#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 6.34 0.22 6.12 0.02 -1.26 -2.09 114.94 124.29 2a8v s ASN 2 Ca 0.00 0.40 -0.09 0.00 -1.02 0.00 0.00 52.86 52.14 2a8v s ASN 2 Cb 0.00 -2.10 0.34 0.00 0.02 0.00 0.00 41.25 39.50 2a8v s ASN 2 CO 0.00 0.26 1.66 0.25 0.02 0.00 0.00 177.10 179.29 2a8v h LEU 3 N 5.93 -0.25 -1.14 0.60 5.85 -0.46 0.83 115.31 126.68 2a8v h LEU 3 Ca -0.47 0.16 -0.05 0.00 0.84 0.00 0.00 57.88 58.36 2a8v h LEU 3 Cb 1.19 0.27 -0.02 0.00 0.37 0.00 0.00 40.66 42.47 2a8v h LEU 3 CO 0.68 -0.11 0.08 0.74 -0.34 0.00 0.00 178.44 179.49 2a8v h THR 4 N 0.14 1.21 0.25 1.05 2.02 -1.93 0.20 112.91 115.84 2a8v h THR 4 Ca 0.35 -0.77 0.01 0.00 0.77 0.00 0.00 66.41 66.76 2a8v h THR 4 Cb 0.58 0.78 -0.04 0.00 -1.74 0.00 0.00 68.15 67.73 2a8v h THR 4 CO -0.55 0.28 -0.43 -0.08 0.37 0.00 0.00 175.52 175.11 2a8v h GLU 5 N 0.67 -0.73 0.05 6.66 4.81 0.21 -2.82 114.58 123.43 2a8v h GLU 5 Ca 0.15 0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.43 2a8v h GLU 5 Cb 0.29 0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.83 2a8v h GLU 5 CO 0.00 -0.49 -0.06 -0.07 -0.73 0.00 0.00 179.01 177.66 2a8v h LEU 6 N -0.76 -0.17 -1.64 1.64 3.38 -0.51 -2.54 115.31 114.71 2a8v h LEU 6 Ca -0.01 0.02 0.43 0.00 0.09 0.00 0.00 57.88 58.41 2a8v h LEU 6 Cb 0.73 0.06 -0.06 0.00 0.09 0.00 0.00 40.66 41.48 2a8v h LEU 6 CO -0.17 -0.10 1.26 0.50 0.09 0.00 0.00 178.44 180.02 2a8v h LYS 7 N -0.14 0.00 0.00 1.13 3.64 -0.72 1.02 116.57 121.50 2a8v h LYS 7 Ca 0.01 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 2a8v h LYS 7 Cb 0.14 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.96 2a8v h LYS 7 CO -0.03 0.00 -1.09 0.09 -2.27 0.00 0.00 179.45 176.15 2a8v n ASN 8 N -3.68 0.76 -4.71 4.20 3.02 -0.96 -4.95 115.26 108.94 2a8v n ASN 8 Ca 0.33 -0.69 -0.42 0.00 -0.03 0.00 0.00 54.58 53.77 2a8v n ASN 8 Cb 1.71 1.04 -0.03 0.00 -0.61 0.00 0.00 39.78 41.90 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 -3.10 4.20 0.24 3.41 2.01 0.35 -4.97 115.64 117.79 2a8v s THR 9 Ca 0.06 1.57 -0.28 0.00 0.31 0.00 0.00 61.69 63.34 2a8v s THR 9 Cb 0.16 -4.01 -0.16 0.00 0.01 0.00 0.00 72.50 68.50 2a8v s THR 9 CO 0.85 0.10 0.80 -2.65 -0.69 0.00 0.00 174.62 173.03 2a8v n PRO 10 N 4.13 0.72 -0.23 4.92 -0.02 -1.26 -4.65 135.00 138.61 2a8v n PRO 10 Ca 0.09 0.25 -0.00 0.00 -2.02 0.00 0.00 63.50 61.82 2a8v n PRO 10 Cb 0.47 -1.47 0.12 0.00 -0.02 0.00 0.00 33.50 32.60 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 1.60 0.88 -0.33 -1.45 2.07 -1.95 -0.24 116.25 116.84 2a8v h VAL 11 Ca -0.35 -0.20 0.06 0.00 0.82 0.00 0.00 66.70 67.03 2a8v h VAL 11 Cb 1.39 0.23 -0.05 0.00 -1.52 0.00 0.00 31.29 31.34 2a8v h VAL 11 CO 0.60 0.11 -0.01 0.77 0.02 0.00 0.00 177.57 179.05 2a8v h SER 12 N 0.60 -0.16 -0.61 0.57 4.64 -2.00 0.26 113.55 116.85 2a8v h SER 12 Ca 0.32 0.08 -0.06 0.00 -0.47 0.00 0.00 61.79 61.66 2a8v h SER 12 Cb 0.30 0.14 -0.03 0.00 -0.31 0.00 0.00 62.40 62.50 2a8v h SER 12 CO -0.24 -0.04 0.17 -0.08 -0.87 0.00 0.00 176.83 175.76 2a8v h GLU 13 N 0.08 0.99 -0.50 4.77 4.81 -1.75 -2.24 114.58 120.75 2a8v h GLU 13 Ca 0.16 -0.22 -0.07 0.00 -0.13 0.00 0.00 59.36 59.10 2a8v h GLU 13 Cb 0.22 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.44 2a8v h GLU 13 CO -0.28 0.87 0.02 -0.07 -0.73 0.00 0.00 179.01 178.83 2a8v h LEU 14 N 0.95 0.78 -0.02 1.64 3.38 -0.12 -1.35 115.31 120.57 2a8v h LEU 14 Ca 0.21 -0.18 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 2a8v h LEU 14 Cb 0.32 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 2a8v h LEU 14 CO -0.00 0.84 0.01 0.40 0.09 0.00 0.00 178.44 179.78 2a8v h ILE 15 N 0.77 1.03 0.61 1.22 2.04 0.04 -1.06 117.51 122.15 2a8v h ILE 15 Ca 0.15 -0.09 -0.03 0.00 1.00 0.00 0.00 64.86 65.89 2a8v h ILE 15 Cb 0.43 1.05 0.00 0.00 -0.74 0.00 0.00 36.82 37.57 2a8v h ILE 15 CO 0.02 0.03 -0.35 0.74 0.00 0.00 0.00 178.15 178.59 2a8v h