#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x4o s SER 2 N 0.00 2.20 0.00 1.61 0.15 -1.26 -5.07 113.70 111.33 1x4o s SER 2 Ca 0.00 -1.24 0.00 0.00 0.70 0.00 0.00 55.95 55.41 1x4o s SER 2 Cb 0.00 0.19 0.00 0.00 -1.71 0.00 0.00 66.02 64.50 1x4o s SER 2 CO 0.00 -0.37 0.00 -0.24 1.20 0.00 0.00 173.24 173.83 1x4o n SER 3 N 4.91 0.00 -3.56 5.45 2.88 -1.26 -5.12 113.62 116.93 1x4o n SER 3 Ca 0.02 0.00 -0.29 0.00 -1.33 0.00 0.00 58.87 57.26 1x4o n SER 3 Cb 0.44 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.77 1x4o n SER 3 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1x4o s GLY 4 N 0.00 1.14 -0.54 0.46 0.00 -1.26 -5.08 107.32 102.05 1x4o s GLY 4 Ca 0.00 -2.11 -0.15 0.00 0.00 0.00 0.00 44.72 42.46 1x4o s GLY 4 CO 0.00 1.89 0.49 -0.56 0.00 0.00 0.00 173.10 174.92 1x4o s SER 5 N 0.83 6.16 -0.25 1.64 0.01 -1.26 -5.04 113.70 115.79 1x4o s SER 5 Ca 0.18 -1.84 -0.14 0.00 1.31 0.00 0.00 55.95 55.45 1x4o s SER 5 Cb -0.23 -2.19 -0.04 0.00 0.21 0.00 0.00 66.02 63.77 1x4o s SER 5 CO 0.00 -0.83 0.35 -0.55 0.41 0.00 0.00 173.24 172.62 1x4o s SER 6 N 3.44 6.27 0.18 2.44 0.15 -1.26 -4.93 113.70 119.99 1x4o s SER 6 Ca 0.04 0.31 0.00 0.00 0.70 0.00 0.00 55.95 57.00 1x4o s SER 6 Cb -0.29 -2.20 0.00 0.00 -1.71 0.00 0.00 66.02 61.82 1x4o s SER 6 CO 0.02 -0.12 0.00 0.61 1.20 0.00 0.00 173.24 174.95 1x4o n GLY 7 N 4.48 -2.73 3.89 9.45 0.00 -1.26 -4.94 105.19 114.08 1x4o n GLY 7 Ca -0.09 -1.34 -0.32 0.00 0.00 0.00 0.00 46.02 44.27 1x4o n GLY 7 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1x4o s LYS 8 N -3.22 3.70 -0.04 1.61 2.47 -1.26 -5.09 119.74 117.91 1x4o s LYS 8 Ca 0.00 0.08 0.06 0.00 -1.56 0.00 0.00 55.97 54.55 1x4o s LYS 8 Cb 0.00 -2.77 -0.01 0.00 -1.46 0.00 0.00 37.83 33.59 1x4o s LYS 8 CO 0.00 0.41 -0.22 0.08 0.16 0.00 0.00 175.35 175.77 1x4o s VAL 9 N -1.71 1.82 0.34 4.02 1.01 -1.26 -5.14 120.40 119.47 1x4o s VAL 9 Ca 0.43 -0.95 0.09 0.00 0.00 0.00 0.00 61.98 61.55 1x4o s VAL 9 Cb -0.12 -1.53 -0.05 0.00 0.00 0.00 0.00 36.38 34.68 1x4o s VAL 9 CO 0.23 0.51 0.03 -0.94 0.00 0.00 0.00 175.10 174.93 1x4o s SER 10 N -0.22 4.26 0.76 3.32 1.04 -1.26 -5.10 113.70 116.50 1x4o s SER 10 Ca 0.00 -0.94 -0.11 0.00 0.48 0.00 0.00 55.95 55.38 1x4o s SER 10 Cb -0.12 -0.57 0.04 0.00 0.10 0.00 0.00 66.02 65.47 1x4o s SER 10 CO 0.02 -0.23 1.08 -2.16 0.98 0.00 0.00 173.24 172.93 1x4o s PRO 11 N -3.73 2.44 1.11 4.02 0.04 -1.26 -4.73 135.00 132.88 1x4o s PRO 11 Ca 0.35 0.77 -0.19 0.00 0.04 0.00 0.00 61.00 61.97 1x4o s PRO 11 Cb -0.01 -1.95 0.27 0.00 0.04 0.00 0.00 34.50 32.85 1x4o s PRO 