175.76 176.92 2yum n GLY 66 N 1.61 0.64 3.26 0.00 0.00 -1.26 -5.15 105.19 104.28 2yum n GLY 66 Ca -0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.14 1.94 -0.06 -0.61 1.01 -1.26 -5.10 121.20 115.97 2yum s ILE 67 Ca 0.00 -1.02 -0.30 0.00 0.00 0.00 0.00 60.65 59.34 2yum s ILE 67 Cb 0.00 -1.63 -0.05 0.00 0.01 0.00 0.00 42.46 40.79 2yum s ILE 67 CO 0.00 0.54 1.50 -2.16 0.00 0.00 0.00 174.94 174.82 2yum s PRO 68 N -0.27 4.22 -0.10 2.79 0.04 -1.26 -5.01 135.00 135.40 2yum s PRO 68 Ca 0.01 2.02 -0.02 0.00 0.04 0.00 0.00 61.00 63.05 2yum s PRO 68 Cb -0.12 -3.82 -0.03 0.00 0.04 0.00 0.00 34.50 30.57 2yum s PRO 68 CO 0.02 -0.75 -0.03 0.08 0.04 0.00 0.00 177.00 176.36 2yum s VAL 69 N 3.48 4.03 0.00 -0.36 1.01 -1.26 -4.97 120.40 122.33 2yum s VAL 69 Ca 0.67 -0.34 0.00 0.00 0.00 0.00 0.00 61.98 62.31 2yum s VAL 69 Cb -0.30 -2.70 0.00 0.00 0.00 0.00 0.00 36.38 33.38 2yum s VAL 69 CO 0.25 0.57 0.00 -1.20 0.00 0.00 0.00 175.10 174.73 2yum n SER 70 N 2.52 0.35 0.00 3.32 7.64 -1.26 -5.12 113.62 121.07 2yum n SER 70 Ca -0.18 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.70 2yum n SER 70 Cb 0.53 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.73 2yum n SER 70 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2yum n GLY 71 N 1.94 0.84 3.77 0.23 0.00 -1.26 -5.08 105.19 105.63 2yum n GLY 71 Ca 0.00 -0.58 -0.34 0.00 0.00 0.00 0.00 46.02 45.09 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 -0.12 3.17 -1.61 1.61 0.04 -1.26 -3.44 135.00 133.38 2yum s PRO 72 Ca 0.00 1.54 -0.14 0.00 0.04 0.00 0.00 61.00 62.43 2yum s PRO 72 Cb 0.00 -1.99 0.11 0.00 0.04 0.00 0.00 34.50 32.67 2yum s PRO 72 CO 0.00 -0.98 0.78 0.45 0.04 0.00 0.00 177.00 177.29 2yum n SER 73 N -1.68 -3.22 -0.31 6.66 2.88 -1.26 -4.81 113.62 111.88 2yum n SER 73 Ca 0.11 -0.95 0.13 0.00 -1.33 0.00 0.00 58.87 56.83 2yum n SER 73 Cb 0.51 -3.11 0.36 0.00 -0.75 0.00 0.00 64.21 61.23 2yum n SER 73 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 2yum h SER 74 N -1.71 0.70 0.00 -3.46 4.64 -1.98 -3.57 113.55 108.17 2yum h SER 74 Ca -0.59 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 60.79 2yum h SER 74 Cb 1.38 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.40 2yum h SER 74 CO 0.73 0.30 0.00 0.61 -0.87 0.00 0.00 176.83 177.60