#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a8v s ASN 2 N 0.00 3.79 0.15 6.12 3.84 -1.26 -1.81 114.94 125.77 2a8v s ASN 2 Ca 0.00 -0.31 -0.21 0.00 0.21 0.00 0.00 52.86 52.54 2a8v s ASN 2 Cb 0.00 -1.06 0.03 0.00 -0.55 0.00 0.00 41.25 39.66 2a8v s ASN 2 CO 0.00 0.27 1.65 0.25 -2.79 0.00 0.00 177.10 176.48 2a8v h LEU 3 N 5.91 -0.62 -0.59 3.21 5.85 -1.66 -0.48 115.31 126.94 2a8v h LEU 3 Ca -0.37 0.12 0.02 0.00 0.84 0.00 0.00 57.88 58.49 2a8v h LEU 3 Cb 1.17 0.31 -0.03 0.00 0.37 0.00 0.00 40.66 42.48 2a8v h LEU 3 CO 0.51 -0.23 0.37 0.74 -0.34 0.00 0.00 178.44 179.49 2a8v h THR 4 N -0.19 1.10 0.35 1.05 2.02 -1.92 -1.31 112.91 114.01 2a8v h THR 4 Ca 0.13 -0.25 -0.01 0.00 0.77 0.00 0.00 66.41 67.06 2a8v h THR 4 Cb 0.40 0.29 -0.02 0.00 -1.74 0.00 0.00 68.15 67.08 2a8v h THR 4 CO -0.35 0.13 -0.29 -0.08 0.37 0.00 0.00 175.52 175.30 2a8v h GLU 5 N 0.74 -0.63 -0.48 6.66 4.81 -1.66 -1.92 114.58 122.09 2a8v h GLU 5 Ca 0.23 0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.52 2a8v h GLU 5 Cb -0.02 0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.48 2a8v h GLU 5 CO -0.08 -0.42 0.32 -0.07 -0.73 0.00 0.00 179.01 178.02 2a8v h LEU 6 N -0.66 0.52 -2.04 1.64 3.38 -1.06 -0.99 115.31 116.11 2a8v h LEU 6 Ca -0.03 -0.01 0.11 0.00 0.09 0.00 0.00 57.88 58.04 2a8v h LEU 6 Cb 0.58 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 2a8v h LEU 6 CO -0.02 0.37 0.29 0.50 0.09 0.00 0.00 178.44 179.67 2a8v h LYS 7 N 0.61 0.00 -0.56 1.13 3.64 -0.44 0.73 116.57 121.68 2a8v h LYS 7 Ca 0.18 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.56 2a8v h LYS 7 Cb -0.02 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.80 2a8v h LYS 7 CO -0.04 0.00 0.01 0.09 -2.27 0.00 0.00 179.45 177.24 2a8v n ASN 8 N -4.26 5.61 -4.71 4.20 3.02 -0.38 -4.95 115.26 113.79 2a8v n ASN 8 Ca 0.06 -2.96 -0.34 0.00 -0.03 0.00 0.00 54.58 51.31 2a8v n ASN 8 Cb 0.47 -0.68 -0.09 0.00 -0.61 0.00 0.00 39.78 38.87 2a8v n ASN 8 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2a8v s THR 9 N -2.79 4.41 0.14 3.41 2.01 0.25 -5.06 115.64 118.00 2a8v s THR 9 Ca 0.54 -0.36 -0.33 0.00 0.31 0.00 0.00 61.69 61.85 2a8v s THR 9 Cb 0.41 -2.93 -0.12 0.00 0.01 0.00 0.00 72.50 69.88 2a8v s THR 9 CO 0.15 0.49 1.72 -2.65 -0.69 0.00 0.00 174.62 173.64 2a8v n PRO 10 N 1.71 2.49 -0.33 4.92 -0.02 -1.26 -4.85 135.00 137.66 2a8v n PRO 10 Ca -0.16 0.90 0.26 0.00 -2.02 0.00 0.00 63.50 62.48 2a8v n PRO 10 Cb 0.53 -2.73 0.57 0.00 -0.02 0.00 0.00 33.50 31.85 2a8v n PRO 10 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2a8v h VAL 11 N 4.15 0.46 -0.06 -1.45 2.07 -1.97 0.17 116.25 119.62 2a8v h VAL 11 Ca -0.45 -0.10 -0.11 0.00 0.82 0.00 0.00 66.70 66.86 2a8v h VAL 11 Cb 1.23 0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 31.15 2a8v h VAL 11 CO 0.93 0.05 -0.47 0.77 0.02 0.00 0.00 177.57 178.87 2a8v h SER 12 N 0.28 0.15 0.56 0.57 4.64 -2.00 -1.99 113.55 115.76 2a8v h SER 12 Ca 0.61 -0.07 -0.25 0.00 -0.47 0.00 0.00 61.79 61.60 2a8v h SER 12 Cb 1.75 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.80 2a8v h SER 12 CO -0.25 0.60 -1.13 -0.08 -0.87 0.00 0.00 176.83 175.10 2a8v h GLU 13 N 0.11 0.29 -0.72 4.77 4.81 -1.07 -3.05 114.58 119.73 2a8v h GLU 13 Ca 0.01 -0.43 -0.04 0.00 -0.13 0.00 0.00 59.36 58.76 2a8v h GLU 13 Cb 0.88 0.15 -0.03 0.00 0.63 0.00 0.00 28.75 30.37 2a8v h GLU 13 CO 0.07 1.17 0.30 -0.07 -0.73 0.00 0.00 179.01 179.75 2a8v h LEU 14 N 0.11 0.99 -0.02 1.64 3.38 -1.16 -1.27 115.31 118.98 2a8v h LEU 14 Ca -0.11 -0.17 0.03 0.00 0.09 0.00 0.00 57.88 57.72 2a8v h LEU 14 Cb 1.83 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 42.29 2a8v h LEU 14 CO 0.19 0.88 -0.18 0.40 0.09 0.00 0.00 178.44 179.82 2a8v h ILE 15 N 1.03 0.57 -0.02 1.22 2.04 -1.36 0.28 117.51 121.28 2a8v h ILE 15 Ca 0.24 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.11 2a8v h ILE 15 Cb 0.19 0.57 -0.01 0.00 -0.74 0.00 0.00 36.82 36.83 2a8v h ILE 15 CO -0.02 0.00 -0.03 0.74 