11 CO 0.20 -1.40 1.22 -0.35 0.04 0.00 0.00 177.00 176.70 1x4o n PRO 12 N -3.31 -2.22 -0.13 0.56 -0.04 -1.26 -4.94 135.00 123.66 1x4o n PRO 12 Ca 0.07 -1.91 -0.20 0.00 -0.04 0.00 0.00 63.50 61.43 1x4o n PRO 12 Cb 0.55 -1.51 -0.12 0.00 -0.04 0.00 0.00 33.50 32.39 1x4o n PRO 12 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1x4o n GLU 13 N -4.34 0.64 -2.02 0.54 1.02 -1.26 -4.86 120.64 110.36 1x4o n GLU 13 Ca 0.16 0.16 -0.41 0.00 -0.02 0.00 0.00 57.16 57.05 1x4o n GLU 13 Cb 0.59 -1.51 -0.03 0.00 -0.02 0.00 0.00 31.44 30.47 1x4o n GLU 13 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1x4o s ASP 14 N -6.64 5.68 0.18 1.62 1.11 -1.26 -4.85 116.67 112.51 1x4o s ASP 14 Ca -0.35 0.96 -0.13 0.00 0.18 0.00 0.00 52.55 53.20 1x4o s ASP 14 Cb 0.10 -2.53 0.17 0.00 1.07 0.00 0.00 42.92 41.73 1x4o s ASP 14 CO 0.58 -1.94 1.73 -0.08 1.18 0.00 0.00 175.17 176.64 1x4o h GLU 15 N 13.59 0.26 -0.95 8.23 4.81 -2.00 0.17 114.58 138.69 1x4o h GLU 15 Ca -0.30 -0.02 0.27 0.00 -0.13 0.00 0.00 59.36 59.18 1x4o h GLU 15 Cb 1.17 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 30.45 1x4o h GLU 15 CO 1.10 0.17 0.76 0.93 -0.73 0.00 0.00 179.01 181.24 1x4o h GLU 16 N 0.27 0.00 0.06 1.92 5.08 -2.00 0.41 114.58 120.32 1x4o h GLU 16 Ca 0.23 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.59 1x4o h GLU 16 Cb 0.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1x4o h GLU 16 CO -0.28 0.00 -0.03 0.00 -1.00 0.00 0.00 179.01 177.70 1x4o h ALA 17 N 1.37 -0.08 -1.96 3.43 0.00 -1.08 -0.47 119.26 120.46 1x4o h ALA 17 Ca 0.45 -0.21 0.57 0.00 0.00 0.00 0.00 54.91 55.72 1x4o h ALA 17 Cb 1.97 0.03 -0.08 0.00 0.00 0.00 0.00 17.79 19.71 1x4o h ALA 17 CO -0.00 -0.10 1.41 -0.22 0.00 0.00 0.00 179.25 180.34 1x4o h LYS 18 N -0.98 0.00 0.00 0.00 3.64 -0.28 1.32 116.57 120.28 1x4o h LYS 18 Ca -0.01 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.25 1x4o h LYS 18 Cb 0.44 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.24 1x4o h LYS 18 CO 0.01 0.00 -0.82 -0.97 -2.27 0.00 0.00 179.45 175.40 1x4o h ASN 19 N 0.00 0.00 0.11 4.20 -0.73 -1.40 -3.25 115.58 114.51 1x4o h ASN 19 Ca 0.93 -0.38 0.02 0.00 1.87 0.00 0.00 56.30 58.74 1x4o h ASN 19 Cb 3.75 0.00 -0.05 0.00 0.27 0.00 0.00 38.32 42.29 1x4o h ASN 19 CO -0.01 1.16 -0.43 -0.07 -0.37 0.00 0.00 177.43 177.71 1x4o h LEU 20 N -1.00 -1.27 -0.24 0.34 3.38 0.20 0.31 115.31 117.03 1x4o h LEU 20 Ca -0.19 0.14 0.02 0.00 0.09 0.00 0.00 57.88 57.95 1x4o h LEU 20 Cb 0.96 0.48 -0.04 0.00 0.09 0.00 0.00 40.66 42.15 1x4o h LEU 20 CO -0.11 -0.49 -0.22 0.00 0.09 0.00 