THR 16 N -0.00 0.00 -1.58 -0.27 2.02 -1.28 -1.64 112.91 110.16 2a8v h THR 16 Ca 0.01 0.00 0.51 0.00 0.77 0.00 0.00 66.41 67.69 2a8v h THR 16 Cb 0.03 0.00 -0.12 0.00 -1.74 0.00 0.00 68.15 66.32 2a8v h THR 16 CO -0.00 0.00 1.07 0.25 0.37 0.00 0.00 175.52 177.21 2a8v h LEU 17 N -0.88 0.13 0.14 2.58 5.85 -1.17 0.23 115.31 122.19 2a8v h LEU 17 Ca -0.08 0.10 -0.32 0.00 0.84 0.00 0.00 57.88 58.41 2a8v h LEU 17 Cb 0.70 0.10 -0.00 0.00 0.37 0.00 0.00 40.66 41.83 2a8v h LEU 17 CO 0.10 -0.16 -1.63 1.23 -0.34 0.00 0.00 178.44 177.64 2a8v h GLY 18 N 0.01 0.35 1.92 3.75 0.00 -0.80 -3.33 103.07 104.97 2a8v h GLY 18 Ca 0.89 -0.89 -0.15 0.00 0.00 0.00 0.00 47.33 47.18 2a8v h GLY 18 CO -0.31 0.78 -0.69 0.83 0.00 0.00 0.00 176.54 177.15 2a8v h GLU 19 N 0.08 0.08 0.00 4.80 5.08 0.32 -1.89 114.58 123.06 2a8v h GLU 19 Ca -0.29 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.01 2a8v h GLU 19 Cb 2.05 0.01 0.00 0.00 0.50 0.00 0.00 28.75 31.32 2a8v h GLU 19 CO 0.17 0.74 0.00 0.09 -1.00 0.00 0.00 179.01 179.00 2a8v n ASN 20 N -3.75 0.00 -0.83 1.42 3.02 -0.09 0.90 115.26 115.93 2a8v n ASN 20 Ca -0.02 0.19 0.07 0.00 -0.03 0.00 0.00 54.58 54.80 2a8v n ASN 20 Cb 0.68 -0.31 0.22 0.00 -0.61 0.00 0.00 39.78 39.76 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 -1.31 2.98 -2.06 3.52 2.81 -0.72 -4.98 117.12 117.36 2a8v n MET 21 Ca 0.04 -2.47 -0.04 0.00 -1.81 0.00 0.00 57.70 53.43 2a8v n MET 21 Cb 0.07 -1.57 0.02 0.00 -0.71 0.00 0.00 33.22 31.03 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 0.12 -0.03 3.18 3.03 0.00 0.26 -5.07 105.19 106.68 2a8v n GLY 22 Ca 0.17 0.01 -0.27 0.00 0.00 0.00 0.00 46.02 45.93 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 -3.46 1.99 0.18 0.99 1.43 -1.16 -4.95 118.68 113.70 2a8v s LEU 23 Ca 0.11 -0.38 -0.05 0.00 -1.03 0.00 0.00 54.13 52.78 2a8v s LEU 23 Cb -0.01 -1.06 -0.06 0.00 0.03 0.00 0.00 46.19 45.09 2a8v s LEU 23 CO 0.25 0.20 0.43 -0.70 0.23 0.00 0.00 176.35 176.76 2a8v s GLU 24 N -0.19 3.63 -0.43 1.70 -6.30 -1.26 -4.50 118.70 111.35 2a8v s GLU 24 Ca 0.01 -0.06 -0.10 0.00 -2.50 0.00 0.00 54.97 52.32 2a8v s GLU 24 Cb -0.10 -2.79 0.01 0.00 0.00 0.00 0.00 34.13 31.25 2a8v s GLU 24 CO 0.01 0.40 0.26 0.09 0.02 0.00 0.00 175.26 176.04 2a8v n ASN 25 N -0.18 -1.69 0.07 -1.70 3.02 -1.26 -4.80 115.26 108.72 2a8v n ASN 25 Ca -0.02 -0.48 0.09 0.00 -0.03 0.00 0.00 54.58 54.14 2a8v n ASN 25 Cb 0.52 -0.62 -0.04 0.00 -0.61 0.00 0.00 39.78 39.03 2a8v n ASN 25 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2a8v n LEU 26 N -2.19 0.72 -0.00 3.41 4.77 -1.26 -3.88 117.00 118.57 2a8v n LEU 26 Ca -0.07 0.29 -0.09 0.00 -0.03 0.00 0.00 56.01 56.11 2a8v n LEU 26 Cb 0.24 -0.01 0.07 0.00 -2.33 0.00 0.00 43.42 41.39 2a8v n LEU 26 CO 0.28 -0.08 0.52 0.00 -1.33 0.00 0.00 177.39 176.79 2a8v h ALA 27 N 1.86 0.76 -0.28 -1.18 0.00 -1.94 -2.49 119.26 115.98 2a8v h ALA 27 Ca -0.05 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.38 2a8v h ALA 27 Cb 1.15 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.85 2a8v h ALA 27 CO 0.01 0.67 0.00 0.54 0.00 0.00 0.00 179.25 180.47 2a8v n ARG 28 N -3.99 2.44 -4.31 0.00 1.74 -1.25 -4.89 116.66 106.40 2a8v n ARG 28 Ca -0.03 -1.34 -0.25 0.00 -0.77 0.00 0.00 57.85 55.47 2a8v n ARG 28 Cb 0.57 -1.66 -0.12 0.00 -1.02 0.00 0.00 32.46 30.23 2a8v n ARG 28 CO 0.00 0.00 0.00 1.41 -1.52 0.00 0.00 177.63 177.52 2a8v s MET 29 N -1.71 1.19 0.39 5.56 1.75 -0.94 -5.12 119.30 120.42 2a8v s MET 29 Ca 0.24 -1.22 -0.27 0.00 -1.25 0.00 0.00 55.69 53.19 2a8v s MET 29 Cb 0.16 -1.48 -0.09 0.00 2.84 0.00 0.00 34.83 36.26 2a8v s MET 29 CO 0.10 0.34 1.33 0.50 -0.65 0.00 0.00 175.02 176.64 2a8v s ARG 30 N -2.02 4.04 0.26 4.11 6.06 -1.26 -4.80 118.95 125.33 2a8v s ARG 30 Ca 0.09 2.22 -0.04 0.00 -2.50 0.00 0.00 55.73 55.50 2a8v s ARG 30 Cb -0.10 -2.83 0.52 0.00 0.06 0.00 0.00 34.95 32.60 2a8v s ARG 30 CO 0.05 -0.46 