#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l0h s THR 2 N 0.00 2.24 0.15 2.46 -4.23 -1.26 -5.02 115.64 109.98 1l0h s THR 2 Ca 0.00 -1.54 -0.12 0.00 -1.18 0.00 0.00 61.69 58.85 1l0h s THR 2 Cb 0.00 -2.78 0.02 0.00 1.34 0.00 0.00 72.50 71.07 1l0h s THR 2 CO 0.00 0.00 1.58 0.40 -0.54 0.00 0.00 174.62 176.06 1l0h h ILE 3 N 1.14 1.27 -0.49 2.99 2.04 -2.01 -1.32 117.51 121.13 1l0h h ILE 3 Ca -0.41 -1.16 0.05 0.00 1.00 0.00 0.00 64.86 64.33 1l0h h ILE 3 Cb 1.27 1.02 -0.05 0.00 -0.74 0.00 0.00 36.82 38.32 1l0h h ILE 3 CO 0.63 0.41 0.23 -0.33 0.00 0.00 0.00 178.15 179.09 1l0h h GLU 4 N 0.77 0.44 -0.41 2.37 3.07 -1.95 0.31 114.58 119.17 1l0h h GLU 4 Ca 0.13 -0.03 -0.13 0.00 -0.50 0.00 0.00 59.36 58.84 1l0h h GLU 4 Cb 0.59 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.39 1l0h h GLU 4 CO 0.04 0.29 -0.26 1.49 -1.40 0.00 0.00 179.01 179.17 1l0h h GLU 5 N 0.45 0.86 -0.60 2.33 4.81 -1.92 -1.60 114.58 118.92 1l0h h GLU 5 Ca 0.22 -0.38 -0.01 0.00 -0.13 0.00 0.00 59.36 59.06 1l0h h GLU 5 Cb 0.15 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.48 1l0h h GLU 5 CO -0.17 1.02 0.34 0.00 -0.73 0.00 0.00 179.01 179.47 1l0h h ARG 6 N 0.74 0.82 -0.05 1.92 3.08 -0.47 -0.64 114.38 119.78 1l0h h ARG 6 Ca 0.09 -0.09 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 1l0h h ARG 6 Cb 0.80 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 30.69 1l0h h ARG 6 CO 0.07 0.62 0.02 0.28 -1.07 0.00 0.00 179.97 179.88 1l0h h VAL 7 N 0.81 1.13 -0.67 2.04 2.07 -0.27 -2.21 116.25 119.15 1l0h h VAL 7 Ca 0.21 -0.40 -0.02 0.00 0.82 0.00 0.00 66.70 67.31 1l0h h VAL 7 Cb 0.02 1.30 -0.03 0.00 -1.52 0.00 0.00 31.29 31.06 1l0h h VAL 7 CO -0.04 0.11 0.32 0.11 0.02 0.00 0.00 177.57 178.10 1l0h h LYS 8 N -0.07 0.96 -0.63 1.57 1.57 -1.09 -1.10 116.57 117.78 1l0h h LYS 8 Ca 0.02 -0.13 -0.03 0.00 -1.87 0.00 0.00 60.65 58.64 1l0h h LYS 8 Cb 0.16 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.26 1l0h h LYS 8 CO -0.00 0.74 0.26 -0.22 -0.57 0.00 0.00 179.45 179.65 1l0h h LYS 9 N 0.95 0.93 -0.37 3.15 3.64 -1.01 0.54 116.57 124.41 1l0h h LYS 9 Ca 0.23 -0.17 -0.05 0.00 -1.27 0.00 0.00 60.65 59.40 1l0h h LYS 9 Cb 0.10 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.75 1l0h h LYS 9 CO -0.03 0.79 0.04 0.82 -2.27 0.00 0.00 179.45 178.79 1l0h h ILE 10 N 0.88 1.25 -0.55 2.00 2.04 -0.98 0.31 117.51 122.46 1l0h h ILE 10 Ca 0.21 -0.90 -0.03 0.00 1.00 0.00 0.00 64.86 65.14 1l0h h ILE 10 Cb 0.20 1.12 -0.02 0.00 -0.74 0.00 0.00 36.82 37.37 1l0h h ILE 10 CO -0.02 0.30 0.22 0.40 0.00 0.00 0.00 178.15 179.05 