0.00 178.44 177.70 1x4o h ALA 21 N -0.20 -0.38 -0.14 1.53 0.00 0.12 1.19 119.26 121.37 1x4o h ALA 21 Ca 0.02 0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.97 1x4o h ALA 21 Cb 0.69 0.97 -0.04 0.00 0.00 0.00 0.00 17.79 19.41 1x4o h ALA 21 CO -0.25 -0.50 -0.28 1.49 0.00 0.00 0.00 179.25 179.71 1x4o h GLU 22 N -0.09 -0.24 -0.32 0.00 4.81 -1.53 0.28 114.58 117.50 1x4o h GLU 22 Ca 0.04 0.02 0.03 0.00 -0.13 0.00 0.00 59.36 59.32 1x4o h GLU 22 Cb 0.20 0.05 -0.05 0.00 0.63 0.00 0.00 28.75 29.58 1x4o h GLU 22 CO -0.28 -0.16 -0.29 0.87 -0.73 0.00 0.00 179.01 178.42 1x4o h LYS 23 N -0.25 -0.13 -0.98 1.92 1.57 0.20 1.52 116.57 120.43 1x4o h LYS 23 Ca 0.03 0.01 0.15 0.00 -1.87 0.00 0.00 60.65 58.97 1x4o h LYS 23 Cb 0.32 0.03 -0.16 0.00 0.08 0.00 0.00 32.23 32.50 1x4o h LYS 23 CO -0.27 -0.08 -0.40 1.25 -0.57 0.00 0.00 179.45 179.38 1x4o h LEU 24 N -0.13 -1.46 0.84 2.94 7.12 0.19 1.19 115.31 126.00 1x4o h LEU 24 Ca 0.05 0.31 -0.04 0.00 0.13 0.00 0.00 57.88 58.34 1x4o h LEU 24 Cb 0.27 0.76 0.00 0.00 -0.53 0.00 0.00 40.66 41.16 1x4o h LEU 24 CO -0.37 -0.29 -0.47 0.00 -0.13 0.00 0.00 178.44 177.18 1x4o h ALA 25 N 1.33 -1.24 -1.15 1.25 0.00 0.20 0.70 119.26 120.36 1x4o h ALA 25 Ca 0.34 -0.26 0.33 0.00 0.00 0.00 0.00 54.91 55.32 1x4o h ALA 25 Cb 0.59 0.55 -0.10 0.00 0.00 0.00 0.00 17.79 18.83 1x4o h ALA 25 CO -0.98 -1.21 0.75 0.00 0.00 0.00 0.00 179.25 177.81 1x4o h ARG 26 N -1.21 0.25 0.14 0.00 2.47 0.47 1.51 114.38 118.00 1x4o h ARG 26 Ca -0.11 -0.01 -0.01 0.00 -1.26 0.00 0.00 59.98 58.59 1x4o h ARG 26 Cb 0.95 -0.06 0.00 0.00 -1.65 0.00 0.00 29.97 29.22 1x4o h ARG 26 CO 0.14 0.16 -0.07 0.35 0.56 0.00 0.00 179.97 181.12 1x4o h PHE 27 N 0.25 -0.17 -0.94 3.04 3.57 0.21 -2.77 116.94 120.13 1x4o h PHE 27 Ca 0.66 -0.00 0.20 0.00 3.53 0.00 0.00 57.97 62.36 1x4o h PHE 27 Cb 1.93 0.06 -0.08 0.00 2.79 0.00 0.00 35.95 40.65 1x4o h PHE 27 CO -0.00 -0.11 0.61 0.82 -2.23 0.00 0.00 178.31 177.40 1x4o h ILE 28 N -0.69 0.68 0.00 1.41 2.04 0.12 1.45 117.51 122.52 1x4o h ILE 28 Ca -0.02 -0.17 -0.03 0.00 1.00 0.00 0.00 64.86 65.64 1x4o h ILE 28 Cb 0.14 0.14 -0.00 0.00 -0.74 0.00 0.00 36.82 36.35 1x4o h ILE 28 CO 0.03 0.09 -0.15 0.00 0.00 0.00 0.00 178.15 178.12 1x4o h ALA 29 N 1.61 1.28 0.00 1.87 0.00 0.20 0.67 119.26 124.89 1x4o h ALA 29 Ca 0.51 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.28 1x4o h ALA 29 Cb 1.13 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1x4o h ALA 29 CO -0.23 0.18 0.00 -3.47 0.00 0.00 0.00 179.25 175.73 1x4o n ASP 30 N -3.67 0.26 0.00 0.00 2.03 0.49 -4.74 116.55 