1.65 -0.22 -2.50 0.00 0.00 175.30 173.82 2a8v h LYS 31 N 2.82 0.17 -0.77 5.12 3.64 -1.99 0.17 116.57 125.73 2a8v h LYS 31 Ca -0.50 -0.01 0.14 0.00 -1.27 0.00 0.00 60.65 59.02 2a8v h LYS 31 Cb 1.24 -0.04 -0.09 0.00 -0.41 0.00 0.00 32.23 32.93 2a8v h LYS 31 CO 0.63 0.11 0.33 1.96 -2.27 0.00 0.00 179.45 180.21 2a8v h GLN 32 N 0.17 0.46 -0.41 1.90 4.20 -2.00 0.12 115.11 119.56 2a8v h GLN 32 Ca 0.45 -0.03 -0.15 0.00 0.06 0.00 0.00 58.65 58.99 2a8v h GLN 32 Cb 0.83 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.49 2a8v h GLN 32 CO -0.62 0.30 -0.33 -0.44 -0.67 0.00 0.00 178.83 177.07 2a8v h ASP 33 N 0.47 0.99 0.32 1.46 3.32 -1.09 -2.27 116.42 119.62 2a8v h ASP 33 Ca 0.42 -0.44 -0.01 0.00 0.02 0.00 0.00 57.03 57.02 2a8v h ASP 33 Cb 0.63 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.89 2a8v h ASP 33 CO -0.40 1.23 -0.31 0.40 -1.72 0.00 0.00 179.24 178.44 2a8v h ILE 34 N 0.77 0.00 -0.72 0.35 2.04 0.14 0.35 117.51 120.44 2a8v h ILE 34 Ca 0.07 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.07 2a8v h ILE 34 Cb 0.92 0.00 -0.14 0.00 -0.74 0.00 0.00 36.82 36.86 2a8v h ILE 34 CO 0.09 0.00 -0.24 0.40 0.00 0.00 0.00 178.15 178.39 2a8v h ILE 35 N -0.62 0.21 0.21 -0.67 2.04 -1.06 0.21 117.51 117.84 2a8v h ILE 35 Ca -0.04 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.82 2a8v h ILE 35 Cb 0.54 0.21 -0.01 0.00 -0.74 0.00 0.00 36.82 36.83 2a8v h ILE 35 CO -0.03 0.00 -0.15 -0.26 0.00 0.00 0.00 178.15 177.71 2a8v h PHE 36 N -0.05 -0.38 -0.49 1.37 -1.00 -1.16 -0.95 116.94 114.28 2a8v h PHE 36 Ca 0.32 -0.00 0.08 0.00 2.81 0.00 0.00 57.97 61.19 2a8v h PHE 36 Cb 0.55 0.14 -0.10 0.00 3.61 0.00 0.00 35.95 40.15 2a8v h PHE 36 CO -0.62 -0.23 -0.38 0.00 -1.61 0.00 0.00 178.31 175.47 2a8v h ALA 37 N 0.41 -0.25 0.43 2.45 0.00 0.20 0.55 119.26 123.07 2a8v h ALA 37 Ca -0.02 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 2a8v h ALA 37 Cb 0.31 0.83 -0.03 0.00 0.00 0.00 0.00 17.79 18.90 2a8v h ALA 37 CO 0.01 -0.77 -0.51 0.82 0.00 0.00 0.00 179.25 178.79 2a8v h ILE 38 N -0.25 0.01 -0.02 0.00 2.04 -0.52 0.92 117.51 119.70 2a8v h ILE 38 Ca 0.18 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.07 2a8v h ILE 38 Cb 0.56 0.01 -0.05 0.00 -0.74 0.00 0.00 36.82 36.60 2a8v h ILE 38 CO -0.62 0.00 -0.34 -0.07 0.00 0.00 0.00 178.15 177.12 2a8v h LEU 39 N -0.97 -1.03 -0.89 1.44 3.38 -0.44 0.55 115.31 117.36 2a8v h LEU 39 Ca -0.05 0.13 0.20 0.00 0.09 0.00 0.00 57.88 58.25 2a8v h LEU 39 Cb 0.86 0.42 -0.12 0.00 0.09 0.00 0.00 40.66 41.91 2a8v h LEU 39 CO -0.11 -0.40 0.41 0.11 0.09 0.00 0.00 178.44 178.55 2a8v h LYS 40 N -0.49 0.45 0.59 1.13 1.57 0.23 0.45 116.57 120.52 2a8v h LYS 40 Ca 0.06 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.79 2a8v h LYS 40 Cb 0.58 -0.10 0.01 0.00 0.08 0.00 0.00 32.23 32.79 2a8v h LYS 40 CO -0.29 0.30 -0.29 0.37 -0.57 0.00 0.00 179.45 178.97 2a8v h GLN 41 N 0.46 -0.77 0.00 3.15 5.75 0.77 -2.49 115.11 121.98 2a8v h GLN 41 Ca 0.54 0.05 0.00 0.00 -0.15 0.00 0.00 58.65 59.09 2a8v h GLN 41 Cb 0.96 0.17 0.00 0.00 1.07 0.00 0.00 27.48 29.68 2a8v h GLN 41 CO -0.48 -0.46 0.38 1.25 -2.65 0.00 0.00 178.83 176.87 2a8v h HIS 42 N -0.96 0.00 0.08 3.99 2.76 0.16 0.43 115.15 121.61 2a8v h HIS 42 Ca -0.08 0.00 -0.27 0.00 -2.20 0.00 0.00 60.37 57.82 2a8v h HIS 42 Cb 0.66 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.61 2a8v h HIS 42 CO -0.01 0.00 -1.31 0.00 -1.30 0.00 0.00 177.93 175.31 2a8v h ALA 43 N 1.23 0.26 -0.32 5.26 0.00 -0.54 -2.71 119.26 122.45 2a8v h ALA 43 Ca 0.00 -1.01 -0.15 0.00 0.00 0.00 0.00 54.91 53.76 2a8v h ALA 43 Cb 0.77 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 2a8v h ALA 43 CO 0.00 1.14 -0.39 0.87 0.00 0.00 0.00 179.25 180.87 2a8v h LYS 44 N 0.05 0.77 0.00 0.00 1.57 0.12 -2.24 116.57 116.83 2a8v h LYS 44 Ca -0.15 -0.40 0.00 0.00 -1.87 0.00 0.00 60.65 58.23 2a8v h LYS 44 Cb 1.94 