#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 4.24 0.50 1.61 0.01 -1.26 -5.16 113.70 113.64 2yum s SER 2 Ca 0.00 -1.42 0.08 0.00 1.31 0.00 0.00 55.95 55.92 2yum s SER 2 Cb 0.00 0.16 0.04 0.00 0.21 0.00 0.00 66.02 66.43 2yum s SER 2 CO 0.00 -0.78 0.59 -0.94 0.41 0.00 0.00 173.24 172.53 2yum s SER 3 N -3.93 5.18 0.04 2.44 1.04 -1.26 -5.08 113.70 112.13 2yum s SER 3 Ca 0.23 -0.77 -0.30 0.00 0.48 0.00 0.00 55.95 55.58 2yum s SER 3 Cb 0.03 -0.11 -0.05 0.00 0.10 0.00 0.00 66.02 65.99 2yum s SER 3 CO 0.13 -1.02 1.13 -0.83 0.98 0.00 0.00 173.24 173.63 2yum s GLY 4 N -4.42 2.57 -0.14 7.32 0.00 -1.26 -5.02 107.32 106.38 2yum s GLY 4 Ca 0.53 0.75 -0.29 0.00 0.00 0.00 0.00 44.72 45.71 2yum s GLY 4 CO 0.33 1.93 0.83 -0.45 0.00 0.00 0.00 173.10 175.73 2yum s SER 5 N 1.04 -0.55 0.40 1.64 0.15 -1.26 -5.16 113.70 109.97 2yum s SER 5 Ca 0.57 0.70 -0.25 0.00 0.70 0.00 0.00 55.95 57.66 2yum s SER 5 Cb -0.27 0.59 -0.09 0.00 -1.71 0.00 0.00 66.02 64.55 2yum s SER 5 CO 0.29 -0.43 1.18 -0.44 1.20 0.00 0.00 173.24 175.04 2yum s SER 6 N -0.85 6.53 0.41 5.45 0.01 -1.26 -4.63 113.70 119.35 2yum s SER 6 Ca -0.05 2.38 0.00 0.00 1.31 0.00 0.00 55.95 59.58 2yum s SER 6 Cb -0.01 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.60 2yum s SER 6 CO 0.04 -0.67 0.00 0.61 0.41 0.00 0.00 173.24 173.63 2yum n GLY 7 N 0.65 1.44 2.70 3.44 0.00 -1.26 -4.95 105.19 107.21 2yum n GLY 7 Ca 0.04 -0.86 -0.14 0.00 0.00 0.00 0.00 46.02 45.06 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 3.67 -4.46 -1.92 1.61 3.02 -1.26 -4.91 115.26 111.01 2yum n ASN 8 Ca 0.00 -0.31 -0.15 0.00 -0.03 0.00 0.00 54.58 54.08 2yum n ASN 8 Cb 0.00 -3.11 0.01 0.00 -0.61 0.00 0.00 39.78 36.07 2yum n ASN 8 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2yum n GLN 9 N -3.09 1.78 -4.03 3.52 6.02 -1.26 -4.91 117.38 115.41 2yum n GLN 9 Ca 0.00 -1.42 -0.22 0.00 -0.01 0.00 0.00 57.00 55.35 2yum n GLN 9 Cb 0.54 -1.61 -0.03 0.00 1.02 0.00 0.00 30.24 30.15 2yum n GLN 9 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2yum s LEU 10 N -1.53 4.12 0.15 1.08 1.43 -1.26 -5.04 118.68 117.62 2yum s LEU 10 Ca 0.32 -0.05 -0.30 0.00 -1.03 0.00 0.00 54.13 53.07 2yum s LEU 10 Cb 0.23 -2.66 -0.17 0.00 0.03 0.00 0.00 46.19 43.62 2yum s LEU 10 CO -0.03 -0.04 0.63 0.79 0.23 0.00 0.00 176.35 177.92 2yum n TRP 11 N -1.22 -0.21 -2.77 0.29 7.02 -1.26 -4.95 117.44 114.33 2yum n TRP 11 Ca -0.08 0.96 -0.20 0.00 -1.02 0.00 0.00 57.50 57.15 