0.00 0.00 0.00 178.15 178.84 2a8v h THR 16 N -0.28 0.92 -0.76 -0.27 2.02 -1.38 -0.90 112.91 112.26 2a8v h THR 16 Ca 0.06 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.28 2a8v h THR 16 Cb 0.36 0.92 -0.04 0.00 -1.74 0.00 0.00 68.15 67.65 2a8v h THR 16 CO -0.19 0.00 0.50 0.25 0.37 0.00 0.00 175.52 176.45 2a8v h LEU 17 N -0.04 0.78 -0.03 2.58 5.85 -0.93 -2.10 115.31 121.42 2a8v h LEU 17 Ca 0.02 -0.01 -0.22 0.00 0.84 0.00 0.00 57.88 58.51 2a8v h LEU 17 Cb 0.07 -0.18 0.02 0.00 0.37 0.00 0.00 40.66 40.93 2a8v h LEU 17 CO -0.04 0.53 -0.83 1.23 -0.34 0.00 0.00 178.44 178.99 2a8v h GLY 18 N 0.91 0.68 2.00 3.75 0.00 -0.09 -3.15 103.07 107.17 2a8v h GLY 18 Ca 0.30 -1.15 0.00 0.00 0.00 0.00 0.00 47.33 46.49 2a8v h GLY 18 CO -0.09 1.01 0.00 0.83 0.00 0.00 0.00 176.54 178.29 2a8v h GLU 19 N 0.24 0.00 -0.17 4.80 5.08 -1.02 -1.00 114.58 122.51 2a8v h GLU 19 Ca -0.10 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 2a8v h GLU 19 Cb 1.50 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.75 2a8v h GLU 19 CO 0.17 0.00 0.00 0.09 -1.00 0.00 0.00 179.01 178.27 2a8v n ASN 20 N -2.69 1.48 -0.29 1.42 3.02 -0.80 -2.99 115.26 114.40 2a8v n ASN 20 Ca 0.01 -1.73 0.04 0.00 -0.03 0.00 0.00 54.58 52.87 2a8v n ASN 20 Cb 0.27 -0.11 0.03 0.00 -0.61 0.00 0.00 39.78 39.37 2a8v n ASN 20 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 2a8v n MET 21 N 0.22 0.10 0.00 3.52 2.81 -0.44 -4.98 117.12 118.35 2a8v n MET 21 Ca 0.15 -0.96 0.00 0.00 -1.81 0.00 0.00 57.70 55.08 2a8v n MET 21 Cb 0.29 -1.14 0.00 0.00 -0.71 0.00 0.00 33.22 31.66 2a8v n MET 21 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2a8v n GLY 22 N 0.40 0.63 3.78 3.03 0.00 -1.15 -5.06 105.19 106.82 2a8v n GLY 22 Ca 0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 2a8v n GLY 22 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2a8v s LEU 23 N 0.00 4.33 0.27 0.99 1.43 -0.84 -4.99 118.68 119.87 2a8v s LEU 23 Ca 0.00 1.88 0.07 0.00 -1.03 0.00 0.00 54.13 55.05 2a8v s LEU 23 Cb 0.00 -4.01 -0.03 0.00 0.03 0.00 0.00 46.19 42.18 2a8v s LEU 23 CO 0.00 -0.12 0.26 -1.61 0.23 0.00 0.00 176.35 175.11 2a8v s GLU 24 N -2.07 2.99 0.00 1.70 0.41 -1.26 -4.08 118.70 116.40 2a8v s GLU 24 Ca 0.51 -1.04 0.00 0.00 -0.41 0.00 0.00 54.97 54.02 2a8v s GLU 24 Cb -0.20 -2.62 0.00 0.00 -1.78 0.00 0.00 34.13 29.53 2a8v s GLU 24 CO 0.25 0.33 0.00 0.09 -0.49 0.00 0.00 175.26 175.44 2a8v n ASN 25 N -1.29 0.00 0.05 -0.19 3.02 -1.26 -4.83 115.26 110.77 2a8v n ASN 25 Ca -0.06 0.00 0.02 0.00 -0.03 0.00 0.00 54.58 54.51 2a8v n ASN 25 Cb 0.58 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.69 2a8v n ASN 25 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 2a8v h LEU 26 N 0.98 0.00 -1.94 3.41 3.38 -1.93 -3.37 115.31 115.85 2a8v h LEU 26 Ca 0.00 0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.07 2a8v h LEU 26 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2a8v h LEU 26 CO 0.00 0.47 0.45 0.00 0.09 0.00 0.00 178.44 179.45 2a8v h ALA 27 N 1.53 1.98 -0.52 1.53 0.00 -1.94 -0.85 119.26 120.99 2a8v h ALA 27 Ca -0.13 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2a8v h ALA 27 Cb 1.47 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.29 2a8v h ALA 27 CO 0.04 -0.62 0.00 2.89 0.00 0.00 0.00 179.25 181.56 2a8v n ARG 28 N -3.53 3.62 -4.32 0.00 1.85 -1.26 -4.99 116.66 108.04 2a8v n ARG 28 Ca 0.06 -2.81 -0.24 0.00 -1.00 0.00 0.00 57.85 53.86 2a8v n ARG 28 Cb 0.60 -1.85 -0.08 0.00 -1.05 0.00 0.00 32.46 30.08 2a8v n ARG 28 CO 0.00 0.00 0.00 -1.64 -0.01 0.00 0.00 177.63 175.98 2a8v s MET 29 N -2.05 2.13 0.34 2.89 -1.94 -0.33 -5.10 119.30 115.25 2a8v s MET 29 Ca 0.46 -1.60 -0.29 0.00 -1.71 0.00 0.00 55.69 52.56 2a8v s MET 29 Cb 0.32 -2.02 -0.11 0.00 2.01 0.00 0.00 34.83 35.03 2a8v s MET 29 CO 0.19 0.26 1.39 0.50 -0.01 0.00 0.00 175.02 177.35 2a8v s ARG 30 N -3.68 4.25 0.17 2.03 6.06 -1.26 -4.79 118.95 121.74 2a8v s ARG 30 Ca 0.33 2.36 -0.19 0.00 -2.50 0.00 0.00 55.73 