0.01 0.00 0.00 0.08 0.00 0.00 32.23 34.26 2a8v h LYS 44 CO 0.16 1.02 0.00 -1.13 -0.57 0.00 0.00 179.45 178.94 2a8v n SER 45 N -4.04 0.00 -2.35 0.86 3.41 -0.88 -4.84 113.62 105.77 2a8v n SER 45 Ca -0.02 -0.36 -0.15 0.00 -0.26 0.00 0.00 58.87 58.08 2a8v n SER 45 Cb 0.53 -0.01 0.04 0.00 -0.26 0.00 0.00 64.21 64.52 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 -0.25 -0.04 3.89 5.00 0.00 -0.84 -5.04 105.19 107.91 2a8v n GLY 46 Ca 0.09 -0.11 -0.23 0.00 0.00 0.00 0.00 46.02 45.77 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 -5.68 2.38 -0.18 1.61 2.56 -1.02 -5.06 118.70 113.31 2a8v s GLU 47 Ca 0.32 -1.76 -0.09 0.00 0.00 0.00 0.00 54.97 53.45 2a8v s GLU 47 Cb -0.14 -2.25 -0.05 0.00 2.00 0.00 0.00 34.13 33.69 2a8v s GLU 47 CO 0.40 -0.40 0.12 -0.51 -0.56 0.00 0.00 175.26 174.31 2a8v s ASP 48 N -4.21 6.12 -0.11 -1.70 1.01 -1.26 -4.68 116.67 111.84 2a8v s ASP 48 Ca 0.43 0.25 0.02 0.00 0.71 0.00 0.00 52.55 53.96 2a8v s ASP 48 Cb -0.02 -2.05 -0.01 0.00 1.01 0.00 0.00 42.92 41.85 2a8v s ASP 48 CO 0.26 0.23 -0.17 0.27 0.21 0.00 0.00 175.17 175.96 2a8v s ILE 49 N 0.07 2.68 0.13 0.77 -4.36 -1.26 -4.41 121.20 114.81 2a8v s ILE 49 Ca 0.09 -0.80 0.07 0.00 -0.26 0.00 0.00 60.65 59.75 2a8v s ILE 49 Cb -0.11 -2.08 -0.04 0.00 1.25 0.00 0.00 42.46 41.47 2a8v s ILE 49 CO -0.00 0.54 -0.08 -0.36 0.24 0.00 0.00 174.94 175.28 2a8v s PHE 50 N 0.24 2.75 0.25 1.37 0.40 -0.89 -1.18 117.98 120.92 2a8v s PHE 50 Ca -0.12 -0.16 -0.02 0.00 -0.60 0.00 0.00 56.93 56.04 2a8v s PHE 50 Cb -0.16 -1.40 -0.03 0.00 0.51 0.00 0.00 43.02 41.94 2a8v s PHE 50 CO 0.06 0.46 0.27 0.20 0.70 0.00 0.00 175.22 176.91 2a8v s GLY 51 N -2.43 1.46 0.22 4.36 0.00 -0.01 0.37 107.32 111.29 2a8v s GLY 51 Ca 0.23 -1.60 -0.23 0.00 0.00 0.00 0.00 44.72 43.12 2a8v s GLY 51 CO 0.15 -1.22 0.84 0.51 0.00 0.00 0.00 173.10 173.38 2a8v s ASP 52 N -3.19 -0.22 0.00 1.64 1.47 -1.26 -1.90 116.67 113.22 2a8v s ASP 52 Ca 0.35 -0.51 0.00 0.00 1.18 0.00 0.00 52.55 53.57 2a8v s ASP 52 Cb 0.04 0.61 0.00 0.00 -0.34 0.00 0.00 42.92 43.23 2a8v s ASP 52 CO 0.16 -1.13 0.00 0.61 0.68 0.00 0.00 175.17 175.49 2a8v n GLY 53 N -0.47 -2.52 3.63 2.12 0.00 -0.46 -4.74 105.19 102.75 2a8v n GLY 53 Ca -0.05 -1.26 -0.37 0.00 0.00 0.00 0.00 46.02 44.34 2a8v n GLY 53 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2a8v s VAL 54 N -2.01 5.31 0.32 1.61 1.01 0.15 -1.24 120.40 125.55 2a8v s VAL 54 Ca 0.00 0.25 -0.29 0.00 0.00 0.00 0.00 61.98 61.94 2a8v s VAL 54 Cb 0.00 -3.55 -0.10 0.00 0.00 0.00 0.00 36.38 32.73 2a8v s VAL 54 CO 0.00 0.28 1.33 -0.22 0.00 0.00 0.00 175.10 176.49 2a8v s LEU 55 N 1.45 4.42 -0.16 3.92 2.96 0.94 -1.04 118.68 131.16 2a8v s LEU 55 Ca 0.09 2.69 -0.01 0.00 -0.22 0.00 0.00 54.13 56.67 2a8v s LEU 55 Cb -0.15 -3.65 0.04 0.00 0.50 0.00 0.00 46.19 42.94 2a8v s LEU 55 CO 0.08 -0.57 -0.02 -0.70 -1.32 0.00 0.00 176.35 173.82 2a8v s GLU 56 N -1.57 1.11 -0.03 1.98 2.12 -0.42 -0.35 118.70 121.53 2a8v s GLU 56 Ca 0.51 -0.40 -0.16 0.00 0.36 0.00 0.00 54.97 55.28 2a8v s GLU 56 Cb -0.40 -1.87 -0.05 0.00 0.26 0.00 0.00 34.13 32.07 2a8v s GLU 56 CO 0.52 -0.46 0.43 0.42 -0.54 0.00 0.00 175.26 175.63 2a8v s ILE 57 N 1.74 5.06 0.18 -3.70 1.01 -1.26 -2.30 121.20 121.93 2a8v s ILE 57 Ca 0.01 0.89 0.04 0.00 0.00 0.00 0.00 60.65 61.59 2a8v s ILE 57 Cb -0.15 -3.75 -0.04 0.00 0.01 0.00 0.00 42.46 38.53 2a8v s ILE 57 CO -0.07 0.50 0.23 -0.76 0.00 0.00 0.00 174.94 174.84 2a8v s LEU 58 N -0.56 4.09 0.34 2.97 1.02 -0.70 -4.97 118.68 120.88 2a8v s LEU 58 Ca 0.24 0.01 0.11 0.00 0.02 0.00 0.00 54.13 54.51 2a8v s LEU 58 Cb -0.16 -2.67 0.90 0.00 0.02 0.00 0.00 46.19 44.28 2a8v s LEU 58 CO 0.13 0.03 1.77 -0.61 0.02 0.00 0.00 176.35 177.69 2a8v h GLN 59 N 2.02 0.58 -0.22 1.70 5.75 -1.98 0.29 115.11 123.25 2a8v h GLN 59 Ca -0.49 -0.03 0.06 0.00 -0.15 0.00 0.00 58.65 58.04 2a8v h GLN 59 Cb 1.21 -0.13 -0.01 0.00 1.07 0.00 0.00 27.48 29.62 2a8v h GLN 59 CO 0.65 0.38 0.32 -0.44 -2.65 0.00 0.00 178.83 177.09 2a8v h ASP 60 N 0.60 0.00 0.00 -0.69 3.32 -2.04 -3.45 116.42 114.16 2a8v h ASP 60 Ca 0.59 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.64 2a8v h ASP 60 Cb 1.