2yum n TRP 11 Cb 0.57 -1.92 0.03 0.00 -2.42 0.00 0.00 31.31 27.57 2yum n TRP 11 CO 0.00 0.00 0.00 -0.08 -2.02 0.00 0.00 177.69 175.59 2yum s THR 12 N -0.74 2.82 0.23 -0.99 -1.32 -1.26 -4.87 115.64 109.52 2yum s THR 12 Ca 0.68 -0.76 -0.06 0.00 -1.21 0.00 0.00 61.69 60.33 2yum s THR 12 Cb -0.97 -3.02 0.20 0.00 -1.51 0.00 0.00 72.50 67.19 2yum s THR 12 CO 0.54 -0.01 1.72 1.62 -2.21 0.00 0.00 174.62 176.28 2yum h VAL 13 N 0.26 0.65 0.35 5.08 3.04 -1.99 0.13 116.25 123.77 2yum h VAL 13 Ca -0.42 -0.13 -0.01 0.00 -1.01 0.00 0.00 66.70 65.14 2yum h VAL 13 Cb 1.29 0.25 -0.01 0.00 -2.01 0.00 0.00 31.29 30.80 2yum h VAL 13 CO 0.50 0.07 -0.34 -0.33 -1.01 0.00 0.00 177.57 176.46 2yum h GLU 14 N 0.37 -0.66 -0.39 4.17 4.39 -2.00 -2.73 114.58 117.73 2yum h GLU 14 Ca 0.38 0.05 0.07 0.00 0.34 0.00 0.00 59.36 60.19 2yum h GLU 14 Cb 0.56 0.15 -0.06 0.00 -0.10 0.00 0.00 28.75 29.30 2yum h GLU 14 CO -0.40 -0.44 0.00 0.93 -1.16 0.00 0.00 179.01 177.93 2yum h GLU 15 N -0.69 0.10 -0.25 2.33 3.07 -1.87 -1.24 114.58 116.03 2yum h GLU 15 Ca -0.04 -0.01 0.02 0.00 -0.50 0.00 0.00 59.36 58.83 2yum h GLU 15 Cb 0.59 -0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 28.45 2yum h GLU 15 CO -0.04 0.07 -0.15 1.04 -1.40 0.00 0.00 179.01 178.53 2yum n GLN 16 N -5.19 -0.11 0.06 2.33 6.02 0.44 0.39 117.38 121.32 2yum n GLN 16 Ca 0.02 1.06 0.04 0.00 -0.01 0.00 0.00 57.00 58.12 2yum n GLN 16 Cb 0.20 -1.58 0.46 0.00 1.02 0.00 0.00 30.24 30.33 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 0.40 -0.14 -1.09 2.10 -1.33 0.43 116.57 116.93 2yum h LYS 17 Ca 0.04 -0.03 -0.02 0.00 -2.00 0.00 0.00 60.65 58.64 2yum h LYS 17 Cb 0.10 -0.09 -0.01 0.00 -0.90 0.00 0.00 32.23 31.34 2yum h LYS 17 CO -0.24 0.30 0.00 -0.22 -2.00 0.00 0.00 179.45 177.30 2yum h LYS 18 N 0.41 0.20 0.09 0.07 1.63 0.12 -1.20 116.57 117.89 2yum h LYS 18 Ca 0.11 -0.03 -0.31 0.00 -0.85 0.00 0.00 60.65 59.57 2yum h LYS 18 Cb 0.01 -0.04 -0.02 0.00 -0.60 0.00 0.00 32.23 31.59 2yum h LYS 18 CO -0.02 0.22 -1.66 1.25 -3.45 0.00 0.00 179.45 175.80 2yum h LEU 19 N 0.20 0.29 -0.81 5.20 5.85 0.93 -3.22 115.31 123.75 2yum h LEU 19 Ca 0.05 -0.80 0.09 0.00 0.84 0.00 0.00 57.88 58.06 2yum h LEU 19 Cb 0.14 -0.10 -0.07 0.00 0.37 0.00 0.00 40.66 41.00 2yum h LEU 19 CO 0.00 1.70 0.46 -0.33 -0.34 0.00 0.00 178.44 179.94 2yum h GLU 20 N -0.32 0.76 0.02 1.25 5.08 -0.83 0.23 114.58 120.77 2yum h GLU 20 Ca -0.38 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 