55.74 2a8v s ARG 30 Cb -0.04 -3.03 0.11 0.00 0.06 0.00 0.00 34.95 32.05 2a8v s ARG 30 CO 0.19 -0.34 1.63 -0.22 -2.50 0.00 0.00 175.30 174.06 2a8v h LYS 31 N 3.41 -0.11 -0.99 5.12 3.64 -1.98 0.27 116.57 125.93 2a8v h LYS 31 Ca -0.49 0.01 0.20 0.00 -1.27 0.00 0.00 60.65 59.10 2a8v h LYS 31 Cb 1.23 0.03 -0.10 0.00 -0.41 0.00 0.00 32.23 32.98 2a8v h LYS 31 CO 0.66 -0.07 0.62 0.37 -2.27 0.00 0.00 179.45 178.75 2a8v h GLN 32 N -0.12 0.64 -0.10 1.90 4.15 -1.99 0.20 115.11 119.79 2a8v h GLN 32 Ca 0.21 -0.04 -0.21 0.00 0.77 0.00 0.00 58.65 59.38 2a8v h GLN 32 Cb 0.44 -0.14 0.00 0.00 0.21 0.00 0.00 27.48 27.99 2a8v h GLN 32 CO -0.50 0.42 -0.78 -0.44 -1.93 0.00 0.00 178.83 175.60 2a8v h ASP 33 N 0.66 0.70 -0.38 -0.69 5.19 -0.96 -2.03 116.42 118.90 2a8v h ASP 33 Ca 0.56 -0.47 -0.01 0.00 -0.62 0.00 0.00 57.03 56.50 2a8v h ASP 33 Cb 1.02 -0.21 -0.02 0.00 0.18 0.00 0.00 39.33 40.31 2a8v h ASP 33 CO -0.33 1.24 0.21 0.40 -3.12 0.00 0.00 179.24 177.64 2a8v h ILE 34 N 0.39 1.14 -0.63 0.35 2.04 0.17 -0.14 117.51 120.83 2a8v h ILE 34 Ca -0.05 -0.35 -0.01 0.00 1.00 0.00 0.00 64.86 65.46 2a8v h ILE 34 Cb 1.38 0.68 -0.03 0.00 -0.74 0.00 0.00 36.82 38.12 2a8v h ILE 34 CO 0.15 0.14 0.36 0.40 0.00 0.00 0.00 178.15 179.20 2a8v h ILE 35 N 0.49 1.19 -0.52 -0.67 2.04 -0.67 -0.66 117.51 118.71 2a8v h ILE 35 Ca 0.13 -0.45 -0.01 0.00 1.00 0.00 0.00 64.86 65.54 2a8v h ILE 35 Cb 0.04 0.36 -0.02 0.00 -0.74 0.00 0.00 36.82 36.45 2a8v h ILE 35 CO -0.02 0.20 0.30 -0.26 0.00 0.00 0.00 178.15 178.37 2a8v h PHE 36 N 0.85 0.70 -0.50 1.37 0.04 -1.03 -1.68 116.94 116.69 2a8v h PHE 36 Ca 0.22 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.99 2a8v h PHE 36 Cb 0.01 -0.23 -0.02 0.00 2.20 0.00 0.00 35.95 37.91 2a8v h PHE 36 CO -0.01 0.50 0.33 0.00 -0.60 0.00 0.00 178.31 178.52 2a8v h ALA 37 N 1.14 0.63 -0.76 2.45 0.00 -0.55 -0.78 119.26 121.39 2a8v h ALA 37 Ca 0.18 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 2a8v h ALA 37 Cb 0.01 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.57 2a8v h ALA 37 CO -0.03 0.08 0.40 0.82 0.00 0.00 0.00 179.25 180.51 2a8v h ILE 38 N 0.68 1.24 -0.13 0.00 2.04 -0.89 -0.89 117.51 119.56 2a8v h ILE 38 Ca 0.18 -0.62 -0.03 0.00 1.00 0.00 0.00 64.86 65.39 2a8v h ILE 38 Cb -0.08 0.25 -0.00 0.00 -0.74 0.00 0.00 36.82 36.25 2a8v h ILE 38 CO -0.04 0.27 -0.04 -0.07 0.00 0.00 0.00 178.15 178.26 2a8v h LEU 39 N 1.06 0.26 -0.81 1.44 3.38 -1.04 -1.92 115.31 117.68 2a8v h LEU 39 Ca 0.27 -0.39 0.07 0.00 0.09 0.00 0.00 57.88 57.92 2a8v h LEU 39 Cb 0.07 -0.07 -0.06 0.00 0.09 0.00 0.00 40.66 40.68 2a8v h LEU 39 CO -0.04 0.59 0.48 0.11 0.09 0.00 0.00 178.44 179.67 2a8v h LYS 40 N -0.08 0.82 -0.13 1.13 1.57 -1.01 -0.58 116.57 118.30 2a8v h LYS 40 Ca 0.03 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.76 2a8v h LYS 40 Cb 0.49 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 2a8v h LYS 40 CO 0.02 0.54 0.07 0.37 -0.57 0.00 0.00 179.45 179.87 2a8v h GLN 41 N 0.84 0.18 -0.81 3.15 5.75 -1.08 -0.53 115.11 122.60 2a8v h GLN 41 Ca 0.37 -0.02 -0.02 0.00 -0.15 0.00 0.00 58.65 58.82 2a8v h GLN 41 Cb 0.25 -0.03 -0.04 0.00 1.07 0.00 0.00 27.48 28.72 2a8v h GLN 41 CO -0.20 0.21 0.43 1.25 -2.65 0.00 0.00 178.83 177.87 2a8v h HIS 42 N 0.10 1.14 -0.22 3.99 2.76 -0.92 -1.77 115.15 120.23 2a8v h HIS 42 Ca 0.04 -0.04 -0.07 0.00 -2.20 0.00 0.00 60.37 58.10 2a8v h HIS 42 Cb 0.09 -0.36 -0.00 0.00 1.55 0.00 0.00 27.41 28.68 2a8v h HIS 42 CO -0.04 0.81 -0.15 0.00 -1.30 0.00 0.00 177.93 177.25 2a8v h ALA 43 N 1.22 0.32 0.00 5.26 0.00 -0.98 -2.43 119.26 122.65 2a8v h ALA 43 Ca 0.28 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2a8v h ALA 43 Cb 0.06 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2a8v h ALA 43 CO -0.04 0.21 0.00 1.63 0.00 0.00 0.00 179.25 181.05 2a8v n LYS 44 N -4.47 0.20 0.00 0.00 5.02 -0.22 -1.14 118.16 117.54 2a8v n LYS 44 Ca -0.05 0.44 0.15 0.00 -2.02 0.00 0.00 58.31 56.83 2a8v n LYS 44 Cb 0.37 -1.88 0.76 