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.70 2a8v h ASP 60 CO -0.36 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 177.77 2a8v n GLY 61 N -1.38 2.02 4.00 2.75 0.00 0.10 -5.10 105.19 107.59 2a8v n GLY 61 Ca 0.03 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.85 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 -1.98 2.32 0.34 1.61 -0.12 -1.26 -4.51 117.98 114.39 2a8v s PHE 62 Ca 0.00 -0.32 -0.02 0.00 -0.05 0.00 0.00 56.93 56.54 2a8v s PHE 62 Cb 0.00 -2.57 0.00 0.00 -0.63 0.00 0.00 43.02 39.82 2a8v s PHE 62 CO 0.00 -0.95 0.46 0.20 -0.05 0.00 0.00 175.22 174.89 2a8v s GLY 63 N -4.51 1.56 0.04 1.99 0.00 -0.63 -1.72 107.32 104.06 2a8v s GLY 63 Ca 0.59 -1.57 0.02 0.00 0.00 0.00 0.00 44.72 43.77 2a8v s GLY 63 CO 0.38 -1.04 -0.08 -1.36 0.00 0.00 0.00 173.10 171.01 2a8v s PHE 64 N -3.07 0.68 -0.51 1.90 0.40 -0.97 0.36 117.98 116.76 2a8v s PHE 64 Ca 0.31 -0.45 -0.19 0.00 -0.60 0.00 0.00 56.93 56.00 2a8v s PHE 64 Cb -0.00 -0.41 0.06 0.00 0.51 0.00 0.00 43.02 43.18 2a8v s PHE 64 CO 0.21 -0.07 0.64 -0.51 0.70 0.00 0.00 175.22 176.19 2a8v s LEU 65 N -1.42 4.93 0.33 -0.37 1.02 0.16 -1.31 118.68 122.02 2a8v s LEU 65 Ca -0.08 -0.89 -0.07 0.00 0.02 0.00 0.00 54.13 53.10 2a8v s LEU 65 Cb -0.09 -2.46 -0.06 0.00 0.02 0.00 0.00 46.19 43.60 2a8v s LEU 65 CO 0.00 -0.91 0.64 -0.13 0.02 0.00 0.00 176.35 175.97 2a8v s ARG 66 N 2.70 3.70 0.23 1.70 1.81 -0.21 -2.39 118.95 126.49 2a8v s ARG 66 Ca 0.16 0.20 0.12 0.00 -1.72 0.00 0.00 55.73 54.48 2a8v s ARG 66 Cb -0.19 -2.54 -0.05 0.00 -0.45 0.00 0.00 34.95 31.72 2a8v s ARG 66 CO 0.12 0.12 -0.22 -1.54 -0.68 0.00 0.00 175.30 173.10 2a8v s SER 67 N -3.14 3.54 0.36 0.23 1.04 -1.26 0.32 113.70 114.80 2a8v s SER 67 Ca 0.47 -0.93 0.04 0.00 0.48 0.00 0.00 55.95 56.01 2a8v s SER 67 Cb -0.11 -0.30 0.68 0.00 0.10 0.00 0.00 66.02 66.40 2a8v s SER 67 CO 0.30 0.08 1.98 0.00 0.98 0.00 0.00 173.24 176.59 2a8v h ALA 68 N 2.77 1.53 -0.50 5.32 0.00 -1.95 0.36 119.26 126.79 2a8v h ALA 68 Ca -0.44 -0.09 0.10 0.00 0.00 0.00 0.00 54.91 54.48 2a8v h ALA 68 Cb 1.23 -0.20 -0.10 0.00 0.00 0.00 0.00 17.79 18.72 2a8v h ALA 68 CO 0.53 0.39 -0.30 0.22 0.00 0.00 0.00 179.25 180.09 2a8v h ASP 69 N 0.68 -1.02 -0.22 0.00 3.58 -2.01 1.09 116.42 118.52 2a8v h ASP 69 Ca 0.17 0.20 0.00 0.00 0.42 0.00 0.00 57.03 57.83 2a8v h ASP 69 Cb 0.04 0.51 0.00 0.00 1.72 0.00 0.00 39.33 41.60 2a8v h ASP 69 CO -0.03 -0.29 0.00 -1.20 -2.88 0.00 0.00 179.24 174.84 2a8v n SER 70 N -5.42 2.69 -1.94 2.28 7.64 -1.02 -4.84 113.62 113.02 2a8v n SER 70 Ca 0.03 -2.33 -0.14 0.00 1.01 0.00 0.00 58.87 57.44 2a8v n SER 70 Cb 0.34 -0.55 -0.03 0.00 -1.01 0.00 0.00 64.21 62.96 2a8v n SER 70 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2a8v n SER 71 N 0.23 -3.97 -0.96 6.43 2.88 0.37 -0.94 113.62 117.66 2a8v n SER 71 Ca 0.10 0.25 -0.05 0.00 -1.33 0.00 0.00 58.87 57.83 2a8v n SER 71 Cb 0.58 -3.50 0.01 0.00 -0.75 0.00 0.00 64.21 60.55 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 -2.75 -0.50 -5.00 0.66 4.01 0.12 -4.94 117.16 108.77 2a8v n TYR 72 Ca -0.15 0.14 -0.32 0.00 -0.16 0.00 0.00 57.90 57.41 2a8v n TYR 72 Cb 0.54 -1.86 -0.15 0.00 -0.31 0.00 0.00 39.34 37.57 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 -2.07 2.50 -0.53 7.72 1.43 -0.12 -4.92 118.68 122.70 2a8v s LEU 73 Ca 0.08 -0.33 -0.28 0.00 -1.03 0.00 0.00 54.13 52.57 2a8v s LEU 73 Cb -0.04 -1.50 -0.15 0.00 0.03 0.00 0.00 46.19 44.53 2a8v s LEU 73 CO 0.10 0.27 1.75 0.00 0.23 0.00 0.00 176.35 178.70 2a8v n ALA 74 N 2.78 0.18 -2.49 4.21 0.00 -1.26 -4.84 120.51 119.10 2a8v n ALA 74 Ca -0.17 -0.02 -0.24 0.00 0.00 0.00 0.00 