57.94 2yum h GLU 20 Cb 1.77 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.85 2yum h GLU 20 CO -0.00 0.50 -0.01 1.96 -1.00 0.00 0.00 179.01 180.46 2yum h GLN 21 N 0.78 -0.03 -0.69 2.33 4.20 -1.39 -3.16 115.11 117.17 2yum h GLN 21 Ca 0.39 0.00 0.03 0.00 0.06 0.00 0.00 58.65 59.13 2yum h GLN 21 Cb 0.35 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.09 2yum h GLN 21 CO -0.24 0.32 0.43 -0.07 -0.67 0.00 0.00 178.83 178.60 2yum h LEU 22 N -0.38 0.71 -0.91 1.46 3.38 -1.46 -2.19 115.31 115.92 2yum h LEU 22 Ca -0.00 0.00 0.22 0.00 0.09 0.00 0.00 57.88 58.19 2yum h LEU 22 Cb 0.36 -0.15 -0.12 0.00 0.09 0.00 0.00 40.66 40.84 2yum h LEU 22 CO 0.00 0.49 0.42 -0.07 0.09 0.00 0.00 178.44 179.37 2yum h LEU 23 N 0.84 0.37 0.17 1.67 3.38 -0.54 0.15 115.31 121.35 2yum h LEU 23 Ca 0.28 0.15 -0.01 0.00 0.09 0.00 0.00 57.88 58.39 2yum h LEU 23 Cb 0.02 0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.89 2yum h LEU 23 CO -0.11 0.01 -0.08 0.40 0.09 0.00 0.00 178.44 178.75 2yum h ILE 24 N 0.42 0.95 -0.89 1.22 2.04 -1.37 -3.06 117.51 116.82 2yum h ILE 24 Ca 0.57 -0.60 0.11 0.00 1.00 0.00 0.00 64.86 65.94 2yum h ILE 24 Cb 1.09 1.31 -0.07 0.00 -0.74 0.00 0.00 36.82 38.41 2yum h ILE 24 CO -0.52 0.14 0.57 0.50 0.00 0.00 0.00 178.15 178.84 2yum h LYS 25 N -0.52 0.82 -3.88 2.37 3.64 -0.98 -3.31 116.57 114.71 2yum h LYS 25 Ca -0.02 -0.05 -0.75 0.00 -1.27 0.00 0.00 60.65 58.56 2yum h LYS 25 Cb 0.40 -0.18 -0.29 0.00 -0.41 0.00 0.00 32.23 31.74 2yum h LYS 25 CO 0.04 0.54 -0.15 0.71 -2.27 0.00 0.00 179.45 178.32 2yum s TYR 26 N -5.79 3.55 0.85 1.91 2.02 0.39 -5.07 117.35 115.22 2yum s TYR 26 Ca -0.11 -2.08 -0.11 0.00 -0.37 0.00 0.00 57.07 54.40 2yum s TYR 26 Cb 0.21 -3.60 0.10 0.00 -0.40 0.00 0.00 41.96 38.27 2yum s TYR 26 CO 0.79 -0.96 1.09 -1.25 -1.57 0.00 0.00 175.55 173.66 2yum s PRO 27 N 0.49 1.64 0.01 -1.71 0.04 -1.25 -4.72 135.00 129.51 2yum s PRO 27 Ca 0.14 0.96 -0.30 0.00 0.04 0.00 0.00 61.00 61.84 2yum s PRO 27 Cb -0.18 -1.84 -0.06 0.00 0.04 0.00 0.00 34.50 32.46 2yum s PRO 27 CO -0.05 -2.01 1.44 -1.25 0.04 0.00 0.00 177.00 175.17 2yum s PRO 28 N -4.92 4.27 0.27 0.56 0.04 -1.26 -5.02 135.00 128.94 2yum s PRO 28 Ca 0.63 2.02 0.02 0.00 0.04 0.00 0.00 61.00 63.70 2yum s PRO 28 Cb -0.18 -3.57 0.02 0.00 0.04 0.00 0.00 34.50 30.81 2yum s PRO 28 CO 0.57 -0.60 0.13 -0.85 0.04 0.00 0.00 177.00 176.29 2yum n GLU 29 N 5.39 1.19 -0.19 4.56 0.00 -1.26 -5.03 120.64 125.30 