0.00 -0.02 0.00 0.00 35.03 34.25 2a8v n LYS 44 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 2a8v n SER 45 N -2.25 0.26 0.00 4.39 3.41 -0.68 -4.86 113.62 113.89 2a8v n SER 45 Ca 0.02 -0.66 0.00 0.00 -0.26 0.00 0.00 58.87 57.97 2a8v n SER 45 Cb 0.22 -0.11 0.00 0.00 -0.26 0.00 0.00 64.21 64.07 2a8v n SER 45 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2a8v n GLY 46 N 1.18 0.78 3.96 5.00 0.00 -0.29 -5.08 105.19 110.74 2a8v n GLY 46 Ca 0.18 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.97 2a8v n GLY 46 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2a8v s GLU 47 N -0.61 3.03 0.22 1.61 2.56 -0.93 -5.03 118.70 119.55 2a8v s GLU 47 Ca 0.00 -0.54 -0.12 0.00 0.00 0.00 0.00 54.97 54.31 2a8v s GLU 47 Cb 0.00 -2.57 -0.07 0.00 2.00 0.00 0.00 34.13 33.48 2a8v s GLU 47 CO 0.00 -0.28 0.58 -0.51 -0.56 0.00 0.00 175.26 174.49 2a8v s ASP 48 N -4.23 6.71 0.06 -1.70 1.01 -1.26 -4.20 116.67 113.06 2a8v s ASP 48 Ca 0.49 1.02 0.05 0.00 0.71 0.00 0.00 52.55 54.81 2a8v s ASP 48 Cb -0.10 -2.27 -0.03 0.00 1.01 0.00 0.00 42.92 41.54 2a8v s ASP 48 CO 0.37 -0.04 -0.13 0.27 0.21 0.00 0.00 175.17 175.85 2a8v s ILE 49 N -1.74 1.03 0.24 0.77 -4.36 -1.26 -4.58 121.20 111.29 2a8v s ILE 49 Ca 0.46 -1.20 0.06 0.00 -0.26 0.00 0.00 60.65 59.71 2a8v s ILE 49 Cb -0.12 -0.99 -0.05 0.00 1.25 0.00 0.00 42.46 42.55 2a8v s ILE 49 CO 0.20 -0.19 -0.08 -0.36 0.24 0.00 0.00 174.94 174.74 2a8v s PHE 50 N -1.18 1.76 0.37 1.37 0.40 -0.75 -0.97 117.98 118.97 2a8v s PHE 50 Ca -0.02 -0.70 -0.05 0.00 -0.60 0.00 0.00 56.93 55.56 2a8v s PHE 50 Cb -0.09 -0.94 0.02 0.00 0.51 0.00 0.00 43.02 42.52 2a8v s PHE 50 CO 0.02 0.24 0.57 0.41 0.70 0.00 0.00 175.22 177.16 2a8v n GLY 51 N -0.46 1.80 3.64 4.36 0.00 -0.64 -1.49 105.19 112.41 2a8v n GLY 51 Ca -0.07 -1.53 -0.01 0.00 0.00 0.00 0.00 46.02 44.41 2a8v n GLY 51 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2a8v s ASP 52 N -3.18 -0.12 0.00 1.61 1.47 -1.26 -2.29 116.67 112.89 2a8v s ASP 52 Ca 0.26 -0.18 0.00 0.00 1.18 0.00 0.00 52.55 53.82 2a8v s ASP 52 Cb -0.02 0.26 0.00 0.00 -0.34 0.00 0.00 42.92 42.82 2a8v s ASP 52 CO 0.19 -0.47 0.00 0.61 0.68 0.00 0.00 175.17 176.18 2a8v n GLY 53 N -0.41 -1.35 3.46 2.12 0.00 -0.70 -4.81 105.19 103.51 2a8v n GLY 53 Ca -0.07 -1.12 -0.38 0.00 0.00 0.00 0.00 46.02 44.46 2a8v n GLY 53 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2a8v s VAL 54 N -3.00 4.64 -0.36 1.61 0.11 0.16 -0.92 120.40 122.64 2a8v s VAL 54 Ca 0.00 -0.27 -0.27 0.00 -2.93 0.00 0.00 61.98 58.51 2a8v s VAL 54 Cb 0.00 -3.30 -0.04 0.00 -1.53 0.00 0.00 36.38 31.51 2a8v s VAL 54 CO 0.00 0.16 2.14 -0.22 -3.33 0.00 0.00 175.10 173.85 2a8v s LEU 55 N 1.64 3.43 -0.14 2.54 2.96 -0.75 -1.17 118.68 127.19 2a8v s LEU 55 Ca 0.05 1.37 -0.04 0.00 -0.22 0.00 0.00 54.13 55.30 2a8v s LEU 55 Cb -0.16 -3.14 -0.03 0.00 0.50 0.00 0.00 46.19 43.36 2a8v s LEU 55 CO 0.06 -2.20 0.01 -0.70 -1.32 0.00 0.00 176.35 172.20 2a8v s GLU 56 N 6.80 3.49 0.04 1.98 2.12 -0.77 -2.97 118.70 129.39 2a8v s GLU 56 Ca 0.92 -0.42 0.00 0.00 0.36 0.00 0.00 54.97 55.83 2a8v s GLU 56 Cb -0.24 -2.96 -0.04 0.00 0.26 0.00 0.00 34.13 31.15 2a8v s GLU 56 CO 0.31 0.44 0.15 0.42 -0.54 0.00 0.00 175.26 176.04 2a8v s ILE 57 N -0.15 5.05 0.02 -3.70 1.09 -1.26 -1.45 121.20 120.80 2a8v s ILE 57 Ca 0.05 -0.45 -0.01 0.00 -1.10 0.00 0.00 60.65 59.14 2a8v s ILE 57 Cb -0.12 -3.41 -0.04 0.00 -1.06 0.00 0.00 42.46 37.83 2a8v s ILE 57 CO 0.02 0.21 0.17 -0.76 -0.10 0.00 0.00 174.94 174.48 2a8v s LEU 58 N -2.22 4.25 0.39 2.97 2.01 0.13 -4.96 118.68 121.25 2a8v s LEU 58 Ca 0.30 0.26 0.24 0.00 0.01 0.00 0.00 54.13 54.94 2a8v s LEU 58 Cb -0.13 -2.68 1.34 0.00 0.01 0.00 0.00 46.19 44.73 2a8v s LEU 58 CO 0.22 0.22 1.61 1.56 1.01 0.00 0.00 176.35 180.97 2a8v h GLN 59 N 3.54 0.08 -0.01 1.70 4.20 -2.00 0.57 115.11 123.19 2a8v h GLN 59 Ca -0.47 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.24 2a8v h GLN 59 Cb 1.17 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.94 