1l0h h ILE 11 N 0.46 1.22 0.11 -0.67 2.04 -1.09 0.34 117.51 119.92 1l0h h ILE 11 Ca 0.11 -0.68 -0.00 0.00 1.00 0.00 0.00 64.86 65.29 1l0h h ILE 11 Cb 0.40 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 37.12 1l0h h ILE 11 CO 0.01 0.26 -0.09 1.23 0.00 0.00 0.00 178.15 179.57 1l0h h GLY 12 N 0.75 -0.20 0.90 5.37 0.00 -0.59 0.29 103.07 109.59 1l0h h GLY 12 Ca 0.18 0.10 0.01 0.00 0.00 0.00 0.00 47.33 47.62 1l0h h GLY 12 CO -0.02 -0.09 -0.04 -2.09 0.00 0.00 0.00 176.54 174.30 1l0h h GLU 13 N -0.21 -0.07 -0.34 4.80 4.57 -0.10 -0.57 114.58 122.67 1l0h h GLU 13 Ca -0.00 0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 58.10 1l0h h GLU 13 Cb 0.19 0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.78 1l0h h GLU 13 CO -0.01 -0.05 -0.12 1.96 -1.18 0.00 0.00 179.01 179.62 1l0h h GLN 14 N -0.07 0.58 -0.03 1.92 1.08 -0.15 -3.07 115.11 115.37 1l0h h GLN 14 Ca 0.02 -0.17 0.00 0.00 -1.45 0.00 0.00 58.65 57.04 1l0h h GLN 14 Cb 0.09 -0.06 0.00 0.00 -0.05 0.00 0.00 27.48 27.46 1l0h h GLN 14 CO -0.04 0.68 -0.02 1.28 -0.95 0.00 0.00 178.83 179.78 1l0h n LEU 15 N -4.19 2.72 -3.38 1.46 4.77 0.10 -4.96 117.00 113.51 1l0h n LEU 15 Ca 0.01 -0.91 -0.18 0.00 -0.03 0.00 0.00 56.01 54.90 1l0h n LEU 15 Cb 0.33 -0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.51 1l0h n LEU 15 CO 0.41 0.45 0.14 0.61 -1.33 0.00 0.00 177.39 177.68 1l0h n GLY 16 N 1.33 -0.37 3.24 -0.72 0.00 -0.24 -4.94 105.19 103.48 1l0h n GLY 16 Ca 0.15 0.12 -0.22 0.00 0.00 0.00 0.00 46.02 46.06 1l0h n GLY 16 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1l0h s VAL 17 N -3.34 1.49 0.46 1.61 -7.23 -1.09 -5.07 120.40 107.23 1l0h s VAL 17 Ca 0.15 -1.44 -0.23 0.00 -1.81 0.00 0.00 61.98 58.65 1l0h s VAL 17 Cb -0.06 -1.37 -0.07 0.00 0.56 0.00 0.00 36.38 35.43 1l0h s VAL 17 CO 0.70 -0.11 1.16 -1.59 -0.31 0.00 0.00 175.10 174.96 1l0h s LYS 18 N -1.82 3.76 0.38 4.82 -2.85 -1.26 -4.67 119.74 118.10 1l0h s LYS 18 Ca 0.03 1.77 0.21 0.00 -1.00 0.00 0.00 55.97 56.98 1l0h s LYS 18 Cb -0.10 -2.40 1.25 0.00 -2.06 0.00 0.00 37.83 34.52 1l0h s LYS 18 CO 0.03 -0.55 1.64 1.96 0.10 0.00 0.00 175.35 178.53 1l0h h GLN 19 N 2.05 0.17 0.00 1.78 1.08 -1.95 0.36 115.11 118.60 1l0h h GLN 19 Ca -0.49 -0.01 -0.00 0.00 -1.45 0.00 0.00 58.65 56.70 1l0h h GLN 19 Cb 1.25 -0.04 -0.00 0.00 -0.05 0.00 0.00 27.48 28.64 1l0h h GLN 19 CO 0.60 0.12 -0.00 1.05 -0.95 0.00 0.00 178.83 179.64 1l0h h GLU 20 N 0.18 0.00 0.00 1.46 4.11 -2.01 -1.87 114.58 116.45 1l0h h GLU 20 Ca 0.78 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 60.19 1l0h h GLU 