2yum n GLU 29 Ca 0.14 -1.77 -0.01 0.00 0.00 0.00 0.00 57.16 55.51 2yum n GLU 29 Cb 0.43 0.29 0.06 0.00 0.00 0.00 0.00 31.44 32.22 2yum n GLU 29 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.13 178.62 2yum h GLU 30 N 0.00 0.02 -6.34 3.44 4.81 -2.07 -3.41 114.58 111.03 2yum h GLU 30 Ca -0.19 -0.00 -0.63 0.00 -0.13 0.00 0.00 59.36 58.41 2yum h GLU 30 Cb 0.64 -0.00 -0.11 0.00 0.63 0.00 0.00 28.75 29.90 2yum h GLU 30 CO 0.30 0.01 -0.65 0.08 -0.73 0.00 0.00 179.01 178.02 2yum s VAL 31 N -6.22 3.97 -0.20 0.32 1.01 -1.26 -5.03 120.40 112.99 2yum s VAL 31 Ca -0.14 -1.10 0.17 0.00 0.00 0.00 0.00 61.98 60.91 2yum s VAL 31 Cb 0.18 -2.93 -0.25 0.00 0.00 0.00 0.00 36.38 33.39 2yum s VAL 31 CO 0.73 0.05 0.06 -1.84 0.00 0.00 0.00 175.10 174.10 2yum n GLU 32 N 0.33 0.69 0.00 2.72 0.28 -1.26 -4.16 120.64 119.24 2yum n GLU 32 Ca -0.10 0.00 -0.05 0.00 -0.16 0.00 0.00 57.16 56.85 2yum n GLU 32 Cb 0.53 -1.52 -0.03 0.00 1.43 0.00 0.00 31.44 31.84 2yum n GLU 32 CO 0.00 0.00 0.00 1.03 -0.16 0.00 0.00 177.13 178.00 2yum h SER 33 N 0.00 -0.55 -0.83 -1.84 0.87 -1.97 0.14 113.55 109.38 2yum h SER 33 Ca -0.55 0.06 0.09 0.00 -1.23 0.00 0.00 61.79 60.17 2yum h SER 33 Cb 2.23 0.21 -0.07 0.00 -0.44 0.00 0.00 62.40 64.33 2yum h SER 33 CO 0.02 -0.16 0.48 0.08 -0.53 0.00 0.00 176.83 176.72 2yum h ARG 34 N -0.19 0.79 -0.94 2.24 -0.00 -2.00 -0.93 114.38 113.35 2yum h ARG 34 Ca 0.01 -0.05 0.17 0.00 -0.00 0.00 0.00 59.98 60.11 2yum h ARG 34 Cb 0.22 -0.18 -0.08 0.00 -0.00 0.00 0.00 29.97 29.93 2yum h ARG 34 CO -0.14 0.52 0.60 -0.09 -0.00 0.00 0.00 179.97 180.86 2yum h ARG 35 N 0.81 0.66 0.00 0.08 2.43 -1.55 0.27 114.38 117.08 2yum h ARG 35 Ca 0.39 -0.04 -0.10 0.00 -0.81 0.00 0.00 59.98 59.43 2yum h ARG 35 Cb 0.34 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.73 2yum h ARG 35 CO -0.24 0.44 -0.45 -1.49 -1.51 0.00 0.00 179.97 176.72 2yum h TRP 36 N 0.68 0.00 -0.41 2.20 -0.00 0.42 -3.07 115.95 115.77 2yum h TRP 36 Ca 0.49 0.00 -0.09 0.00 -0.00 0.00 0.00 58.89 59.30 2yum h TRP 36 Cb 0.85 0.00 -0.01 0.00 -0.00 0.00 0.00 29.16 30.00 2yum h TRP 36 CO -0.00 0.45 -0.09 0.37 -0.00 0.00 0.00 178.44 179.17 2yum h GLN 37 N 0.00 0.79 0.42 0.49 5.75 -0.16 -0.87 115.11 121.53 2yum h GLN 37 Ca -0.00 -0.29 -0.02 0.00 -0.15 0.00 0.00 58.65 58.18 2yum h GLN 37 Cb 0.98 -0.05 0.00 0.00 1.07 0.00 0.00 27.48 29.49 2yum h GLN 37 CO 0.06 0.91 -0.20 0.87 -2.65 0.00 0.00 178.83 177.81 2yum h LYS 38 N 0.61 -0.54 -0.24 1.69 1.57 -1.40 -1.52 116.57 116.73 2yum h LYS 38 Ca 0.11 0.04 0.03 0.00 -1.87 0.00 0.00 60.65 58.95 2yum h LYS 38 Cb 0.61 0.12 -0.03 0.00 0.08 0.00 0.00 32.23 33.01 2yum h LYS 38 CO 0.04 -0.28 0.06 0.82 -0.57 0.00 0.00 179.45 179.52 2yum h ILE 39 N -0.72 0.91 0.15 1.86 2.04 -1.57 -2.97 117.51 117.21 2yum h ILE 39 Ca -0.06 -0.06 0.02 0.00 1.00 0.00 0.00 64.86 65.76 2yum h ILE 39 Cb 0.51 0.73 -0.04 0.00 -0.74 0.00 0.00 36.82 37.28 2yum h ILE 39 CO 0.09 0.03 -0.41 0.00 0.00 0.00 0.00 178.15 177.87 2yum h ALA 40 N 1.16 -0.74 -0.96 1.87 0.00 -1.13 -2.17 119.26 117.29 2yum h ALA 40 Ca 0.11 -0.08 0.21 0.00 0.00 0.00 0.00 54.91 55.15 2yum h ALA 40 Cb 0.09 0.68 -0.18 0.00 0.00 0.00 0.00 17.79 18.38 2yum h ALA 40 CO -0.13 -0.98 -0.17 -3.47 0.00 0.00 0.00 179.25 174.50 2yum n ASP 41 N -5.46 -0.28 0.29 0.00 2.03 -0.58 -0.32 116.55 112.23 2yum n ASP 41 Ca -0.07 1.64 -0.17 0.00 0.52 0.00 0.00 54.79 56.71 2yum n ASP 41 Cb 0.38 -0.52 -0.08 0.00 -0.72 0.00 0.00 41.12 40.17 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 -0.78 -0.86 -0.67 4.39 -1.30 -2.86 114.58 112.50 2yum h GLU 42 Ca 0.49 0.05 0.17 0.00 0.34 0.00 0.00 59.36 60.41 2yum h GLU 42 Cb 0.83 0.18 -0.16 0.00 -0.10 0.00 0.00 28.75 29.50 2yum h GLU 42 CO -0.96 -0.52 -0.25 -0.07 -1.16 0.00 0.00 179.01 176.05 2yum h LEU 43 N -0.81 -0.92 0.00 1.33 3.38 -0.27 -3.45 115.31 114.57 2yum h LEU 43 Ca -0.05 0.26 0.00 0.00 0.09 0.00 0.00 57.88 58.18 2yum h LEU 43 Cb 0.68 0.57 0.00 0.00 0.09 0.00 0.00 40.66 42.00 2yum h LEU 43 CO 0.03 -0.29 0.00 0.61 0.09 0.00 0.00 178.44 178.88 2yum n GLY 44 N -1.54 2.65 0.09 0.83 0.00 -0.80 -4.74 105.19 101.69 2yum n GLY 44 Ca 0.12 -0.25 -0.09 0.00 0.00 0.00 0.00 46.02 45.79 2yum n GLY 44 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2yum n ASN 45 N 0.76 1.94 -4.60 1.61 0.23 -1.26 -5.01 115.26 108.93 2yum n ASN 45 Ca 0.00 0.34 -0.29 0.00 -0.53 0.00 0.00 54.58 54.10 2yum n ASN 45 Cb 0.00 -0.75 0.20 0.00 -2.08 0.00 0.00 39.78 37.15 2yum n ASN 45 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 2yum s ARG 46 N -2.87 0.07 0.26 -3.83 1.81 -1.26 -5.07 118.95 108.06 2yum s ARG 46 Ca -0.29 0.85 0.05 0.00 -1.72 0.00 0.00 55.73 54.63 2yum s ARG 46 Cb 0.04 -1.67 -0.06 0.00 -0.45 0.00 0.00 34.95 32.82 2yum s ARG 46 CO 0.42 -3.06 -0.04 -0.08 -0.68 0.00 0.00 175.30 171.86 2yum s THR 47 N -2.70 1.43 0.34 0.02 -1.32 -1.26 -4.68 115.64 107.47 2yum s THR 47 Ca 0.66 -2.09 0.13 0.00 -1.21 0.00 