110.93 1x4o n ASP 30 Ca -0.02 0.53 0.00 0.00 0.52 0.00 0.00 54.79 55.82 1x4o n ASP 30 Cb 0.27 -0.60 0.00 0.00 -0.72 0.00 0.00 41.12 40.07 1x4o n ASP 30 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1x4o n GLY 31 N 1.38 1.08 0.00 0.27 0.00 0.22 -5.09 105.19 103.05 1x4o n GLY 31 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1x4o n GLY 31 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x4o n GLY 32 N 5.00 0.84 0.00 -0.02 0.00 -1.16 -4.95 105.19 104.91 1x4o n GLY 32 Ca 0.00 0.15 0.12 0.00 0.00 0.00 0.00 46.02 46.28 1x4o n GLY 32 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1x4o n PRO 33 N 0.00 0.59 -0.11 1.61 -0.04 -1.26 -2.30 135.00 133.49 1x4o n PRO 33 Ca 0.00 0.03 -0.24 0.00 -0.04 0.00 0.00 63.50 63.24 1x4o n PRO 33 Cb 0.00 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 31.85 1x4o n PRO 33 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 1x4o n GLU 34 N -1.10 0.62 -0.21 0.54 2.13 -1.26 -3.96 120.64 117.39 1x4o n GLU 34 Ca 0.15 0.35 -0.08 0.00 0.66 0.00 0.00 57.16 58.24 1x4o n GLU 34 Cb 0.12 -1.61 0.03 0.00 0.27 0.00 0.00 31.44 30.24 1x4o n GLU 34 CO 0.00 0.00 0.00 -0.24 -0.41 0.00 0.00 177.13 176.48 1x4o h VAL 35 N -0.69 1.25 0.00 6.31 3.04 -1.88 -0.74 116.25 123.54 1x4o h VAL 35 Ca -0.53 -0.94 0.00 0.00 -1.01 0.00 0.00 66.70 64.22 1x4o h VAL 35 Cb 1.62 0.71 0.00 0.00 -2.01 0.00 0.00 31.29 31.60 1x4o h VAL 35 CO -0.23 0.35 0.00 -1.84 -1.01 0.00 0.00 177.57 174.84 1x4o n GLU 36 N -4.33 0.13 -0.10 4.17 0.28 -0.97 0.19 120.64 120.01 1x4o n GLU 36 Ca 0.03 0.57 -0.17 0.00 -0.16 0.00 0.00 57.16 57.43 1x4o n GLU 36 Cb 0.25 -1.88 -0.07 0.00 1.43 0.00 0.00 31.44 31.17 1x4o n GLU 36 CO 0.00 0.00 0.00 2.41 -0.16 0.00 0.00 177.13 179.38 1x4o n THR 37 N -2.15 1.49 -0.04 3.84 -1.04 -0.45 -3.34 114.28 112.59 1x4o n THR 37 Ca -0.00 0.00 -0.14 0.00 -2.04 0.00 0.00 64.05 61.87 1x4o n THR 37 Cb 0.07 -2.16 -0.08 0.00 -1.82 0.00 0.00 70.33 66.35 1x4o n THR 37 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 1x4o h ILE 38 N -1.00 1.38 -0.82 12.58 5.03 -0.88 0.52 117.51 134.33 1x4o h ILE 38 Ca -0.27 -1.45 0.07 0.00 -0.12 0.00 0.00 64.86 63.09 1x4o h ILE 38 Cb 1.08 2.08 -0.06 0.00 -3.03 0.00 0.00 36.82 36.89 1x4o h ILE 38 CO -0.16 0.42 0.49 0.00 -0.68 0.00 0.00 178.15 178.22 1x4o h ALA 39 N 0.53 1.14 -0.14 1.87 0.00 0.19 0.63 119.26 123.49 1x4o h ALA 39 Ca 0.01 0.01 -0.23 0.00 0.00 0.00 0.00 54.91 54.69 1x4o h ALA 39 Cb 0.76 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 18.37 1x4o h ALA 39 CO 0.04 0.19 -0.81 -0.07 0.00 0.00 0.00 179.25 178.61 1x4o