2a8v h GLN 59 CO 0.70 0.05 0.02 -0.44 -0.67 0.00 0.00 178.83 178.50 2a8v h ASP 60 N 0.09 0.00 0.00 1.46 3.32 -2.05 -3.46 116.42 115.78 2a8v h ASP 60 Ca 0.82 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.87 2a8v h ASP 60 Cb 2.32 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.87 2a8v h ASP 60 CO -0.60 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 177.53 2a8v n GLY 61 N -1.29 1.98 3.96 2.75 0.00 0.20 -5.08 105.19 107.72 2a8v n GLY 61 Ca -0.03 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.81 2a8v n GLY 61 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2a8v s PHE 62 N -2.01 2.71 0.28 1.61 -0.12 -1.25 -4.02 117.98 115.18 2a8v s PHE 62 Ca 0.00 -0.45 -0.10 0.00 -0.05 0.00 0.00 56.93 56.33 2a8v s PHE 62 Cb 0.00 -2.30 0.00 0.00 -0.63 0.00 0.00 43.02 40.09 2a8v s PHE 62 CO 0.00 -0.34 0.49 0.20 -0.05 0.00 0.00 175.22 175.52 2a8v s GLY 63 N -4.28 0.76 -0.02 1.99 0.00 -0.07 0.18 107.32 105.88 2a8v s GLY 63 Ca 0.53 -1.04 0.04 0.00 0.00 0.00 0.00 44.72 44.25 2a8v s GLY 63 CO 0.31 -0.71 -0.14 -1.36 0.00 0.00 0.00 173.10 171.21 2a8v s PHE 64 N -3.66 1.27 -0.45 1.90 0.40 -0.53 0.16 117.98 117.07 2a8v s PHE 64 Ca 0.24 -0.26 -0.29 0.00 -0.60 0.00 0.00 56.93 56.02 2a8v s PHE 64 Cb -0.01 -0.83 0.02 0.00 0.51 0.00 0.00 43.02 42.71 2a8v s PHE 64 CO 0.12 -0.04 1.30 -0.51 0.70 0.00 0.00 175.22 176.78 2a8v s LEU 65 N -0.24 3.59 0.63 -0.37 1.02 0.12 -1.85 118.68 121.58 2a8v s LEU 65 Ca 0.04 0.62 -0.09 0.00 0.02 0.00 0.00 54.13 54.72 2a8v s LEU 65 Cb -0.06 -3.50 -0.00 0.00 0.02 0.00 0.00 46.19 42.64 2a8v s LEU 65 CO -0.00 -1.38 0.99 -0.13 0.02 0.00 0.00 176.35 175.84 2a8v s ARG 66 N 4.79 3.09 0.14 1.70 1.81 -0.31 -2.65 118.95 127.51 2a8v s ARG 66 Ca 0.55 0.33 0.10 0.00 -1.72 0.00 0.00 55.73 54.99 2a8v s ARG 66 Cb -0.11 -2.15 -0.04 0.00 -0.45 0.00 0.00 34.95 32.20 2a8v s ARG 66 CO 0.32 -0.74 -0.21 -1.54 -0.68 0.00 0.00 175.30 172.44 2a8v s SER 67 N -4.28 3.64 0.19 0.23 1.04 -1.26 0.39 113.70 113.66 2a8v s SER 67 Ca 0.55 -0.68 -0.05 0.00 0.48 0.00 0.00 55.95 56.25 2a8v s SER 67 Cb -0.11 -0.40 0.11 0.00 0.10 0.00 0.00 66.02 65.72 2a8v s SER 67 CO 0.49 0.16 1.55 0.00 0.98 0.00 0.00 173.24 176.42 2a8v h ALA 68 N 3.64 0.74 -0.63 5.32 0.00 -1.96 0.91 119.26 127.28 2a8v h ALA 68 Ca -0.49 -0.44 0.12 0.00 0.00 0.00 0.00 54.91 54.09 2a8v h ALA 68 Cb 1.18 -0.12 -0.12 0.00 0.00 0.00 0.00 17.79 18.73 2a8v h ALA 68 CO 0.44 0.66 -0.27 0.22 0.00 0.00 0.00 179.25 180.31 2a8v h ASP 69 N 0.60 -0.94 -0.31 0.00 1.82 -2.00 1.07 116.42 116.67 2a8v h ASP 69 Ca 0.05 0.22 -0.15 0.00 -0.39 0.00 0.00 57.03 56.76 2a8v h ASP 69 Cb 0.92 0.51 -0.09 0.00 0.68 0.00 0.00 39.33 41.35 2a8v h ASP 69 CO 0.08 -0.27 0.19 -0.24 -1.61 0.00 0.00 179.24 177.39 2a8v n SER 70 N -5.45 3.19 -2.87 2.28 2.88 -1.14 -4.81 113.62 107.70 2a8v n SER 70 Ca 0.06 -2.49 -0.17 0.00 -1.33 0.00 0.00 58.87 54.94 2a8v n SER 70 Cb 0.35 -0.60 -0.00 0.00 -0.75 0.00 0.00 64.21 63.21 2a8v n SER 70 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2a8v n SER 71 N -0.00 -3.69 -2.86 -3.46 2.88 0.37 -0.92 113.62 105.93 2a8v n SER 71 Ca 0.18 -0.06 -0.20 0.00 -1.33 0.00 0.00 58.87 57.47 2a8v n SER 71 Cb 0.85 -3.10 0.05 0.00 -0.75 0.00 0.00 64.21 61.26 2a8v n SER 71 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 2a8v n TYR 72 N -3.60 -2.06 -4.29 0.66 4.01 0.31 -4.96 117.16 107.23 2a8v n TYR 72 Ca -0.08 0.65 -0.21 0.00 -0.16 0.00 0.00 57.90 58.10 2a8v n TYR 72 Cb 0.57 -4.22 -0.12 0.00 -0.31 0.00 0.00 39.34 35.27 2a8v n TYR 72 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2a8v s LEU 73 N -6.07 2.38 -0.42 7.72 1.43 -0.10 -4.88 118.68 118.75 2a8v s LEU 73 Ca 0.38 -0.78 -0.44 0.00 -1.03 0.00 0.00 54.13 52.25 2a8v s LEU 73 Cb -0.17 -0.77 -0.18 0.00 0.03 0.00 0.00 46.19 45.11 2a8v s LEU 73 CO 0.46 -0.03 1.71 0.00 0.23 0.00 0.00 176.35 178.72 2a8v n ALA 74 N 0.65 -0.76 -2.18 4.21 0.00 -1.26 -4.73 120.51 116.43 2a8v n ALA 74 Ca -0.16 