#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1apy s PRO 3 N 0.00 3.78 0.26 1.43 0.04 -1.26 -5.07 135.00 134.17 1apy s PRO 3 Ca 0.00 0.72 0.09 0.00 0.04 0.00 0.00 61.00 61.85 1apy s PRO 3 Cb 0.00 -2.20 -0.04 0.00 0.04 0.00 0.00 34.50 32.30 1apy s PRO 3 CO 0.00 -0.29 0.05 -0.51 0.04 0.00 0.00 177.00 176.29 1apy s LEU 4 N -4.39 3.38 0.81 -3.56 1.43 -1.26 -4.50 118.68 110.59 1apy s LEU 4 Ca 0.55 -0.52 -0.11 0.00 -1.03 0.00 0.00 54.13 53.02 1apy s LEU 4 Cb -0.10 -1.91 0.07 0.00 0.03 0.00 0.00 46.19 44.29 1apy s LEU 4 CO 0.39 -0.01 1.09 -2.84 0.23 0.00 0.00 176.35 175.21 1apy s PRO 5 N -3.70 2.01 -0.03 1.29 0.02 -1.26 -5.19 135.00 128.14 1apy s PRO 5 Ca 0.32 0.80 0.02 0.00 0.02 0.00 0.00 61.00 62.16 1apy s PRO 5 Cb -0.07 -1.90 0.01 0.00 0.02 0.00 0.00 34.50 32.56 1apy s PRO 5 CO 0.21 -1.72 -0.08 -1.17 -0.33 0.00 0.00 177.00 173.92 1apy s LEU 6 N -5.88 1.67 -0.10 -5.54 2.96 -1.26 -5.09 118.68 105.43 1apy s LEU 6 Ca 0.61 -0.18 0.01 0.00 -0.22 0.00 0.00 54.13 54.34 1apy s LEU 6 Cb -0.16 -0.55 0.02 0.00 0.50 0.00 0.00 46.19 46.00 1apy s LEU 6 CO 0.55 0.03 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.81 1apy s VAL 7 N 0.42 1.23 -0.02 1.68 1.01 -1.26 -5.13 120.40 118.32 1apy s VAL 7 Ca -0.07 -0.46 0.03 0.00 0.00 0.00 0.00 61.98 61.48 1apy s VAL 7 Cb -0.11 -1.17 0.00 0.00 0.00 0.00 0.00 36.38 35.10 1apy s VAL 7 CO 0.01 0.39 -0.10 -0.69 0.00 0.00 0.00 175.10 174.71 1apy s VAL 8 N 1.25 0.81 0.00 2.92 1.01 -1.26 -5.11 120.40 120.02 1apy s VAL 8 Ca -0.03 -0.39 -0.10 0.00 0.00 0.00 0.00 61.98 61.47 1apy s VAL 8 Cb -0.14 -0.71 0.01 0.00 0.00 0.00 0.00 36.38 35.54 1apy s VAL 8 CO -0.04 0.25 0.19 0.54 0.00 0.00 0.00 175.10 176.04 1apy s ASN 9 N 0.09 -0.03 0.47 3.32 4.22 -1.26 -5.12 114.94 116.62 1apy s ASN 9 Ca -0.01 -0.15 -0.22 0.00 -2.14 0.00 0.00 52.86 50.33 1apy s ASN 9 Cb -0.08 0.24 -0.07 0.00 1.28 0.00 0.00 41.25 42.63 1apy s ASN 9 CO 0.00 -0.42 1.17 0.42 -2.04 0.00 0.00 177.10 176.24 1apy s THR 10 N -1.53 3.07 0.44 0.54 -4.23 -1.26 -4.83 115.64 107.83 1apy s THR 10 Ca -0.13 0.79 0.00 0.00 -1.18 0.00 0.00 61.69 61.16 1apy s THR 10 Cb -0.06 -3.39 0.00 0.00 1.34 0.00 0.00 72.50 70.39 1apy s THR 10 CO 0.02 -0.03 0.00 0.79 -0.54 0.00 0.00 174.62 174.86 1apy n TRP 11 N -0.59 -2.98 -0.90 3.99 7.02 -1.26 -4.40 117.44 118.32 1apy n TRP 11 Ca 0.08 1.63 -0.15 0.00 -1.02 0.00 0.00 57.50 58.04 1apy n TRP 11 Cb 0.48 -2.67 -0.12 0.00 -2.42 0.00 0.00 31.31 26.59 1apy n TRP 11 CO 0.00 0.00 0.00 -0.35 -2.02 0.00 0.00 177.69 175.32 1apy n PRO 12 N -2.93 2.00 -2.29 -0.99 -0.04 -1.26 -4.74 135.00 124.76 1apy n PRO 12 Ca -0.03 -1.09 -0.42 0.00 -0.04 0.00 0.00 63.50 61.92 1apy n PRO 12 Cb 0.42 -2.09 0.00 0.00 -0.04 0.00 0.00 33.50 31.79 1apy n PRO 12 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1apy n PHE 13 N 2.86 3.07 -0.34 0.54 3.72 -1.26 -4.83 117.46 