20 Cb 2.07 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 31.32 1l0h h GLU 20 CO -0.58 0.00 -0.23 1.49 0.07 0.00 0.00 179.01 179.77 1l0h h GLU 21 N 0.00 0.00 -4.46 1.06 4.81 -0.63 -3.39 114.58 111.98 1l0h h GLU 21 Ca -0.00 0.00 -0.71 0.00 -0.13 0.00 0.00 59.36 58.52 1l0h h GLU 21 Cb 0.36 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 29.67 1l0h h GLU 21 CO 0.00 0.10 2.69 0.28 -0.73 0.00 0.00 179.01 181.35 1l0h n VAL 22 N -3.07 3.72 -2.76 0.32 0.31 -0.70 -4.88 118.33 111.26 1l0h n VAL 22 Ca 0.03 -3.53 -0.29 0.00 -0.01 0.00 0.00 64.34 60.54 1l0h n VAL 22 Cb 0.58 -2.51 -0.02 0.00 -0.91 0.00 0.00 33.84 30.98 1l0h n VAL 22 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 1l0h s THR 23 N 3.06 4.85 0.54 2.52 -4.23 -1.26 -4.97 115.64 116.14 1l0h s THR 23 Ca 0.48 0.40 0.19 0.00 -1.18 0.00 0.00 61.69 61.58 1l0h s THR 23 Cb 0.10 -3.80 0.29 0.00 1.34 0.00 0.00 72.50 70.44 1l0h s THR 23 CO -0.03 -0.67 2.17 0.78 -0.54 0.00 0.00 174.62 176.33 1l0h h ASN 24 N 0.78 0.00 1.10 3.99 4.21 -1.94 -2.20 115.58 121.51 1l0h h ASN 24 Ca -0.47 0.00 -0.11 0.00 1.21 0.00 0.00 56.30 56.93 1l0h h ASN 24 Cb 1.20 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 38.38 1l0h h ASN 24 CO 0.63 0.00 -0.95 0.78 -1.29 0.00 0.00 177.43 176.60 1l0h h ASN 25 N 0.00 0.00 -1.50 5.81 4.21 -1.96 -0.18 115.58 121.96 1l0h h ASN 25 Ca 0.00 0.00 -0.70 0.00 1.21 0.00 0.00 56.30 56.81 1l0h h ASN 25 Cb 0.02 0.00 0.06 0.00 -1.12 0.00 0.00 38.32 37.28 1l0h h ASN 25 CO -0.00 0.42 0.25 0.00 -1.29 0.00 0.00 177.43 176.80 1l0h n ALA 26 N -2.28 -1.81 -2.72 -0.83 0.00 -0.83 -4.68 120.51 107.36 1l0h n ALA 26 Ca -0.03 0.53 -0.37 0.00 0.00 0.00 0.00 53.44 53.57 1l0h n ALA 26 Cb 0.74 -1.95 -0.07 0.00 0.00 0.00 0.00 19.45 18.17 1l0h n ALA 26 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1l0h s SER 27 N 0.16 6.47 0.13 0.00 0.15 -1.26 -1.57 113.70 117.77 1l0h s SER 27 Ca 0.83 0.55 -0.23 0.00 0.70 0.00 0.00 55.95 57.79 1l0h s SER 27 Cb -1.02 -2.18 -0.02 0.00 -1.71 0.00 0.00 66.02 61.08 1l0h s SER 27 CO 0.51 0.13 1.65 -0.26 1.20 0.00 0.00 173.24 176.48 1l0h h PHE 28 N 6.44 -0.50 0.20 3.44 0.05 -1.68 0.60 116.94 125.48 1l0h h PHE 28 Ca -0.43 0.02 -0.01 0.00 3.82 0.00 0.00 57.97 61.38 1l0h h PHE 28 Cb 1.17 0.24 0.00 0.00 2.00 0.00 0.00 35.95 39.36 1l0h h PHE 28 CO 0.62 -0.27 -0.10 0.28 -0.18 0.00 0.00 178.31 178.66 1l0h h VAL 29 N -0.26 0.22 0.36 -0.55 2.07 -1.80 -1.02 116.25 115.27 1l0h h VAL 29 Ca 0.09 -0.91 -0.01 0.00 0.82 0.00 0.00 66.70 66.69 1l0h h VAL 29 Cb 0.39 0.38 -0.00 0.00 -1.52 0.00 0.00 31.29 