0.42 -0.11 0.00 0.00 0.00 0.00 53.44 53.59 2a8v n ALA 74 Cb 0.56 -2.06 -0.10 0.00 0.00 0.00 0.00 19.45 17.85 2a8v n ALA 74 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2a8v s GLY 75 N 3.54 1.25 0.57 0.00 0.00 -1.26 -5.05 107.32 106.37 2a8v s GLY 75 Ca 1.04 -1.60 0.27 0.00 0.00 0.00 0.00 44.72 44.42 2a8v s GLY 75 CO 0.74 -1.40 2.19 -0.56 0.00 0.00 0.00 173.10 174.08 2a8v h PRO 76 N 2.72 0.00 -0.22 2.90 0.13 -1.99 -2.00 132.00 133.55 2a8v h PRO 76 Ca -0.36 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 2a8v h PRO 76 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2a8v h PRO 76 CO 0.56 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.08 2a8v n ASP 77 N -3.99 1.93 -4.74 1.44 8.00 -1.26 -4.82 116.55 113.11 2a8v n ASP 77 Ca -0.02 -1.78 -0.39 0.00 0.71 0.00 0.00 54.79 53.32 2a8v n ASP 77 Cb 0.15 -0.14 0.03 0.00 -0.02 0.00 0.00 41.12 41.15 2a8v n ASP 77 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2a8v n ASP 78 N 0.50 2.81 -4.53 -2.24 8.00 -0.75 -4.90 116.55 115.45 2a8v n ASP 78 Ca 0.16 1.02 -0.35 0.00 0.71 0.00 0.00 54.79 56.33 2a8v n ASP 78 Cb 0.36 -1.58 -0.11 0.00 -0.02 0.00 0.00 41.12 39.77 2a8v n ASP 78 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2a8v s ILE 79 N -1.26 4.40 0.14 0.53 1.01 -1.09 -4.07 121.20 120.87 2a8v s ILE 79 Ca 0.68 -0.16 -0.30 0.00 0.00 0.00 0.00 60.65 60.87 2a8v s ILE 79 Cb -0.43 -3.00 -0.08 0.00 0.01 0.00 0.00 42.46 38.96 2a8v s ILE 79 CO 0.52 0.41 1.28 -0.47 0.00 0.00 0.00 174.94 176.68 2a8v s TYR 80 N 0.90 3.34 -0.22 3.97 5.04 -0.33 0.16 117.35 130.22 2a8v s TYR 80 Ca 0.03 1.22 0.02 0.00 -2.44 0.00 0.00 57.07 55.89 2a8v s TYR 80 Cb -0.14 -3.54 0.04 0.00 0.35 0.00 0.00 41.96 38.67 2a8v s TYR 80 CO 0.02 -1.71 -0.12 0.08 -1.34 0.00 0.00 175.55 172.48 2a8v s VAL 81 N 0.53 1.90 0.23 3.14 1.01 0.41 -1.59 120.40 126.03 2a8v s VAL 81 Ca 0.58 -1.20 -0.30 0.00 0.00 0.00 0.00 61.98 61.06 2a8v s VAL 81 Cb -0.34 -1.93 -0.09 0.00 0.00 0.00 0.00 36.38 34.02 2a8v s VAL 81 CO 0.34 0.18 1.22 -0.94 0.00 0.00 0.00 175.10 175.89 2a8v s SER 82 N 1.28 7.03 0.39 3.32 1.04 -1.26 -0.90 113.70 124.60 2a8v s SER 82 Ca -0.03 2.34 0.33 0.00 0.48 0.00 0.00 55.95 59.08 2a8v s SER 82 Cb -0.17 -2.62 1.24 0.00 0.10 0.00 0.00 66.02 64.57 2a8v s SER 82 CO -0.08 -0.38 1.18 -2.65 0.98 0.00 0.00 173.24 172.28 2a8v n PRO 83 N 2.02 -0.01 0.12 4.02 -0.02 -1.26 -0.33 135.00 139.54 2a8v n PRO 83 Ca 0.03 0.87 -0.05 0.00 -2.02 0.00 0.00 63.50 62.32 2a8v n PRO 83 Cb 0.44 -1.88 -0.03 0.00 -0.02 0.00 0.00 33.50 32.01 2a8v n PRO 83 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 2a8v h SER 84 N 0.00 -0.35 -0.72 2.55 0.02 -1.90 -2.98 113.55 110.17 2a8v h SER 84 Ca 0.69 0.02 0.15 0.00 -0.84 0.00 0.00 61.79 61.82 2a8v h SER 84 Cb 2.58 0.10 -0.13 0.00 0.14 0.00 0.00 62.40 65.10 2a8v h SER 84 CO -0.14 -0.21 -0.08 1.56 -1.14 0.00 0.00 176.83 176.82 2a8v h GLN 85 N -0.34 0.05 -0.35 3.45 4.20 -1.05 0.47 115.11 121.54 2a8v h GLN 85 Ca -0.03 -0.00 0.10 0.00 0.06 0.00 0.00 58.65 58.78 2a8v h GLN 85 Cb 0.27 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 2a8v h GLN 85 CO 0.03 0.03 0.33 0.82 -0.67 0.00 0.00 178.83 179.37 2a8v h ILE 86 N 0.05 0.51 0.00 2.54 5.03 -1.55 -2.44 117.51 121.66 2a8v h ILE 86 Ca 0.37 0.00 -0.04 0.00 -0.12 0.00 0.00 64.86 65.07 2a8v h ILE 86 Cb 0.61 0.74 -0.01 0.00 -3.03 0.00 0.00 36.82 35.14 2a8v h ILE 86 CO -0.68 0.00 -0.36 0.03 -0.68 0.00 0.00 178.15 176.46 2a8v h ARG 87 N 0.00 0.00 0.00 2.37 3.08 0.02 -2.34 114.38 117.51 2a8v h ARG 87 Ca 0.17 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.22 2a8v h ARG 87 Cb 0.83 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.88 2a8v h ARG 87 CO -0.00 0.45 0.25 0.54 -1.07 0.00 0.00 179.97 180.14 2a8v n ARG 88 N -4.63 0.04 0.00 0.04 1.74 -0.22 -0.65 116.66 112.97 2a8v n ARG 88 Ca -0.10 0.42 0.00 0.00 -0.77 0.00 0.00 57.85 57.39 2a8v n ARG 88 Cb 0.31 -1.88 0.00 0.00 -1.02 0.00 0.00 32.46 29.87 2a8v n ARG 88 