0.00 61.69 59.19 2yum s THR 47 Cb -0.22 -2.42 0.34 0.00 -1.51 0.00 0.00 72.50 68.69 2yum s THR 47 CO 0.61 -0.30 1.63 0.00 -2.21 0.00 0.00 174.62 174.34 2yum h ALA 48 N 2.34 1.83 -0.11 11.08 0.00 -1.89 0.11 119.26 132.62 2yum h ALA 48 Ca -0.39 0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2yum h ALA 48 Cb 1.23 0.27 0.00 0.00 0.00 0.00 0.00 17.79 19.29 2yum h ALA 48 CO 0.66 -0.66 0.00 1.63 0.00 0.00 0.00 179.25 180.88 2yum n LYS 49 N -5.18 0.00 -0.54 0.00 4.76 -1.26 -1.67 118.16 114.26 2yum n LYS 49 Ca 0.31 0.48 0.44 0.00 -2.87 0.00 0.00 58.31 56.67 2yum n LYS 49 Cb 1.00 -1.25 0.72 0.00 -1.84 0.00 0.00 35.03 33.66 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 0.01 -0.17 1.97 7.50 -1.83 1.44 115.11 124.03 2yum h GLN 50 Ca 0.00 -0.00 -0.21 0.00 0.50 0.00 0.00 58.65 58.94 2yum h GLN 50 Cb 0.00 -0.00 0.01 0.00 0.05 0.00 0.00 27.48 27.54 2yum h GLN 50 CO 0.00 0.01 -0.71 0.28 -1.50 0.00 0.00 178.83 176.91 2yum h VAL 51 N 0.01 1.29 -0.36 -0.54 2.07 -0.81 -2.83 116.25 115.08 2yum h VAL 51 Ca 0.89 -1.91 0.03 0.00 0.82 0.00 0.00 66.70 66.52 2yum h VAL 51 Cb 3.10 1.96 -0.03 0.00 -1.52 0.00 0.00 31.29 34.80 2yum h VAL 51 CO -0.31 0.61 0.18 0.00 0.02 0.00 0.00 177.57 178.06 2yum h ALA 52 N 0.56 0.45 -0.03 1.67 0.00 0.29 -1.96 119.26 120.24 2yum h ALA 52 Ca -0.04 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2yum h ALA 52 Cb 1.34 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.08 2yum h ALA 52 CO 0.15 -0.19 0.02 0.77 0.00 0.00 0.00 179.25 179.99 2yum h SER 53 N 0.37 0.04 -0.58 0.00 0.02 -1.45 -2.89 113.55 109.05 2yum h SER 53 Ca 0.15 -0.07 0.11 0.00 -0.84 0.00 0.00 61.79 61.14 2yum h SER 53 Cb 0.07 -0.01 -0.09 0.00 0.14 0.00 0.00 62.40 62.51 2yum h SER 53 CO -0.11 0.10 0.05 -0.61 -1.14 0.00 0.00 176.83 175.12 2yum h GLN 54 N -0.03 0.17 -0.94 3.45 5.75 -1.26 -0.17 115.11 122.07 2yum h GLN 54 Ca 0.01 -0.01 0.13 0.00 -0.15 0.00 0.00 58.65 58.63 2yum h GLN 54 Cb 0.07 -0.04 -0.09 0.00 1.07 0.00 0.00 27.48 28.50 2yum h GLN 54 CO -0.00 0.11 0.56 0.28 -2.65 0.00 0.00 178.83 177.12 2yum h VAL 55 N 0.17 0.83 -0.32 2.39 2.07 -1.17 -1.82 116.25 118.40 2yum h VAL 55 Ca 0.30 -0.29 0.07 0.00 0.82 0.00 0.00 66.70 67.60 2yum h VAL 55 Cb 0.46 -0.07 -0.07 0.00 -1.52 0.00 0.00 31.29 30.09 2yum h VAL 55 CO -0.45 0.15 -0.15 1.56 0.02 0.00 0.00 177.57 178.71 2yum h GLN 56 N 0.83 -0.09 -0.93 1.57 1.08 -0.83 0.25 115.11 116.99 2yum h GLN 56 Ca 0.49 0.01 -0.02 0.00 -1.45 