30.53 1l0h h VAL 29 CO -0.25 0.06 -0.22 -0.33 0.02 0.00 0.00 177.57 176.85 1l0h h GLU 30 N -1.04 -0.54 0.02 1.57 4.39 -1.90 -3.13 114.58 113.94 1l0h h GLU 30 Ca -0.03 0.04 -0.34 0.00 0.34 0.00 0.00 59.36 59.37 1l0h h GLU 30 Cb 0.31 0.12 -0.05 0.00 -0.10 0.00 0.00 28.75 29.03 1l0h h GLU 30 CO 0.05 -0.36 -2.04 -0.25 -1.16 0.00 0.00 179.01 175.24 1l0h n ASP 31 N -5.35 0.90 -1.21 1.42 8.00 -0.18 -4.52 116.55 115.60 1l0h n ASP 31 Ca -0.10 0.20 0.11 0.00 0.71 0.00 0.00 54.79 55.70 1l0h n ASP 31 Cb 0.26 0.11 0.28 0.00 -0.02 0.00 0.00 41.12 41.75 1l0h n ASP 31 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1l0h n LEU 32 N -3.04 3.72 -1.32 0.64 4.77 0.02 -4.93 117.00 116.86 1l0h n LEU 32 Ca -0.27 -1.92 -0.13 0.00 -0.03 0.00 0.00 56.01 53.66 1l0h n LEU 32 Cb 1.08 -0.41 -0.02 0.00 -2.33 0.00 0.00 43.42 41.74 1l0h n LEU 32 CO 0.42 0.91 -0.15 0.61 -1.33 0.00 0.00 177.39 177.85 1l0h n GLY 33 N 1.46 0.27 3.77 -0.72 0.00 -0.95 -4.92 105.19 104.09 1l0h n GLY 33 Ca 0.22 -0.37 -0.38 0.00 0.00 0.00 0.00 46.02 45.48 1l0h n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1l0h s ALA 34 N -2.59 3.25 0.37 4.61 0.00 -0.44 -4.98 121.76 121.99 1l0h s ALA 34 Ca 0.00 0.63 0.08 0.00 0.00 0.00 0.00 51.96 52.67 1l0h s ALA 34 Cb 0.00 -3.22 -0.06 0.00 0.00 0.00 0.00 23.12 19.84 1l0h s ALA 34 CO 0.00 0.08 0.09 0.16 0.00 0.00 0.00 175.76 176.09 1l0h s ASP 35 N -1.39 4.29 0.23 0.00 1.47 -1.26 -4.54 116.67 115.47 1l0h s ASP 35 Ca 0.48 -1.04 -0.11 0.00 1.18 0.00 0.00 52.55 53.06 1l0h s ASP 35 Cb -0.23 -0.52 0.32 0.00 -0.34 0.00 0.00 42.92 42.15 1l0h s ASP 35 CO 0.29 -0.38 1.39 -1.54 0.68 0.00 0.00 175.17 175.61 1l0h n SER 36 N -1.08 -0.44 0.23 2.11 3.41 -1.26 -0.31 113.62 116.28 1l0h n SER 36 Ca -0.03 1.55 0.09 0.00 -0.26 0.00 0.00 58.87 60.21 1l0h n SER 36 Cb 0.64 -0.41 0.57 0.00 -0.26 0.00 0.00 64.21 64.74 1l0h n SER 36 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1l0h h LEU 37 N 0.00 0.00 -0.41 1.04 5.85 -1.98 -2.15 115.31 117.66 1l0h h LEU 37 Ca 0.37 0.00 -0.16 0.00 0.84 0.00 0.00 57.88 58.93 1l0h h LEU 37 Cb 0.60 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.62 1l0h h LEU 37 CO -0.90 0.20 -0.44 0.44 -0.34 0.00 0.00 178.44 177.39 1l0h h ASP 38 N 0.00 0.93 0.85 1.25 5.19 -1.05 0.40 116.42 123.99 1l0h h ASP 38 Ca -0.00 -0.45 -0.18 0.00 -0.62 0.00 0.00 57.03 55.78 1l0h h ASP 38 Cb 0.44 -0.26 -0.03 0.00 0.18 0.00 0.00 39.33 39.66 1l0h h ASP 38 CO 0.03 1.23 -0.84 0.71 -3.12 0.00 0.00 179.24 177.24 1l0h h THR 39 N 0.69 1.60 -0.19 0.35 1.35 -1.24 -1.85 112.91 113.62 1l0h h THR 39 Ca 0.04 -2.88 -0.15 0.00 -0.55 0.00 0.00 66.41 62.87 1l0h h THR 39 Cb 1.03 2.56 0.00 0.00 -1.73 0.00 0.00 68.15 70.01 1l0h h THR 39 CO 0.10 0.82 -0.45 0.58 -0.25 0.00 0.00 175.52 176.32 1l0h h VAL 40 N 0.00 1.32 0.00 6.82 2.07 -1.19 -2.81 116.25 122.46 1l0h h VAL 40 Ca -0.01 -1.69 -0.10 0.00 0.82 0.00 0.00 66.70 65.73 1l0h h VAL 40 Cb 1.49 1.89 -0.01 0.00 -1.52 0.00 0.00 31.29 33.14 1l0h h VAL 40 CO 0.11 0.53 -0.45 -0.33 0.02 0.00 0.00 177.57 177.44 1l0h h GLU 41 N 0.34 0.00 -0.06 1.57 5.08 -0.95 -2.41 114.58 118.15 1l0h h GLU 41 Ca -0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1l0h h GLU 41 Cb 1.06 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.31 1l0h h GLU 41 CO 0.10 0.45 0.01 1.25 -1.00 0.00 0.00 179.01 179.82 1l0h h LEU 42 N 0.00 0.09 -1.28 1.33 5.85 -1.33 0.49 115.31 120.47 1l0h h LEU 42 Ca -0.00 -0.28 -0.02 0.00 0.84 0.00 0.00 57.88 58.42 1l0h h LEU 42 Cb 1.17 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 42.15 1l0h h LEU 42 CO 0.06 0.35 0.24 0.58 -0.34 0.00 0.00 178.44 179.32 1l0h h VAL 43 N -0.16 1.18 -0.60 1.05 2.07 -1.50 0.80 116.25 119.09 1l0h h VAL 43 Ca 0.02 -0.52 -0.08 0.00 0.82 0.00 0.00 66.70 66.93 1l0h h VAL 43 Cb 0.30 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 30.58 1l0h h VAL 43 CO 0.00 0.21 0.06 -0.03 0.02 0.00 0.00 177.57 177.83 1l0h h MET 44 N 0.73 1.02 -0.41 1.57 1.85 -1.05 -1.42 114.93 117.22 1l0h h MET 44 Ca 0.18 -0.30 -0.03 0.00 -0.61 0.00 0.00 59.70 58.95 1l0h h MET 44 Cb 0.10 -0.11 -0.02 0.00 0.43 0.00 0.00 31.60 32.00 1l0h h MET 44 CO -0.02 0.98 0.15 0.00 -0.40 0.00 0.00 176.91 177.62 1l0h h ALA 45 N 1.00 0.53 -0.24 0.39 0.00 0.12 -2.40 119.26 118.66 1l0h h ALA 45 Ca 0.18 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 1l0h h ALA 45 Cb 0.48 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1l0h h ALA 45 CO 0.02 0.15 -0.09 -0.07 0.00 0.00 0.00 179.25 179.26 1l0h h LEU 46 N 0.51 0.36 -0.37 0.00 3.38 -0.65 0.41 115.31 118.96 1l0h h LEU 46 Ca 0.13 -0.07 -0.08 0.00 0.09 0.00 0.00 57.88 57.95 1l0h h LEU 46 Cb 0.22 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1l0h h LEU 46 CO -0.01 0.49 -0.08 -0.33 0.09 0.00 0.00 178.44 178.60 1l0h h GLU 47 N 0.36 0.71 -0.02 1.13 5.08 -1.01 -2.44 114.58 118.39 1l0h h GLU 47 Ca 0.07 -0.27 -0.01 0.00 -1.00 0.00 0.00 59.36 58.15 1l0h h GLU 47 Cb 0.38 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1l0h h GLU 47 CO 0.02 0.86 -0.04 0.93 -1.00 0.00 0.00 179.01 179.78 1l0h h GLU 48 N 0.51 0.05 -0.69 2.33 5.08 -1.22 0.20 114.58 120.84 1l0h h GLU 48 Ca 0.09 -0.04 0.15 