h LEU 40 N 0.88 0.95 -1.65 0.00 3.38 -1.54 0.14 115.31 117.46 1x4o h LEU 40 Ca 0.37 -0.63 -0.03 0.00 0.09 0.00 0.00 57.88 57.68 1x4o h LEU 40 Cb 0.23 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1x4o h LEU 40 CO -0.19 1.43 -0.06 1.56 0.09 0.00 0.00 178.44 181.27 1x4o h GLN 41 N 0.53 0.15 0.01 1.13 1.08 0.12 0.55 115.11 118.67 1x4o h GLN 41 Ca -0.06 -0.02 -0.26 0.00 -1.45 0.00 0.00 58.65 56.85 1x4o h GLN 41 Cb 1.44 -0.03 -0.04 0.00 -0.05 0.00 0.00 27.48 28.80 1x4o h GLN 41 CO 0.17 0.22 -1.44 -0.91 -0.95 0.00 0.00 178.83 175.91 1x4o h ASN 42 N 0.14 0.04 0.30 1.46 2.35 0.35 -3.23 115.58 117.00 1x4o h ASN 42 Ca 0.03 -0.06 0.00 0.00 -0.55 0.00 0.00 56.30 55.72 1x4o h ASN 42 Cb 0.20 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 38.56 1x4o h ASN 42 CO 0.01 1.06 -0.06 0.59 -1.65 0.00 0.00 177.43 177.37 1x4o n ASN 43 N -3.20 0.39 0.39 5.81 3.02 0.48 -3.67 115.26 118.48 1x4o n ASN 43 Ca -0.11 -0.65 -0.19 0.00 -0.03 0.00 0.00 54.58 53.60 1x4o n ASN 43 Cb 1.01 -0.09 -0.10 0.00 -0.61 0.00 0.00 39.78 39.99 1x4o n ASN 43 CO 0.00 0.00 0.00 -0.09 -2.62 0.00 0.00 177.26 174.55 1x4o h ARG 44 N 0.51 -1.11 -0.04 3.52 1.12 0.05 -3.23 114.38 115.19 1x4o h ARG 44 Ca 0.00 0.08 -0.06 0.00 -1.11 0.00 0.00 59.98 58.89 1x4o h ARG 44 Cb 0.29 0.25 0.00 0.00 -0.01 0.00 0.00 29.97 30.51 1x4o h ARG 44 CO 0.00 -0.74 -0.20 1.05 -3.11 0.00 0.00 179.97 176.96 1x4o h GLU 45 N -1.16 0.21 -6.28 0.20 4.11 -1.78 -3.45 114.58 106.43 1x4o h GLU 45 Ca -0.09 -0.17 -0.67 0.00 0.07 0.00 0.00 59.36 58.50 1x4o h GLU 45 Cb 0.95 0.04 0.07 0.00 0.50 0.00 0.00 28.75 30.30 1x4o h GLU 45 CO 0.05 0.83 0.29 0.09 0.07 0.00 0.00 179.01 180.34 1x4o n ASN 46 N -4.55 1.28 0.00 3.06 3.02 -1.22 -4.87 115.26 111.98 1x4o n ASN 46 Ca -0.09 1.14 -0.16 0.00 -0.03 0.00 0.00 54.58 55.44 1x4o n ASN 46 Cb 0.44 -1.18 -0.14 0.00 -0.61 0.00 0.00 39.78 38.29 1x4o n ASN 46 CO 0.00 0.00 0.00 -0.61 -2.62 0.00 0.00 177.26 174.03 1x4o h GLN 47 N 3.67 0.16 -0.87 3.52 4.15 -1.87 -3.38 115.11 120.49 1x4o h GLN 47 Ca -0.45 -0.28 0.08 0.00 0.77 0.00 0.00 58.65 58.78 1x4o h GLN 47 Cb 1.35 0.10 -0.11 0.00 0.21 0.00 0.00 27.48 29.03 1x4o h GLN 47 CO 0.72 0.92 -0.57 0.00 -1.93 0.00 0.00 178.83 177.97 1x4o h ALA 48 N 0.50 -0.58 0.00 3.38 0.00 -1.93 -0.65 119.26 119.98 1x4o h ALA 48 Ca -0.34 0.09 -0.51 0.00 0.00 0.00 0.00 54.91 54.16 1x4o h ALA 48 Cb 2.02 1.32 0.02 0.00 0.00 0.00 0.00 17.79 21.16 1x4o h ALA 48 CO 0.10 -0.96 3.14 1.19 0.00 0.00 0.00 179.25 182.71 1x4o n PHE 49 N -5.22 1.84 0.02 0.00 3.72 -1.26 -4.18 117.46 112.38 1x4o n PHE 49 Ca 0.01 -2.45 0.07 0.00 -0.05 0.00 0.00 57.45 55.03 1x4o n PHE 49 Cb 0.27 -2.03 -0.11 0.00 -0.94 0.00 0.00 39.48 36.67 1x4o n PHE 49 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1x4o n SER 50 N 4.03 0.38 0.07 4.37 3.41 -0.25 -4.00 113.62 121.63 1x4o n SER 50 Ca 0.59 0.15 0.07 0.00 -0.26 0.00 0.00 58.87 59.42 1x4o n SER 50 Cb 0.18 1.16 0.33 0.00 -0.26 0.00 0.00 64.21 65.61 1x4o n SER 50 CO 0.00 0.00 0.00 2.22 -0.16 0.00 0.00 175.04 177.10 1x4o n PHE 51 N -2.53 0.38 0.11 7.33 1.16 -1.26 -0.54 117.46 122.10 1x4o n PHE 51 Ca -0.07 0.18 0.03 0.00 -1.87 0.00 0.00 57.45 55.71 1x4o n PHE 51 Cb 0.67 -0.79 0.00 0.00 -1.61 0.00 0.00 39.48 37.76 1x4o n PHE 51 CO 0.00 0.00 0.00 -0.07 -1.87 0.00 0.00 176.76 174.82 1x4o h LEU 52 N 0.00 0.00 -4.66 5.98 3.38 -1.92 -2.87 115.31 115.21 1x4o h LEU 52 Ca 0.00 0.00 -0.66 0.00 0.09 0.00 0.00 57.88 57.31 1x4o h LEU 52 Cb 0.11 0.00 -0.36 0.00 0.09 0.00 0.00 40.66 40.50 1x4o h LEU 52 CO 0.00 0.48 0.01 -1.22 0.09 0.00 0.00 178.44 177.80 1x4o n TYR 53 N -3.11 3.22 -3.15 1.13 4.01 0.29 -4.85 117.16 114.70 1x4o n TYR 53 Ca -0.01 -2.77 0.05 0.00 -0.16 0.00 0.00 57.90 55.01 1x4o n TYR 53 Cb 0.74 -0.56 -0.00 0.00 -0.31 0.00 0.00 39.34 39.22 1x4o n TYR 53 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 1x4o s ASP 54 N -2.54 -0.63 0.09 7.72 2.15 -1.22 -5.04 116.67 117.19 1x4o s ASP 54 Ca 0.50 0.09 -0.13 0.00 0.43 0.00 0.00 52.55 53.44 1x4o s ASP 54 Cb 0.42 1.41 -0.20 0.00 -0.30 0.00 0.00 42.92 44.24 1x4o s ASP 54 CO -0.27 -0.11 1.23 1.55 -0.17 0.00 0.00 175.17 177.40 1x4o h PRO 55 N 7.44 0.73 -1.01 4.34 0.13 -1.89 -3.19 132.00 138.56 1x4o h PRO 55 Ca -0.08 -0.72 0.29 0.00 -0.87 0.00 0.00 66.00 64.61 1x4o h PRO 55 Cb 1.18 0.19 -0.14 0.00 0.13 0.00 0.00 31.00 32.36 1x4o h PRO 55 CO -0.05 1.30 0.59 -0.91 -0.23 0.00 0.00 178.00 178.70 1x4o h ASN 56 N 0.45 0.59 -4.10 1.44 2.35 -1.97 -3.41 115.58 110.93 1x4o h ASN 56 Ca -0.10 0.16 -0.49 0.00 -0.55 0.00 0.00 56.30 55.32 1x4o h ASN 56 Cb 1.60 0.09 0.15 0.00 0.05 0.00 0.00 38.32 40.21 1x4o h ASN 56 CO 0.19 -0.02 0.25 -0.55 -1.65 0.00 0.00 177.43 175.65 1x4o s SER 57 N -5.04 3.49 0.01 5.81 0.15 -1.21 -4.97 113.70 111.94 1x4o s SER 57 Ca -0.10 1.66 0.02 0.00 0.70 0.00 0.00 55.95 58.23 1x4o s SER 57 Cb 0.29 -2.32 -0.25 0.00 -1.71 0.00 0.00 66.02 62.03 1x4o s SER 57 CO 0.79 -2.66 0.86 1.56 1.20 0.00 0.00 173.24 175.00 1x4o h GLN 58 N -1.56 0.15 -0.61 5.44 7.50 -1.86 -3.36 115.11 120.81 1x4o h GLN 58 Ca -0.48 -0.26 0.11 0.00 0.50 0.00 0.00 58.65 58.52 1x4o h GLN 58 Cb 1.27 0.10 -0.12 0.00 0.05 0.00 0.00 27.48 28.78 