0.00 0.00 58.65 57.68 2yum h GLN 56 Cb 0.58 0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 28.02 2yum h GLN 56 CO -0.31 -0.06 0.02 1.63 -0.95 0.00 0.00 178.83 179.16 2yum n LYS 57 N -5.33 1.66 0.00 1.46 5.02 -0.72 -2.01 118.16 118.25 2yum n LYS 57 Ca 0.01 -0.60 0.00 0.00 -2.02 0.00 0.00 58.31 55.70 2yum n LYS 57 Cb 0.24 -1.57 0.00 0.00 -0.02 0.00 0.00 35.03 33.67 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 0.13 0.00 -0.09 2.13 4.02 0.69 -4.65 117.16 119.39 2yum n TYR 58 Ca 0.06 0.00 -0.19 0.00 -0.01 0.00 0.00 57.90 57.77 2yum n TYR 58 Cb 0.48 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.74 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 -2.31 0.00 -0.25 -0.72 3.01 -0.02 -4.48 117.46 112.70 2yum n PHE 59 Ca 0.00 0.00 -0.05 0.00 1.01 0.00 0.00 57.45 58.41 2yum n PHE 59 Cb 0.47 -0.64 0.05 0.00 -0.01 0.00 0.00 39.48 39.35 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 -0.70 1.18 -0.89 4.37 2.04 -1.58 -2.41 117.51 119.53 2yum h ILE 60 Ca -0.42 -0.33 0.19 0.00 1.00 0.00 0.00 64.86 65.31 2yum h ILE 60 Cb 1.31 0.16 -0.11 0.00 -0.74 0.00 0.00 36.82 37.44 2yum h ILE 60 CO -0.25 0.17 0.44 0.50 0.00 0.00 0.00 178.15 179.01 2yum h LYS 61 N 0.94 0.51 -0.47 2.37 3.64 -1.80 0.09 116.57 121.85 2yum h LYS 61 Ca 0.25 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.57 2yum h LYS 61 Cb -0.10 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.58 2yum h LYS 61 CO -0.05 0.34 0.15 -0.07 -2.27 0.00 0.00 179.45 177.55 2yum h LEU 62 N 0.52 0.69 -0.89 5.20 3.38 -1.66 -3.17 115.31 119.38 2yum h LEU 62 Ca 0.53 -0.20 0.09 0.00 0.09 0.00 0.00 57.88 58.39 2yum h LEU 62 Cb 0.91 -0.18 -0.12 0.00 0.09 0.00 0.00 40.66 41.36 2yum h LEU 62 CO -0.45 0.71 -0.54 0.74 0.09 0.00 0.00 178.44 178.98 2yum h THR 63 N 0.63 0.01 -4.84 0.22 2.02 -0.80 -3.45 112.91 106.69 2yum h THR 63 Ca 0.15 0.00 -0.31 0.00 0.77 0.00 0.00 66.41 67.03 2yum h THR 63 Cb 0.26 0.01 0.11 0.00 -1.74 0.00 0.00 68.15 66.79 2yum h THR 63 CO -0.01 0.00 -0.55 1.17 0.37 0.00 0.00 175.52 176.50 2yum n LYS 64 N -5.31 -6.14 -3.59 6.66 4.81 -1.19 -5.00 118.16 108.40 2yum n LYS 64 Ca 0.03 0.66 -0.07 0.00 -0.87 0.00 0.00 58.31 58.06 2yum n LYS 64 Cb 0.30 -5.18 -0.04 0.00 0.02 0.00 0.00 35.03 30.13 2yum n LYS 64 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2yum s ALA 65 N -3.26 -2.00 -1.47 3.14 0.00 -1.26 -4.99 121.76 111.92 2yum s ALA 65 Ca 0.38 1.61 -0.11 0.00 0.00 0.00 0.00 51.96 53.84 