0.00 -1.00 0.00 0.00 59.36 58.57 1l0h h GLU 48 Cb 0.59 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 29.73 1l0h h GLU 48 CO 0.04 0.62 0.06 1.49 -1.00 0.00 0.00 179.01 180.21 1l0h h GLU 49 N -0.51 0.15 -0.58 2.33 4.57 -0.95 -0.30 114.58 119.30 1l0h h GLU 49 Ca 0.00 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 1l0h h GLU 49 Cb 0.62 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.17 1l0h h GLU 49 CO 0.01 0.10 0.00 1.19 -1.18 0.00 0.00 179.01 179.13 1l0h n PHE 50 N -5.26 1.54 -3.94 0.92 3.01 -0.92 -4.98 117.46 107.84 1l0h n PHE 50 Ca 0.12 -0.66 -0.38 0.00 1.01 0.00 0.00 57.45 57.54 1l0h n PHE 50 Cb 0.42 -0.31 0.02 0.00 -0.01 0.00 0.00 39.48 39.59 1l0h n PHE 50 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 1l0h n ASP 51 N 0.82 -4.54 -3.62 4.37 10.43 0.07 -4.96 116.55 119.11 1l0h n ASP 51 Ca 0.25 -1.15 -0.15 0.00 2.57 0.00 0.00 54.79 56.32 1l0h n ASP 51 Cb 0.95 -1.87 -0.07 0.00 1.84 0.00 0.00 41.12 41.97 1l0h n ASP 51 CO 0.00 0.00 0.00 0.28 -1.07 0.00 0.00 177.20 176.41 1l0h s THR 52 N -3.33 0.00 0.23 -3.53 -1.32 0.47 -5.02 115.64 103.14 1l0h s THR 52 Ca 0.32 -0.00 -0.23 0.00 -1.21 0.00 0.00 61.69 60.57 1l0h s THR 52 Cb -0.17 -0.97 -0.09 0.00 -1.51 0.00 0.00 72.50 69.76 1l0h s THR 52 CO 0.94 -0.00 0.79 -1.61 -2.21 0.00 0.00 174.62 172.52 1l0h s GLU 53 N 0.09 4.41 -0.30 7.08 0.41 -1.26 -4.26 118.70 124.86 1l0h s GLU 53 Ca -0.02 1.05 -0.03 0.00 -0.41 0.00 0.00 54.97 55.56 1l0h s GLU 53 Cb -0.04 -2.96 0.04 0.00 -1.78 0.00 0.00 34.13 29.39 1l0h s GLU 53 CO 0.03 0.41 0.02 0.42 -0.49 0.00 0.00 175.26 175.65 1l0h s ILE 54 N -1.45 3.17 0.45 -1.63 1.01 -1.26 -5.09 121.20 116.41 1l0h s ILE 54 Ca 0.43 -1.28 -0.25 0.00 0.00 0.00 0.00 60.65 59.55 1l0h s ILE 54 Cb -0.19 -2.79 -0.08 0.00 0.01 0.00 0.00 42.46 39.41 1l0h s ILE 54 CO 0.23 -0.09 1.43 -2.16 0.00 0.00 0.00 174.94 174.35 1l0h s PRO 55 N 1.30 3.66 0.28 2.79 0.04 -1.26 -4.68 135.00 137.13 1l0h s PRO 55 Ca -0.04 2.42 0.02 0.00 0.04 0.00 0.00 61.00 63.44 1l0h s PRO 55 Cb -0.19 -2.64 0.69 0.00 0.04 0.00 0.00 34.50 32.39 1l0h s PRO 55 CO -0.00 -0.84 1.66 -0.44 0.04 0.00 0.00 177.00 177.42 1l0h h ASP 56 N 2.29 0.06 0.53 6.66 3.32 -1.98 0.63 116.42 127.92 1l0h h ASP 56 Ca -0.51 0.18 -0.03 0.00 0.02 0.00 0.00 57.03 56.69 1l0h h ASP 56 Cb 1.27 0.24 -0.00 0.00 0.22 0.00 0.00 39.33 41.05 1l0h h ASP 56 CO 0.61 -0.12 -0.16 -0.33 -1.72 0.00 0.00 179.24 177.52 1l0h h GLU 57 N 0.25 0.00 0.11 3.56 4.39 -2.01 -1.44 114.58 119.43 1l0h h GLU 57 Ca 0.54 0.00 -0.34 0.00 0.34 0.00 0.00 59.36 59.90 1l0h h GLU 57 Cb 1.06 