1x4o h GLN 58 CO 0.52 0.96 -0.34 0.78 -1.50 0.00 0.00 178.83 179.25 1x4o h GLY 59 N 2.28 -0.12 0.05 3.46 0.00 -1.88 0.47 103.07 107.33 1x4o h GLY 59 Ca -0.22 0.45 0.06 0.00 0.00 0.00 0.00 47.33 47.61 1x4o h GLY 59 CO 0.13 -0.20 -0.33 -1.82 0.00 0.00 0.00 176.54 174.32 1x4o h TYR 60 N -0.16 -0.92 0.60 5.60 5.03 -1.65 0.54 116.97 126.01 1x4o h TYR 60 Ca 0.23 0.04 -0.03 0.00 2.58 0.00 0.00 58.73 61.56 1x4o h TYR 60 Cb 0.55 0.44 -0.00 0.00 1.55 0.00 0.00 36.73 39.27 1x4o h TYR 60 CO -0.65 -0.40 -0.38 0.00 -1.32 0.00 0.00 178.16 175.41 1x4o h ARG 61 N -0.37 -0.88 -1.10 1.82 3.08 -1.32 0.62 114.38 116.23 1x4o h ARG 61 Ca 0.11 0.06 0.32 0.00 0.07 0.00 0.00 59.98 60.54 1x4o h ARG 61 Cb 0.55 0.20 -0.04 0.00 0.08 0.00 0.00 29.97 30.76 1x4o h ARG 61 CO -0.41 -0.59 0.81 -0.92 -1.07 0.00 0.00 179.97 177.79 1x4o h TYR 62 N -0.92 0.00 0.09 3.04 5.03 0.10 0.21 116.97 124.52 1x4o h TYR 62 Ca -0.08 0.00 -0.14 0.00 2.58 0.00 0.00 58.73 61.09 1x4o h TYR 62 Cb 0.74 0.00 0.02 0.00 1.55 0.00 0.00 36.73 39.03 1x4o h TYR 62 CO -0.06 0.00 -0.59 -0.92 -1.32 0.00 0.00 178.16 175.27 1x4o h TYR 63 N 0.00 0.43 -0.39 -3.82 5.03 0.87 -3.20 116.97 115.88 1x4o h TYR 63 Ca 0.52 -0.30 0.07 0.00 2.58 0.00 0.00 58.73 61.61 1x4o h TYR 63 Cb 2.14 -0.02 -0.06 0.00 1.55 0.00 0.00 36.73 40.33 1x4o h TYR 63 CO 0.00 1.21 0.01 0.00 -1.32 0.00 0.00 178.16 178.06 1x4o h ARG 64 N -0.47 0.11 0.08 1.82 2.47 0.33 -1.43 114.38 117.29 1x4o h ARG 64 Ca -0.10 -0.01 0.02 0.00 -1.26 0.00 0.00 59.98 58.63 1x4o h ARG 64 Cb 1.44 -0.03 -0.05 0.00 -1.65 0.00 0.00 29.97 29.68 1x4o h ARG 64 CO 0.11 0.08 -0.51 0.37 0.56 0.00 0.00 179.97 180.58 1x4o h GLN 65 N 0.12 -0.68 -0.89 0.04 4.15 -1.29 0.03 115.11 116.59 1x4o h GLN 65 Ca 0.19 0.05 0.23 0.00 0.77 0.00 0.00 58.65 59.89 1x4o h GLN 65 Cb 0.27 0.15 -0.13 0.00 0.21 0.00 0.00 27.48 27.98 1x4o h GLN 65 CO -0.31 -0.45 0.35 0.87 -1.93 0.00 0.00 178.83 177.35 1x4o h LYS 66 N -0.70 0.32 -0.69 1.69 1.79 -1.45 1.64 116.57 119.17 1x4o h LYS 66 Ca 0.01 -0.02 0.06 0.00 -2.18 0.00 0.00 60.65 58.52 1x4o h LYS 66 Cb 0.73 -0.07 -0.06 0.00 -1.58 0.00 0.00 32.23 31.25 1x4o h LYS 66 CO -0.31 0.21 0.39 1.25 -1.08 0.00 0.00 179.45 179.91 1x4o h LEU 67 N 0.33 0.58 -0.12 2.94 5.85 0.02 0.28 115.31 125.20 1x4o h LEU 67 Ca 0.57 0.03 -0.23 0.00 0.84 0.00 0.00 57.88 59.08 1x4o h LEU 67 Cb 1.11 -0.09 0.01 0.00 0.37 0.00 0.00 40.66 42.07 1x4o h LEU 67 CO -0.57 0.37 -0.84 -0.78 -0.34 0.00 0.00 178.44 176.28 1x4o h ASP 68 N 0.72 0.94 0.32 1.25 3.58 0.22 -0.78 116.42 122.66 1x4o h ASP 68 Ca 0.31 -0.66 0.00 0.00 0.42 