121.21 1apy n PHE 13 Ca 0.43 -2.83 0.19 0.00 -0.05 0.00 0.00 57.45 55.19 1apy n PHE 13 Cb 0.64 -2.03 0.40 0.00 -0.94 0.00 0.00 39.48 37.56 1apy n PHE 13 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 1apy h LYS 14 N 5.82 0.53 -0.04 -1.08 3.64 -1.97 -0.95 116.57 122.52 1apy h LYS 14 Ca 0.41 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.73 1apy h LYS 14 Cb 0.64 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.33 1apy h LYS 14 CO 1.64 0.35 -0.14 -0.91 -2.27 0.00 0.00 179.45 178.12 1apy h ASN 15 N 0.54 0.06 -0.14 4.20 2.35 -1.99 0.33 115.58 120.93 1apy h ASN 15 Ca 0.66 -0.01 -0.19 0.00 -0.55 0.00 0.00 56.30 56.20 1apy h ASN 15 Cb 1.30 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 39.66 1apy h ASN 15 CO -0.48 0.21 -0.64 0.00 -1.65 0.00 0.00 177.43 174.86 1apy h ALA 16 N 1.80 0.46 -0.27 -0.83 0.00 -1.41 -0.88 119.26 118.14 1apy h ALA 16 Ca 0.01 -0.55 -0.01 0.00 0.00 0.00 0.00 54.91 54.36 1apy h ALA 16 Cb 0.29 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1apy h ALA 16 CO 0.02 0.69 0.14 1.15 0.00 0.00 0.00 179.25 181.25 1apy h THR 17 N 0.56 1.14 -0.42 0.00 2.02 -1.22 -0.93 112.91 114.05 1apy h THR 17 Ca -0.01 -0.39 -0.01 0.00 0.77 0.00 0.00 66.41 66.77 1apy h THR 17 Cb 1.24 0.90 -0.02 0.00 -1.74 0.00 0.00 68.15 68.53 1apy h THR 17 CO 0.13 0.14 0.24 -0.08 0.37 0.00 0.00 175.52 176.32 1apy h GLU 18 N 0.31 0.59 -0.78 6.66 4.57 -0.89 -1.50 114.58 123.54 1apy h GLU 18 Ca 0.09 -0.07 0.01 0.00 -1.18 0.00 0.00 59.36 58.21 1apy h GLU 18 Cb 0.10 -0.12 -0.04 0.00 -0.16 0.00 0.00 28.75 28.53 1apy h GLU 18 CO -0.01 0.47 0.52 0.00 -1.18 0.00 0.00 179.01 178.80 1apy h ALA 19 N 1.09 0.99 -0.28 2.92 0.00 -0.83 0.01 119.26 123.15 1apy h ALA 19 Ca 0.15 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 1apy h ALA 19 Cb 0.05 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1apy h ALA 19 CO -0.02 0.40 -0.07 0.00 0.00 0.00 0.00 179.25 179.56 1apy h ALA 20 N 1.29 0.39 -0.58 0.00 0.00 -0.95 -2.71 119.26 116.70 1apy h ALA 20 Ca 0.29 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1apy h ALA 20 Cb -0.12 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 1apy h ALA 20 CO -0.06 0.21 0.23 2.35 0.00 0.00 0.00 179.25 181.98 1apy h TRP 21 N 0.31 0.84 -0.49 0.00 2.91 -0.95 -2.04 115.95 116.53 1apy h TRP 21 Ca 0.07 -0.05 -0.06 0.00 1.13 0.00 0.00 58.89 59.99 1apy h TRP 21 Cb 0.55 -0.26 -0.02 0.00 -0.51 0.00 0.00 29.16 28.92 1apy h TRP 21 CO 0.05 0.65 0.06 -0.09 -1.03 0.00 0.00 178.44 178.08 1apy h ARG 22 N 0.83 0.77 -0.42 2.65 2.43 -0.92 -0.82 114.38 118.90 1apy h ARG 22 Ca 0.20 -0.18 -0.07 0.00 -0.81 0.00 0.00 59.98 59.12 1apy h ARG 22 Cb 0.17 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.60 1apy h ARG 22 CO -0.02 0.74 -0.01 0.00 -1.51 0.00 0.00 179.97 179.17 1apy h ALA 23 N 1.33 0.57 -0.52 2.80 0.00 -1.05 -2.14 119.26 