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.70 1l0h h GLU 57 CO -0.62 0.16 -1.84 0.93 -1.16 0.00 0.00 179.01 176.48 1l0h h GLU 58 N 0.00 0.22 -0.94 2.33 5.08 -1.38 -3.37 114.58 116.52 1l0h h GLU 58 Ca -0.00 -0.38 0.02 0.00 -1.00 0.00 0.00 59.36 57.99 1l0h h GLU 58 Cb 0.47 0.14 -0.05 0.00 0.50 0.00 0.00 28.75 29.82 1l0h h GLU 58 CO 0.02 1.06 0.62 0.00 -1.00 0.00 0.00 179.01 179.71 1l0h h ALA 59 N 0.33 1.21 -0.08 3.43 0.00 -0.69 -2.34 119.26 121.12 1l0h h ALA 59 Ca -0.36 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.52 1l0h h ALA 59 Cb 2.04 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 19.46 1l0h h ALA 59 CO 0.11 0.55 0.11 1.05 0.00 0.00 0.00 179.25 181.07 1l0h h GLU 60 N 1.24 0.00 0.00 0.00 4.11 -1.43 -0.38 114.58 118.13 1l0h h GLU 60 Ca 0.35 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.78 1l0h h GLU 60 Cb -0.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.15 1l0h h GLU 60 CO -0.09 0.00 -0.48 0.87 0.07 0.00 0.00 179.01 179.38 1l0h h LYS 61 N 0.00 0.00 -5.41 1.06 1.57 -1.61 -3.40 116.57 108.78 1l0h h LYS 61 Ca 0.04 0.00 -0.46 0.00 -1.87 0.00 0.00 60.65 58.36 1l0h h LYS 61 Cb 0.25 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.52 1l0h h LYS 61 CO -0.00 0.00 1.53 -0.89 -0.57 0.00 0.00 179.45 179.52 1l0h n ILE 62 N -2.68 2.43 0.38 1.86 5.41 -0.15 -4.43 119.36 122.18 1l0h n ILE 62 Ca 0.03 -2.48 0.04 0.00 1.00 0.00 0.00 62.75 61.34 1l0h n ILE 62 Cb 0.51 -2.24 -0.01 0.00 -0.71 0.00 0.00 39.64 37.19 1l0h n ILE 62 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 1l0h n THR 63 N 7.21 0.00 -4.20 1.39 -2.24 -1.26 -4.90 114.28 110.28 1l0h n THR 63 Ca 0.47 -0.39 -0.12 0.00 -2.27 0.00 0.00 64.05 61.74 1l0h n THR 63 Cb 0.46 1.07 -0.10 0.00 -2.10 0.00 0.00 70.33 69.66 1l0h n THR 63 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1l0h s THR 64 N -1.36 0.48 0.16 4.28 -4.23 -1.26 -1.68 115.64 112.02 1l0h s THR 64 Ca 0.06 -1.94 -0.16 0.00 -1.18 0.00 0.00 61.69 58.47 1l0h s THR 64 Cb 0.07 -2.01 0.03 0.00 1.34 0.00 0.00 72.50 71.92 1l0h s THR 64 CO 0.24 -0.55 1.77 0.58 -0.54 0.00 0.00 174.62 176.12 1l0h h VAL 65 N 2.81 0.96 -0.83 2.29 2.07 -1.42 -1.38 116.25 120.74 1l0h h VAL 65 Ca -0.36 -0.13 -0.02 0.00 0.82 0.00 0.00 66.70 67.01 1l0h h VAL 65 Cb 1.19 0.55 -0.04 0.00 -1.52 0.00 0.00 31.29 31.48 1l0h h VAL 65 CO 0.62 0.07 0.44 -0.61 0.02 0.00 0.00 177.57 178.11 1l0h h GLN 66 N 0.37 1.16 -0.59 1.57 5.75 -1.29 -1.56 115.11 120.52 1l0h h GLN 66 Ca 0.17 -0.14 -0.06 0.00 -0.15 0.00 0.00 58.65 58.46 1l0h h GLN 66 Cb 0.09 -0.23 -0.03 0.00 1.07 