0.00 0.00 57.03 57.11 1x4o h ASP 68 Cb 0.19 -0.28 -0.03 0.00 1.72 0.00 0.00 39.33 40.93 1x4o h ASP 68 CO -0.18 1.45 -0.42 -0.08 -2.88 0.00 0.00 179.24 177.13 1x4o h GLU 69 N 0.50 -0.76 0.60 0.28 4.57 0.29 -0.15 114.58 119.90 1x4o h GLU 69 Ca -0.07 0.05 -0.03 0.00 -1.18 0.00 0.00 59.36 58.13 1x4o h GLU 69 Cb 1.47 0.17 0.01 0.00 -0.16 0.00 0.00 28.75 30.24 1x4o h GLU 69 CO 0.17 -0.51 -0.29 0.74 -1.18 0.00 0.00 179.01 177.95 1x4o h PHE 70 N -0.79 -0.74 -0.95 0.92 0.04 -0.55 -3.22 116.94 111.64 1x4o h PHE 70 Ca -0.02 -0.02 0.10 0.00 2.80 0.00 0.00 57.97 60.83 1x4o h PHE 70 Cb 0.73 0.25 -0.12 0.00 2.20 0.00 0.00 35.95 39.00 1x4o h PHE 70 CO -0.27 -0.41 -0.52 0.54 -0.60 0.00 0.00 178.31 177.05 1x4o n ARG 71 N -5.36 -0.37 -1.59 1.51 1.74 -0.30 -1.04 116.66 111.24 1x4o n ARG 71 Ca -0.12 1.45 -0.41 0.00 -0.77 0.00 0.00 57.85 58.00 1x4o n ARG 71 Cb 0.35 -2.13 -0.01 0.00 -1.02 0.00 0.00 32.46 29.64 1x4o n ARG 71 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1x4o n LYS 72 N -5.24 3.22 -1.59 5.56 4.01 -0.08 -4.94 118.16 119.09 1x4o n LYS 72 Ca 0.04 -2.49 -0.33 0.00 -0.51 0.00 0.00 58.31 55.02 1x4o n LYS 72 Cb 0.28 -3.09 0.07 0.00 -0.51 0.00 0.00 35.03 31.78 1x4o n LYS 72 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 1x4o s SER 73 N 2.71 4.73 0.25 4.39 0.15 -0.21 -4.88 113.70 120.84 1x4o s SER 73 Ca 0.55 2.09 0.02 0.00 0.70 0.00 0.00 55.95 59.32 1x4o s SER 73 Cb 0.15 -2.56 -0.05 0.00 -1.71 0.00 0.00 66.02 61.85 1x4o s SER 73 CO -0.08 -1.89 0.05 -0.83 1.20 0.00 0.00 173.24 171.69 1x4o s GLY 74 N -2.49 1.65 -0.89 9.45 0.00 -1.26 -5.03 107.32 108.74 1x4o s GLY 74 Ca 0.68 -1.82 -0.07 0.00 0.00 0.00 0.00 44.72 43.52 1x4o s GLY 74 CO 0.44 -1.63 2.58 -1.55 0.00 0.00 0.00 173.10 172.94 1x4o n PRO 75 N -0.44 2.44 -3.65 2.90 -0.04 -1.26 -4.65 135.00 130.29 1x4o n PRO 75 Ca -0.03 -1.50 -0.01 0.00 -0.04 0.00 0.00 63.50 61.93 1x4o n PRO 75 Cb 0.65 -2.40 -0.07 0.00 -0.04 0.00 0.00 33.50 31.64 1x4o n PRO 75 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1x4o s SER 76 N 2.71 -0.09 0.97 3.54 0.15 -1.26 -5.16 113.70 114.55 1x4o s SER 76 Ca 0.52 0.16 -0.13 0.00 0.70 0.00 0.00 55.95 57.19 1x4o s SER 76 Cb 0.16 0.57 0.03 0.00 -1.71 0.00 0.00 66.02 65.08 1x4o s SER 76 CO -0.03 -0.03 0.32 -0.24 1.20 0.00 0.00 173.24 174.46 1x4o n SER 77 N 2.34 -2.27 0.00 5.45 2.88 -1.26 -5.13 113.62 115.64 1x4o n SER 77 Ca -0.14 0.28 0.00 0.00 -1.33 0.00 0.00 58.87 57.69 1x4o n SER 77 Cb 0.57 -1.17 0.00 0.00 -0.75 0.00 0.00 64.21 62.86 1x4o n SER 77 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42