2yum s ALA 65 Cb -0.17 -0.66 0.06 0.00 0.00 0.00 0.00 23.12 22.35 2yum s ALA 65 CO 0.58 -0.40 1.03 0.41 0.00 0.00 0.00 175.76 177.38 2yum n GLY 66 N 0.37 -0.50 3.48 0.00 0.00 -1.26 -4.98 105.19 102.31 2yum n GLY 66 Ca -0.05 0.21 -0.33 0.00 0.00 0.00 0.00 46.02 45.85 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 -3.33 3.19 0.59 -0.61 1.01 -1.26 -5.12 121.20 115.68 2yum s ILE 67 Ca 0.59 -0.67 -0.18 0.00 0.00 0.00 0.00 60.65 60.40 2yum s ILE 67 Cb -0.29 -2.27 -0.03 0.00 0.01 0.00 0.00 42.46 39.88 2yum s ILE 67 CO 0.80 0.58 1.12 -2.16 0.00 0.00 0.00 174.94 175.28 2yum s PRO 68 N -0.60 3.13 -0.03 2.79 0.04 -1.26 -4.99 135.00 134.08 2yum s PRO 68 Ca 0.09 1.52 -0.00 0.00 0.04 0.00 0.00 61.00 62.64 2yum s PRO 68 Cb -0.11 -1.98 -0.02 0.00 0.04 0.00 0.00 34.50 32.42 2yum s PRO 68 CO 0.01 -1.01 -0.03 1.55 0.04 0.00 0.00 177.00 177.56 2yum n VAL 69 N -1.76 0.18 -5.15 -0.36 3.14 -1.26 -5.05 118.33 108.07 2yum n VAL 69 Ca 0.11 -0.06 -0.29 0.00 -2.96 0.00 0.00 64.34 61.14 2yum n VAL 69 Cb 0.51 -0.83 -0.16 0.00 -1.06 0.00 0.00 33.84 32.30 2yum n VAL 69 CO 0.00 0.00 0.00 -0.44 -6.46 0.00 0.00 176.83 169.93 2yum s SER 70 N -4.54 2.73 -0.44 6.55 0.01 -1.26 -5.09 113.70 111.65 2yum s SER 70 Ca -0.04 -0.42 0.05 0.00 1.31 0.00 0.00 55.95 56.85 2yum s SER 70 Cb 0.01 -0.35 0.18 0.00 0.21 0.00 0.00 66.02 66.07 2yum s SER 70 CO 0.07 0.28 0.52 -0.83 0.41 0.00 0.00 173.24 173.69 2yum s GLY 71 N -0.50 -0.24 0.12 3.44 0.00 -1.26 -5.00 107.32 103.87 2yum s GLY 71 Ca 0.08 -1.10 -0.13 0.00 0.00 0.00 0.00 44.72 43.56 2yum s GLY 71 CO -0.00 2.99 1.44 -0.56 0.00 0.00 0.00 173.10 176.97 2yum h PRO 72 N 5.84 0.80 -6.66 2.90 0.13 -2.07 -3.44 132.00 129.51 2yum h PRO 72 Ca 0.12 -0.42 -0.52 0.00 -0.87 0.00 0.00 66.00 64.31 2yum h PRO 72 Cb 1.04 0.01 0.06 0.00 0.13 0.00 0.00 31.00 32.25 2yum h PRO 72 CO 0.17 1.05 1.02 -1.12 -0.23 0.00 0.00 178.00 178.89 2yum s SER 73 N -6.66 6.37 -0.01 1.44 0.01 -1.26 -4.92 113.70 108.67 2yum s SER 73 Ca -0.12 2.88 -0.22 0.00 1.31 0.00 0.00 55.95 59.80 2yum s SER 73 Cb 0.10 -2.60 -0.22 0.00 0.21 0.00 0.00 66.02 63.51 2yum s SER 73 CO 0.85 -0.98 1.10 0.77 0.41 0.00 0.00 173.24 175.40 2yum h SER 74 N 6.81 0.39 0.00 2.44 4.64 -2.06 -3.55 113.55 122.23 2yum h SER 74 Ca -0.43 -0.73 0.00 0.00 -0.47 0.00 0.00 61.79 60.16 2yum h SER 74 Cb 1.20 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 63.17 2yum h SER 74 CO 0.96 1.07 0.00 0.61 -0.87 0.00 0.00 176.83 178.60