120.25 1apy h ALA 23 Ca 0.15 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 54.70 1apy h ALA 23 Cb 0.36 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1apy h ALA 23 CO 0.01 0.37 -0.03 -0.07 0.00 0.00 0.00 179.25 179.53 1apy h LEU 24 N 0.59 0.94 -2.12 0.00 3.38 -1.29 0.35 115.31 117.16 1apy h LEU 24 Ca 0.12 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.76 1apy h LEU 24 Cb 0.50 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 1apy h LEU 24 CO 0.02 1.03 -0.06 0.00 0.09 0.00 0.00 178.44 179.52 1apy h ALA 25 N 0.94 1.56 -0.01 1.53 0.00 -0.94 -0.94 119.26 121.40 1apy h ALA 25 Ca 0.14 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1apy h ALA 25 Cb 0.57 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1apy h ALA 25 CO 0.03 0.08 -0.19 0.43 0.00 0.00 0.00 179.25 179.60 1apy n SER 26 N -3.97 0.88 0.00 0.00 7.64 -0.82 -4.90 113.62 112.45 1apy n SER 26 Ca -0.03 -0.83 0.00 0.00 1.01 0.00 0.00 58.87 59.02 1apy n SER 26 Cb 0.15 0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.41 1apy n SER 26 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1apy n GLY 27 N 1.31 0.74 3.76 0.23 0.00 -0.36 -5.09 105.19 105.79 1apy n GLY 27 Ca 0.13 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.82 1apy n GLY 27 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1apy s GLY 28 N -0.84 2.28 0.93 -0.02 0.00 0.12 -4.97 107.32 104.82 1apy s GLY 28 Ca 0.00 0.68 -0.15 0.00 0.00 0.00 0.00 44.72 45.24 1apy s GLY 28 CO 0.00 1.04 1.29 -1.35 0.00 0.00 0.00 173.10 174.09 1apy s SER 29 N -2.32 3.37 0.36 1.64 1.04 -1.26 -4.29 113.70 112.24 1apy s SER 29 Ca 0.70 0.37 0.05 0.00 0.48 0.00 0.00 55.95 57.55 1apy s SER 29 Cb -0.23 -0.50 0.68 0.00 0.10 0.00 0.00 66.02 66.07 1apy s SER 29 CO 0.40 -2.58 1.95 0.00 0.98 0.00 0.00 173.24 173.99 1apy h ALA 30 N -1.54 1.49 -0.55 5.32 0.00 -1.98 -0.99 119.26 121.02 1apy h ALA 30 Ca -0.45 -0.13 -0.12 0.00 0.00 0.00 0.00 54.91 54.22 1apy h ALA 30 Cb 1.25 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 1apy h ALA 30 CO 0.43 0.39 -0.11 -0.07 0.00 0.00 0.00 179.25 179.89 1apy h LEU 31 N 0.57 1.04 -0.62 0.00 3.38 -1.93 -0.99 115.31 116.77 1apy h LEU 31 Ca 0.14 -0.35 -0.04 0.00 0.09 0.00 0.00 57.88 57.72 1apy h LEU 31 Cb 0.15 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 1apy h LEU 31 CO -0.01 1.15 0.23 0.44 0.09 0.00 0.00 178.44 180.34 1apy h ASP 32 N 0.92 0.88 0.10 -0.43 3.32 -1.72 -1.82 116.42 117.67 1apy h ASP 32 Ca 0.14 -0.18 -0.00 0.00 0.02 0.00 0.00 57.03 57.00 1apy h ASP 32 Cb 0.68 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 40.00 1apy h ASP 32 CO 0.05 0.82 -0.05 0.00 -1.72 0.00 0.00 179.24 178.34 1apy h ALA 33 N 1.09 -0.14 -0.32 3.45 0.00 -0.99 -1.00 119.26 121.35 1apy h ALA 33 Ca 0.21 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.03 1apy h ALA 33 Cb 0.24 