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 2a8v n PHE 89 N -1.63 0.00 -2.42 -1.55 3.01 -1.04 -4.99 117.46 108.83 2a8v n PHE 89 Ca -0.00 -0.08 -0.13 0.00 1.01 0.00 0.00 57.45 58.24 2a8v n PHE 89 Cb 0.26 -0.01 -0.01 0.00 -0.01 0.00 0.00 39.48 39.72 2a8v n PHE 89 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 2a8v n ASN 90 N -0.08 -4.07 -4.68 4.37 5.15 0.17 -4.90 115.26 111.21 2a8v n ASN 90 Ca 0.00 0.18 -0.31 0.00 -0.60 0.00 0.00 54.58 53.85 2a8v n ASN 90 Cb 0.17 -3.46 0.15 0.00 -0.53 0.00 0.00 39.78 36.11 2a8v n ASN 90 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2a8v s LEU 91 N -5.62 2.61 0.10 1.20 1.43 -0.90 -5.04 118.68 112.45 2a8v s LEU 91 Ca 0.00 1.94 -0.11 0.00 -1.03 0.00 0.00 54.13 54.93 2a8v s LEU 91 Cb 0.00 -4.35 0.01 0.00 0.03 0.00 0.00 46.19 41.88 2a8v s LEU 91 CO 0.00 -2.88 0.26 -0.13 0.23 0.00 0.00 176.35 173.82 2a8v s ARG 92 N -4.73 0.91 -0.23 1.70 1.81 -1.26 -4.93 118.95 112.21 2a8v s ARG 92 Ca 0.65 -0.87 -0.38 0.00 -1.72 0.00 0.00 55.73 53.41 2a8v s ARG 92 Cb -0.21 0.38 -0.14 0.00 -0.45 0.00 0.00 34.95 34.53 2a8v s ARG 92 CO 0.58 -0.31 1.84 2.41 -0.68 0.00 0.00 175.30 179.14 2a8v n THR 93 N -0.09 0.39 0.00 0.02 -1.04 -1.18 -0.76 114.28 111.62 2a8v n THR 93 Ca -0.15 -0.09 0.00 0.00 -2.04 0.00 0.00 64.05 61.76 2a8v n THR 93 Cb 0.63 -1.49 0.00 0.00 -1.82 0.00 0.00 70.33 67.65 2a8v n THR 93 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2a8v n GLY 94 N 4.55 2.16 3.51 3.41 0.00 -1.16 -5.00 105.19 112.67 2a8v n GLY 94 Ca 0.27 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.00 2a8v n GLY 94 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2a8v s ASP 95 N -1.79 1.18 -0.07 1.61 1.11 0.06 -4.80 116.67 113.97 2a8v s ASP 95 Ca 0.00 1.60 0.02 0.00 0.18 0.00 0.00 52.55 54.35 2a8v s ASP 95 Cb 0.00 -2.34 0.01 0.00 1.07 0.00 0.00 42.92 41.67 2a8v s ASP 95 CO 0.00 -4.09 -0.12 -0.89 1.18 0.00 0.00 175.17 171.25 2a8v s THR 96 N -2.48 1.15 0.04 -1.27 2.01 -1.26 -1.81 115.64 112.02 2a8v s THR 96 Ca 0.68 -0.47 0.02 0.00 0.31 0.00 0.00 61.69 62.23 2a8v s THR 96 Cb -0.25 -1.06 -0.02 0.00 0.01 0.00 0.00 72.50 71.18 2a8v s THR 96 CO 0.64 0.36 -0.08 -0.63 -0.69 0.00 0.00 174.62 174.21 2a8v s ILE 97 N 0.76 0.60 0.04 1.82 1.01 -0.10 -4.94 121.20 120.39 2a8v s ILE 97 Ca -0.13 -1.09 -0.03 0.00 0.00 0.00 0.00 60.65 59.40 2a8v s ILE 97 Cb -0.16 -0.65 -0.02 0.00 0.01 0.00 0.00 42.46 41.64 2a8v s ILE 97 CO 0.03 -0.36 0.02 -0.44 0.00 0.00 0.00 174.94 174.19 2a8v s SER 98 N -1.58 0.31 0.00 3.58 0.01 -1.26 -1.72 113.70 113.04 2a8v s SER 98 Ca -0.09 -0.71 0.00 0.00 1.31 0.00 0.00 55.95 56.46 2a8v s SER 98 Cb -0.10 0.19 0.00 0.00 0.21 0.00 0.00 66.02 66.32 2a8v s SER 98 CO 0.01 -0.50 0.00 0.61 0.41 0.00 0.00 173.24 173.76 2a8v n GLY 99 N 0.67 -1.70 3.81 3.44 0.00 -0.97 0.14 105.19 110.58 2a8v n GLY 99 Ca -0.18 -1.20 -0.33 0.00 0.00 0.00 0.00 46.02 44.30 2a8v n GLY 99 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2a8v s LYS 100 N -1.80 3.91 0.21 1.61 1.02 -0.06 -1.62 119.74 123.01 2a8v s LYS 100 Ca 0.00 1.22 -0.01 0.00 0.02 0.00 0.00 55.97 57.21 2a8v s LYS 100 Cb 0.00 -2.12 -0.04 0.00 -0.52 0.00 0.00 37.83 35.15 2a8v s LYS 100 CO 0.00 -0.32 0.13 0.96 -0.92 0.00 0.00 175.35 175.20 2a8v s ILE 101 N -2.16 0.05 0.00 2.17 -4.36 -0.15 0.94 121.20 117.70 2a8v s ILE 101 Ca 0.64 -2.00 -0.01 0.00 -0.26 0.00 0.00 60.65 59.02 2a8v s ILE 101 Cb -0.13 -2.51 -0.01 0.00 1.25 0.00 0.00 42.46 41.06 2a8v s ILE 101 CO 0.20 0.00 0.01 0.00 0.24 0.00 0.00 174.94 175.39 2a8v s ARG 102 N -4.14 0.20 0.99 0.37 1.70 -0.08 -4.31 118.95 113.69 2a8v s ARG 102 Ca 0.39 -0.30 -0.11 0.00 -0.47 0.00 0.00 55.73 55.24 2a8v s ARG 102 Cb 0.07 0.08 0.18 0.00 -0.57 0.00 0.00 34.95 34.71 2a8v s ARG 102 CO 0.12 -0.04 1.09 -1.25 -1.08 0.00 0.00 175.30 174.15 2a8v s PRO 103 N -0.79 0.47 0.84 3.89 0.04 -1.26 -0.89 135.00 137.31 2a8v s PRO 103 Ca -0.09 1.09 -0.11 0.00 0.04 0.00 0.00 61.00 61.94 2a8v s PRO 103 Cb -0.05 -1.70 0.10 0.00 