0.00 0.00 27.48 28.39 1l0h h GLN 66 CO -0.13 0.86 0.12 0.00 -2.65 0.00 0.00 178.83 177.03 1l0h h ALA 67 N 1.32 1.10 -0.37 3.38 0.00 -1.71 0.98 119.26 123.95 1l0h h ALA 67 Ca 0.29 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 1l0h h ALA 67 Cb 0.05 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1l0h h ALA 67 CO -0.04 0.59 0.07 0.00 0.00 0.00 0.00 179.25 179.87 1l0h h ALA 68 N 1.24 0.49 -0.19 0.00 0.00 -0.69 -1.73 119.26 118.38 1l0h h ALA 68 Ca 0.19 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1l0h h ALA 68 Cb 0.36 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1l0h h ALA 68 CO 0.00 0.19 0.10 0.82 0.00 0.00 0.00 179.25 180.37 1l0h h ILE 69 N 0.46 1.11 -0.93 0.00 2.04 -0.89 -2.26 117.51 117.05 1l0h h ILE 69 Ca 0.11 -0.31 0.01 0.00 1.00 0.00 0.00 64.86 65.67 1l0h h ILE 69 Cb 0.35 0.97 -0.05 0.00 -0.74 0.00 0.00 36.82 37.36 1l0h h ILE 69 CO 0.01 0.11 0.61 0.44 0.00 0.00 0.00 178.15 179.32 1l0h h ASP 70 N 0.20 1.06 0.20 1.72 3.32 -0.74 0.11 116.42 122.29 1l0h h ASP 70 Ca 0.07 -0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.08 1l0h h ASP 70 Cb 0.08 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.37 1l0h h ASP 70 CO -0.01 0.77 -0.10 0.22 -1.72 0.00 0.00 179.24 178.40 1l0h h TYR 71 N 1.25 -0.25 -0.55 4.55 3.20 -1.09 -0.29 116.97 123.79 1l0h h TYR 71 Ca 0.34 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.20 1l0h h TYR 71 Cb -0.14 0.08 -0.03 0.00 1.54 0.00 0.00 36.73 38.18 1l0h h TYR 71 CO -0.00 0.00 0.34 0.82 -1.64 0.00 0.00 178.16 177.68 1l0h h ILE 72 N -0.48 1.16 0.07 1.81 1.08 -1.22 -1.96 117.51 117.97 1l0h h ILE 72 Ca -0.03 -0.33 -0.00 0.00 -0.39 0.00 0.00 64.86 64.11 1l0h h ILE 72 Cb 0.37 0.39 -0.00 0.00 -3.07 0.00 0.00 36.82 34.51 1l0h h ILE 72 CO 0.05 0.16 -0.05 0.78 -0.69 0.00 0.00 178.15 178.39 1l0h h ASN 73 N 0.74 -0.13 -0.17 1.72 -0.26 -0.95 -1.97 115.58 114.57 1l0h h ASN 73 Ca 0.20 0.01 0.05 0.00 -0.56 0.00 0.00 56.30 56.00 1l0h h ASN 73 Cb -0.04 0.04 -0.01 0.00 -1.06 0.00 0.00 38.32 37.26 1l0h h ASN 73 CO -0.04 -0.08 0.29 1.23 -1.06 0.00 0.00 177.43 177.77 1l0h h GLY 74 N -0.12 0.00 -4.42 2.83 0.00 -0.72 -1.70 103.07 98.93 1l0h h GLY 74 Ca -0.00 0.00 -0.69 0.00 0.00 0.00 0.00 47.33 46.64 1l0h h GLY 74 CO -0.00 0.00 0.60 1.42 0.00 0.00 0.00 176.54 178.56 1l0h n HIS 75 N -3.41 3.10 -0.09 5.60 8.25 -0.74 -5.09 115.22 122.85 1l0h n HIS 75 Ca 0.02 -2.68 0.00 0.00 -0.26 0.00 0.00 57.72 54.80 1l0h n HIS 75 Cb 0.40 -1.08 0.00 0.00 1.12 0.00 0.00 29.99 30.42 1l0h n HIS 75 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02