53.44 53.00 2a8v n ALA 74 Cb 0.52 -1.58 -0.10 0.00 0.00 0.00 0.00 19.45 18.29 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 5.38 2.01 0.28 0.00 0.00 -1.26 -5.02 107.32 108.71 2a8v s GLY 75 Ca 0.93 -1.98 0.23 0.00 0.00 0.00 0.00 44.72 43.89 2a8v s GLY 75 CO 0.42 -1.97 1.69 -1.55 0.00 0.00 0.00 173.10 171.70 2a8v n PRO 76 N -0.69 0.18 -0.10 2.90 -0.04 -1.26 -2.04 135.00 133.94 2a8v n PRO 76 Ca -0.05 0.49 0.12 0.00 -0.04 0.00 0.00 63.50 64.02 2a8v n PRO 76 Cb 0.62 -1.90 0.23 0.00 -0.04 0.00 0.00 33.50 32.42 2a8v n PRO 76 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2a8v n ASP 77 N -2.24 2.90 -4.72 3.54 5.75 -1.26 -4.79 116.55 115.74 2a8v n ASP 77 Ca 0.01 -1.92 -0.34 0.00 -0.01 0.00 0.00 54.79 52.53 2a8v n ASP 77 Cb 0.17 -0.13 0.10 0.00 -1.03 0.00 0.00 41.12 40.22 2a8v n ASP 77 CO 0.00 0.00 0.00 -1.81 -0.11 0.00 0.00 177.20 175.28 2a8v s ASP 78 N -1.69 4.10 -0.25 -1.12 1.01 -0.87 -4.90 116.67 112.95 2a8v s ASP 78 Ca 0.35 2.36 -0.05 0.00 0.71 0.00 0.00 52.55 55.92 2a8v s ASP 78 Cb 0.21 -2.59 -0.01 0.00 1.01 0.00 0.00 42.92 41.55 2a8v s ASP 78 CO 0.31 -2.32 0.01 -0.63 0.21 0.00 0.00 175.17 172.74 2a8v s ILE 79 N -2.00 3.64 0.25 0.77 1.01 -1.00 -3.95 121.20 119.92 2a8v s ILE 79 Ca 0.74 -0.53 -0.30 0.00 0.00 0.00 0.00 60.65 60.57 2a8v s ILE 79 Cb -0.29 -2.74 -0.10 0.00 0.01 0.00 0.00 42.46 39.34 2a8v s ILE 79 CO 0.46 0.31 1.44 -0.47 0.00 0.00 0.00 174.94 176.68 2a8v s TYR 80 N 1.50 3.01 -0.15 3.97 5.04 -0.06 0.38 117.35 131.04 2a8v s TYR 80 Ca 0.05 1.02 0.01 0.00 -2.44 0.00 0.00 57.07 55.70 2a8v s TYR 80 Cb -0.15 -3.83 0.02 0.00 0.35 0.00 0.00 41.96 38.35 2a8v s TYR 80 CO -0.01 -2.69 -0.18 0.08 -1.34 0.00 0.00 175.55 171.41 2a8v s VAL 81 N 0.01 1.81 0.68 3.14 1.01 0.16 -1.96 120.40 125.24 2a8v s VAL 81 Ca 0.60 -0.80 -0.13 0.00 0.00 0.00 0.00 61.98 61.64 2a8v s VAL 81 Cb -0.42 -1.64 0.01 0.00 0.00 0.00 0.00 36.38 34.33 2a8v s VAL 81 CO 0.43 0.50 1.09 -0.94 0.00 0.00 0.00 175.10 176.18 2a8v s SER 82 N 1.21 5.07 0.38 3.32 1.04 -1.26 -1.60 113.70 121.85 2a8v s SER 82 Ca 0.01 1.89 0.06 0.00 0.48 0.00 0.00 55.95 58.38 2a8v s SER 82 Cb -0.14 -2.53 0.76 0.00 0.10 0.00 0.00 66.02 64.20 2a8v s SER 82 CO -0.08 -1.66 1.99 -0.65 0.98 0.00 0.00 173.24 173.82 2a8v h PRO 83 N -0.30 0.55 -0.61 4.02 0.11 -1.96 -2.05 132.00 131.77 2a8v h PRO 83 Ca -0.46 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 65.56 2a8v h PRO 83 Cb 1.23 -0.11 -0.03 0.00 0.11 0.00 0.00 31.00 32.21 2a8v h PRO 83 CO 0.54 0.44 0.23 0.77 -0.21 0.00 0.00 178.00 179.77 2a8v h SER 84 N 0.55 0.81 0.05 -2.05 0.02 -1.93 -0.19 113.55 110.82 2a8v h SER 84 Ca 0.14 -0.11 -0.20 0.00 -0.84 0.00 0.00 61.79 60.78 2a8v h SER 84 Cb 0.08 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 62.41 2a8v h SER 84 CO -0.02 0.74 -0.72 1.56 -1.14 0.00 0.00 176.83 177.24 2a8v h GLN 85 N 0.87 0.59 -0.35 3.45 4.20 -1.76 0.76 115.11 122.89 2a8v h GLN 85 Ca 0.21 -0.47 -0.04 0.00 0.06 0.00 0.00 58.65 58.41 2a8v h GLN 85 Cb 0.19 0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.04 2a8v h GLN 85 CO -0.02 1.09 0.06 0.82 -0.67 0.00 0.00 178.83 180.12 2a8v h ILE 86 N 0.41 1.23 -0.02 2.54 2.04 -1.06 -1.65 117.51 121.01 2a8v h ILE 86 Ca -0.03 -0.81 -0.25 0.00 1.00 0.00 0.00 64.86 64.77 2a8v h ILE 86 Cb 1.32 1.10 0.02 0.00 -0.74 0.00 0.00 36.82 38.52 2a8v h ILE 86 CO 0.14 0.27 -0.95 0.08 0.00 0.00 0.00 178.15 177.69 2a8v h ARG 87 N 0.41 0.68 -0.71 2.37 0.11 -1.04 0.27 114.38 116.46 2a8v h ARG 87 Ca 0.11 -0.71 0.00 0.00 0.10 0.00 0.00 59.98 59.48 2a8v h ARG 87 Cb 0.34 0.19 -0.04 0.00 1.11 0.00 0.00 29.97 31.58 2a8v h ARG 87 CO 0.01 1.29 0.46 -0.09 0.10 0.00 0.00 179.97 181.74 2a8v h ARG 88 N 0.35 0.94 -0.67 0.08 2.43 -0.80 -2.57 114.38 114.15 2a8v h ARG 88 Ca -0.11 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 58.99 2a8v h ARG 88 Cb 1.61 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 