0.04 0.00 0.00 34.50 32.89 2a8v s PRO 103 CO -0.00 -2.86 1.13 -1.25 0.04 0.00 0.00 177.00 174.06 2a8v s PRO 104 N -4.68 1.63 0.47 0.56 0.04 -1.24 -4.67 135.00 127.12 2a8v s PRO 104 Ca 0.66 1.40 0.06 0.00 0.04 0.00 0.00 61.00 63.17 2a8v s PRO 104 Cb -0.22 -1.81 -0.01 0.00 0.04 0.00 0.00 34.50 32.50 2a8v s PRO 104 CO 0.60 -2.15 0.29 0.15 0.04 0.00 0.00 177.00 175.93 2a8v s LYS 105 N -4.70 2.29 0.01 4.56 1.02 -1.26 -4.97 119.74 116.69 2a8v s LYS 105 Ca 0.65 -1.89 -0.37 0.00 0.02 0.00 0.00 55.97 54.38 2a8v s LYS 105 Cb -0.21 -2.07 -0.16 0.00 -0.52 0.00 0.00 37.83 34.87 2a8v s LYS 105 CO 0.56 -0.34 1.51 0.39 -0.92 0.00 0.00 175.35 176.55 2a8v n GLU 106 N -1.50 1.41 0.00 1.68 1.02 -1.26 -0.61 120.64 121.37 2a8v n GLU 106 Ca -0.02 0.51 0.00 0.00 -0.02 0.00 0.00 57.16 57.63 2a8v n GLU 106 Cb 0.64 -2.20 0.00 0.00 -0.02 0.00 0.00 31.44 29.86 2a8v n GLU 106 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2a8v n GLY 107 N 3.18 3.42 3.84 0.62 0.00 -1.26 -5.05 105.19 109.94 2a8v n GLY 107 Ca 0.20 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.95 2a8v n GLY 107 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2a8v s GLU 108 N -0.88 3.07 0.00 1.61 2.02 0.22 -5.02 118.70 119.72 2a8v s GLU 108 Ca 0.00 -0.75 0.02 0.00 0.02 0.00 0.00 54.97 54.26 2a8v s GLU 108 Cb 0.00 -2.76 -0.01 0.00 0.10 0.00 0.00 34.13 31.46 2a8v s GLU 108 CO 0.00 0.51 0.24 0.54 0.02 0.00 0.00 175.26 176.57 2a8v n ARG 109 N -0.27 4.18 -4.32 1.61 1.74 -1.26 -4.54 116.66 113.80 2a8v n ARG 109 Ca -0.08 -0.20 -0.20 0.00 -0.77 0.00 0.00 57.85 56.61 2a8v n ARG 109 Cb 0.54 -0.73 -0.11 0.00 -1.02 0.00 0.00 32.46 31.14 2a8v n ARG 109 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 2a8v s TYR 110 N -0.88 1.68 0.82 -1.55 1.51 -1.26 -4.89 117.35 112.78 2a8v s TYR 110 Ca 0.01 -0.53 -0.11 0.00 -1.01 0.00 0.00 57.07 55.44 2a8v s TYR 110 Cb 0.02 -0.83 0.09 0.00 -0.11 0.00 0.00 41.96 41.13 2a8v s TYR 110 CO 0.07 0.30 1.12 -0.06 -1.11 0.00 0.00 175.55 175.86 2a8v s PHE 111 N -2.41 2.15 0.03 2.71 0.40 -1.26 -3.64 117.98 115.97 2a8v s PHE 111 Ca 0.17 1.66 0.03 0.00 -0.60 0.00 0.00 56.93 58.18 2a8v s PHE 111 Cb -0.04 -3.20 -0.02 0.00 0.51 0.00 0.00 43.02 40.28 2a8v s PHE 111 CO 0.06 -2.26 -0.09 0.00 0.70 0.00 0.00 175.22 173.63 2a8v s ALA 112 N -2.72 0.72 -0.18 5.36 0.00 -0.06 -1.19 121.76 123.69 2a8v s ALA 112 Ca 0.64 -0.62 -0.29 0.00 0.00 0.00 0.00 51.96 51.69 2a8v s ALA 112 Cb -0.20 -0.08 -0.02 0.00 0.00 0.00 0.00 23.12 22.82 2a8v s ALA 112 CO 0.56 0.10 1.45 -1.17 0.00 0.00 0.00 175.76 176.69 2a8v s LEU 113 N -0.99 4.08 -0.18 0.00 2.96 -0.62 -0.90 118.68 123.04 2a8v s LEU 113 Ca -0.03 1.71 -0.21 0.00 -0.22 0.00 0.00 54.13 55.38 2a8v s LEU 113 Cb -0.07 -3.54 -0.18 0.00 0.50 0.00 0.00 46.19 42.91 2a8v s LEU 113 CO 0.00 -0.98 0.27 -0.07 -1.32 0.00 0.00 176.35 174.26 2a8v h LEU 114 N 10.55 0.00 -7.45 -0.68 4.07 0.26 -3.47 115.31 118.58 2a8v h LEU 114 Ca -0.31 -0.53 -0.43 0.00 0.08 0.00 0.00 57.88 56.69 2a8v h LEU 114 Cb 1.13 0.00 -0.38 0.00 1.08 0.00 0.00 40.66 42.49 2a8v h LEU 114 CO 0.99 1.25 -0.76 -0.54 -1.08 0.00 0.00 178.44 178.29 2a8v s LYS 115 N -2.28 0.53 0.78 1.13 1.02 -1.04 -4.94 119.74 114.94 2a8v s LYS 115 Ca -0.24 0.13 -0.11 0.00 0.02 0.00 0.00 55.97 55.78 2a8v s LYS 115 Cb 0.03 -0.94 0.06 0.00 -0.52 0.00 0.00 37.83 36.46 2a8v s LYS 115 CO 0.54 -0.31 1.08 0.08 -0.92 0.00 0.00 175.35 175.82 2a8v s VAL 116 N 2.00 3.35 0.00 3.17 1.01 -1.26 -0.88 120.40 127.78 2a8v s VAL 116 Ca 0.05 0.44 0.00 0.00 0.00 0.00 0.00 61.98 62.47 2a8v s VAL 116 Cb -0.12 -3.02 0.00 0.00 0.00 0.00 0.00 36.38 33.24 2a8v s VAL 116 CO -0.05 -0.57 0.00 0.59 0.00 0.00 0.00 175.10 175.07 2a8v n ASN 117 N -3.48 0.00 0.00 3.32 3.02 0.36 -4.80 115.26 113.69 2a8v n ASN 117 Ca 0.08 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.63 2a8v n ASN 117 Cb 0.54 -0.26 0.00 0.00 -0.61 0.00 0.00 39.78 39.45 2a8v n ASN 117 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02