30.95 2a8v h ARG 88 CO 0.19 0.64 0.00 1.19 -1.51 0.00 0.00 179.97 180.47 2a8v n PHE 89 N -4.58 1.16 -3.87 2.20 3.01 -0.62 -4.95 117.46 109.80 2a8v n PHE 89 Ca 0.06 -0.55 -0.24 0.00 1.01 0.00 0.00 57.45 57.73 2a8v n PHE 89 Cb 0.02 -0.11 -0.00 0.00 -0.01 0.00 0.00 39.48 39.38 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 1.32 -0.57 -4.82 4.37 2.85 -0.44 -4.91 115.26 113.06 2a8v n ASN 90 Ca 0.24 -0.95 -0.32 0.00 -0.11 0.00 0.00 54.58 53.44 2a8v n ASN 90 Cb 0.73 -3.38 -0.00 0.00 1.24 0.00 0.00 39.78 38.36 2a8v n ASN 90 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 2a8v s LEU 91 N -6.87 3.50 0.02 1.20 1.43 0.83 -5.02 118.68 113.77 2a8v s LEU 91 Ca 0.00 1.70 0.01 0.00 -1.03 0.00 0.00 54.13 54.81 2a8v s LEU 91 Cb -0.00 -4.52 -0.02 0.00 0.03 0.00 0.00 46.19 41.69 2a8v s LEU 91 CO 0.86 -0.97 -0.05 -0.60 0.23 0.00 0.00 176.35 175.82 2a8v s ARG 92 N -4.20 0.40 0.20 1.70 3.52 -1.26 -4.87 118.95 114.44 2a8v s ARG 92 Ca 0.61 -0.49 -0.33 0.00 -0.13 0.00 0.00 55.73 55.39 2a8v s ARG 92 Cb -0.13 -0.22 -0.14 0.00 -1.56 0.00 0.00 34.95 32.90 2a8v s ARG 92 CO 0.37 0.04 1.50 2.41 -0.81 0.00 0.00 175.30 178.82 2a8v n THR 93 N 2.08 0.46 0.00 4.11 -1.04 -1.26 -1.22 114.28 117.41 2a8v n THR 93 Ca -0.19 -0.12 0.00 0.00 -2.04 0.00 0.00 64.05 61.70 2a8v n THR 93 Cb 0.56 -1.53 0.00 0.00 -1.82 0.00 0.00 70.33 67.54 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 2.80 2.78 3.76 3.41 0.00 0.53 -4.97 105.19 113.50 2a8v n GLY 94 Ca 0.14 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.35 5.46 -0.25 1.61 1.01 -0.36 -4.65 116.67 118.15 2a8v s ASP 95 Ca 0.00 2.51 -0.11 0.00 0.71 0.00 0.00 52.55 55.66 2a8v s ASP 95 Cb 0.00 -2.61 -0.05 0.00 1.01 0.00 0.00 42.92 41.27 2a8v s ASP 95 CO 0.00 -1.42 0.20 -0.89 0.21 0.00 0.00 175.17 173.27 2a8v s THR 96 N -1.47 5.32 -0.00 -1.27 2.01 -1.26 -0.04 115.64 118.93 2a8v s THR 96 Ca 0.72 0.25 0.04 0.00 0.31 0.00 0.00 61.69 63.00 2a8v s THR 96 Cb -0.34 -3.54 -0.01 0.00 0.01 0.00 0.00 72.50 68.62 2a8v s THR 96 CO 0.39 0.30 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.88 2a8v s ILE 97 N 1.30 0.90 0.46 1.82 1.01 -0.37 -4.98 121.20 121.33 2a8v s ILE 97 Ca 0.09 -0.53 0.03 0.00 0.00 0.00 0.00 60.65 60.23 2a8v s ILE 97 Cb -0.14 -0.76 -0.01 0.00 0.01 0.00 0.00 42.46 41.55 2a8v s ILE 97 CO 0.07 0.22 0.10 -0.44 0.00 0.00 0.00 174.94 174.88 2a8v s SER 98 N -0.36 3.31 0.00 3.58 0.01 -1.26 -1.35 113.70 117.62 2a8v s SER 98 Ca 0.04 -1.72 0.00 0.00 1.31 0.00 0.00 55.95 55.57 2a8v s SER 98 Cb -0.05 0.62 0.00 0.00 0.21 0.00 0.00 66.02 66.81 2a8v s SER 98 CO -0.00 -0.97 0.00 0.61 0.41 0.00 0.00 173.24 173.29 2a8v n GLY 99 N -1.07 0.84 3.76 3.44 0.00 -0.80 -0.88 105.19 110.49 2a8v n GLY 99 Ca -0.11 -1.90 -0.40 0.00 0.00 0.00 0.00 46.02 43.61 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 -1.36 4.72 0.28 1.61 1.02 -1.21 -0.83 119.74 123.96 2a8v s LYS 100 Ca 0.00 1.34 0.03 0.00 0.02 0.00 0.00 55.97 57.36 2a8v s LYS 100 Cb 0.00 -3.26 -0.06 0.00 -0.52 0.00 0.00 37.83 34.00 2a8v s LYS 100 CO 0.00 0.54 0.04 0.96 -0.92 0.00 0.00 175.35 175.97 2a8v s ILE 101 N -1.18 0.99 0.05 2.17 -4.36 -0.33 0.13 121.20 118.67 2a8v s ILE 101 Ca 0.39 -2.02 0.02 0.00 -0.26 0.00 0.00 60.65 58.79 2a8v s ILE 101 Cb -0.25 -2.59 -0.03 0.00 1.25 0.00 0.00 42.46 40.85 2a8v s ILE 101 CO 0.29 -0.12 -0.08 0.00 0.24 0.00 0.00 174.94 175.27 2a8v s ARG 102 N -3.91 0.56 0.82 0.37 1.70 0.39 -4.56 118.95 114.31 2a8v s ARG 102 Ca 0.34 -0.82 -0.11 0.00 -0.47 0.00 0.00 55.73 54.67 2a8v s ARG 102 Cb 0.07 -0.29 0.08 0.00 -0.57 0.00 0.00 34.95 34.24 2a8v s ARG 102 CO 0.13 0.05 1.09 -1.25 -1.08 0.00 0.00 175.30 174.23 2a8v s PRO 103 N -1.80 1.90 0.07 3.89 0.04 -1.26 -0.32 135.00 137.52 2a8v s PRO 103 Ca -0.08 1.00 -0.30 0.00 0.04 0.00 0.00 61.00 61.66 2a8v s PRO 103 Cb -0.09 -1.87 -0.06 0.00 0.04 0.00 0.00 34.50 32.53 2a8v s PRO 103 CO -0.00 -1.85 1.18 -1.25 0.04 0.00 0.00 177.00 175.12 2a8v s PRO 104 N -4.94 4.45 0.67 0.56 0.04 -1.22 -4.68 135.00 129.89 2a8v s PRO 104 Ca 0.62 1.76 -0.01 0.00 0.04 0.00 0.00 61.00 63.41 2a8v s PRO 104 Cb -0.17 -3.34 0.13 0.00 0.04 0.00 0.00 34.50 31.16 2a8v s PRO 104 CO 0.56 -0.21 0.91 1.63 0.04 0.00 0.00 177.00 179.94 2a8v n LYS 105 N 3.72 -0.09 -1.69 4.56 5.02 -1.26 -4.83 118.16 123.58 2a8v n LYS 105 Ca 0.08 -2.43 -0.56 0.00 -2.02 0.00 0.00 58.31 53.38 2a8v n LYS 105 Cb 0.46 -0.63 -0.07 0.00 -0.02 0.00 0.00 35.03 34.78 2a8v n LYS 105 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 2a8v n GLU 106 N -2.70 1.15 0.00 1.97 2.13 -1.26 -0.04 120.64 121.88 2a8v n GLU 106 Ca 0.15 0.42 0.00 0.00 0.66 0.00 0.00 57.16 58.39 2a8v n GLU 106 Cb 0.53 -2.10 0.00 0.00 0.27 0.00 0.00 31.44 30.15 2a8v n GLU 106 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2a8v n GLY 107 N 3.87 3.07 3.74 8.31 0.00 -1.26 -5.03 105.19 117.89 2a8v n GLY 107 Ca 0.25 -0.88 -0.40 0.00 0.00 0.00 0.00 46.02 44.99 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 0.00 4.74 -0.02 1.61 2.02 0.94 -4.95 118.70 123.05 2a8v s GLU 108 Ca 0.00 1.57 0.12 0.00 0.02 0.00 0.00 54.97 56.68 2a8v s GLU 108 Cb 0.00 -3.29 -0.19 0.00 0.10 0.00 0.00 34.13 30.75 2a8v s GLU 108 CO 0.00 0.32 0.27 -2.13 0.02 0.00 0.00 175.26 173.74 2a8v n ARG 109 N 1.90 0.37 -4.35 1.61 0.63 -1.26 -4.21 116.66 111.36 2a8v n ARG 109 Ca -0.00 -0.11 -0.24 0.00 -0.92 0.00 0.00 57.85 56.58 2a8v n ARG 109 Cb 0.47 -1.29 -0.08 0.00 0.45 0.00 0.00 32.46 32.01 2a8v n ARG 109 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 2a8v s TYR 110 N -2.85 2.54 0.38 -0.14 1.51 -1.26 -4.82 117.35 112.72 2a8v s TYR 110 Ca -0.04 -0.35 -0.26 0.00 -1.01 0.00 0.00 57.07 55.41 2a8v s TYR 110 Cb 0.08 -1.30 -0.09 0.00 -0.11 0.00 0.00 41.96 40.54 2a8v s TYR 110 CO 0.51 0.57 1.12 -0.06 -1.11 0.00 0.00 175.55 176.57 2a8v s PHE 111 N -2.46 3.23 0.01 2.71 0.40 -1.25 -3.45 117.98 117.17 2a8v s PHE 111 Ca 0.33 1.61 0.04 0.00 -0.60 0.00 0.00 56.93 58.31 2a8v s PHE 111 Cb -0.03 -3.29 -0.03 0.00 0.51 0.00 0.00 43.02 40.18 2a8v s PHE 111 CO 0.19 -0.95 -0.08 0.00 0.70 0.00 0.00 175.22 175.08 2a8v s ALA 112 N -1.44 2.96 0.04 5.36 0.00 0.56 -0.88 121.76 128.35 2a8v s ALA 112 Ca 0.55 -1.05 -0.30 0.00 0.00 0.00 0.00 51.96 51.15 2a8v s ALA 112 Cb -0.28 -1.07 -0.06 0.00 0.00 0.00 0.00 23.12 21.71 2a8v s ALA 112 CO 0.35 0.61 1.28 -1.17 0.00 0.00 0.00 175.76 176.84 2a8v s LEU 113 N -1.45 4.34 -0.15 0.00 2.96 -0.83 -0.47 118.68 123.09 2a8v s LEU 113 Ca 0.17 2.06 -0.10 0.00 -0.22 0.00 0.00 54.13 56.04 2a8v s LEU 113 Cb -0.11 -3.57 -0.05 0.00 0.50 0.00 0.00 46.19 42.95 2a8v s LEU 113 CO 0.07 -0.58 -0.10 0.25 -1.32 0.00 0.00 176.35 174.67 2a8v h LEU 114 N 7.40 0.00 -7.73 -0.68 5.85 0.70 -3.47 115.31 117.39 2a8v h LEU 114 Ca -0.40 -0.08 -0.42 0.00 0.84 0.00 0.00 57.88 57.82 2a8v h LEU 114 Cb 1.20 0.00 -0.34 0.00 0.37 0.00 0.00 40.66 41.88 2a8v h LEU 114 CO 0.85 0.85 -0.77 -0.54 -0.34 0.00 0.00 178.44 178.49 2a8v s LYS 115 N -2.21 0.86 -0.01 1.25 1.02 -1.02 -4.99 119.74 114.64 2a8v s LYS 115 Ca -0.16 -0.11 -0.30 0.00 0.02 0.00 0.00 55.97 55.43 2a8v s LYS 115 Cb 0.02 -0.88 -0.06 0.00 -0.52 0.00 0.00 37.83 36.39 2a8v s LYS 115 CO 0.26 -0.09 1.51 0.08 -0.92 0.00 0.00 175.35 176.19 2a8v s VAL 116 N 0.99 3.58 0.00 3.17 1.01 -1.26 -3.31 120.40 124.58 2a8v s VAL 116 Ca -0.10 0.90 0.00 0.00 0.00 0.00 0.00 61.98 62.78 2a8v s VAL 116 Cb -0.14 -3.58 0.00 0.00 0.00 0.00 0.00 36.38 32.66 2a8v s VAL 116 CO -0.00 -0.03 0.00 0.59 0.00 0.00 0.00 175.10 175.66 2a8v n ASN 117 N 5.99 0.00 0.00 3.32 4.13 -0.06 -4.99 115.26 123.65 2a8v n ASN 117 Ca 0.15 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.41 2a8v n ASN 117 Cb 0.43 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.67 2a8v n ASN 117 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92