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1apy h ALA 33 CO -0.01 -0.50 0.19 0.28 0.00 0.00 0.00 179.25 179.21 1apy h VAL 34 N -0.28 1.05 -0.63 0.00 2.07 -1.13 -0.48 116.25 116.85 1apy h VAL 34 Ca -0.01 -0.14 0.02 0.00 0.82 0.00 0.00 66.70 67.38 1apy h VAL 34 Cb 0.24 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 30.59 1apy h VAL 34 CO 0.02 0.07 0.40 -0.08 0.02 0.00 0.00 177.57 178.01 1apy h GLU 35 N 0.40 0.79 -0.21 1.57 4.81 -1.29 -1.19 114.58 119.45 1apy h GLU 35 Ca 0.12 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.29 1apy h GLU 35 Cb -0.02 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.18 1apy h GLU 35 CO -0.05 0.52 0.06 0.77 -0.73 0.00 0.00 179.01 179.58 1apy h SER 36 N 0.81 0.32 -0.56 1.04 0.02 -0.90 -0.09 113.55 114.19 1apy h SER 36 Ca 0.24 -0.22 -0.01 0.00 -0.84 0.00 0.00 61.79 60.96 1apy h SER 36 Cb -0.05 -0.08 -0.03 0.00 0.14 0.00 0.00 62.40 62.38 1apy h SER 36 CO -0.07 0.45 0.30 1.23 -1.14 0.00 0.00 176.83 177.60 1apy h GLY 37 N 0.17 0.84 1.30 -3.77 0.00 -0.87 -1.68 103.07 99.06 1apy h GLY 37 Ca 0.07 -0.38 -0.20 0.00 0.00 0.00 0.00 47.33 46.81 1apy h GLY 37 CO -0.00 0.37 -0.71 0.00 0.00 0.00 0.00 176.54 176.20 1apy h ALA 39 N 0.71 1.66 -0.60 0.00 0.00 -0.92 -1.97 119.26 118.13 1apy h ALA 39 Ca -0.03 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 1apy h ALA 39 Cb 1.31 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 19.04 1apy h ALA 39 CO 0.14 0.24 0.21 1.98 0.00 0.00 0.00 179.25 181.82 1apy h MET 40 N 0.00 0.92 0.00 0.00 4.05 -1.23 -1.72 114.93 116.96 1apy h MET 40 Ca -0.00 -0.19 -0.04 0.00 -0.28 0.00 0.00 59.70 59.19 1apy h MET 40 Cb 0.34 -0.14 -0.01 0.00 -0.80 0.00 0.00 31.60 31.00 1apy h MET 40 CO 0.02 0.81 -0.17 0.00 0.23 0.00 0.00 176.91 177.81 1apy h GLU 42 N 0.00 0.66 -0.16 0.00 5.08 -0.92 -0.40 114.58 118.84 1apy h GLU 42 Ca -0.00 -0.42 -0.03 0.00 -1.00 0.00 0.00 59.36 57.91 1apy h GLU 42 Cb 0.76 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.05 1apy h GLU 42 CO 0.02 1.04 -0.03 0.00 -1.00 0.00 0.00 179.01 179.04 1apy h ARG 43 N 0.36 0.30 -0.00 2.33 3.08 -0.99 -3.04 114.38 116.42 1apy h ARG 43 Ca 0.01 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 59.95 1apy h ARG 43 Cb 1.01 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.04 1apy h ARG 43 CO 0.09 0.56 -0.00 0.39 -1.07 0.00 0.00 179.97 179.94 1apy n GLU 44 N -4.70 1.12 -3.92 0.04 1.02 0.00 -4.92 120.64 109.28 1apy n GLU 44 Ca -0.05 -0.19 -0.25 0.00 -0.02 0.00 0.00 57.16 56.65 1apy n GLU 44 Cb 0.25 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.16 1apy n GLU 44 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1apy n GLN 45 N -0.77 -3.50 -1.53 3.49 6.02 -0.24 -4.74 117.38 116.11 1apy n GLN 45 Ca 0.23 0.43 -0.57 0.00 -0.01 0.00 0.00 57.00 57.08 1apy n GLN 45 Cb 0.16 -4.61 -0.09 0.00 1.02 0.00 0.00 30.24 26.72 1apy n GLN 45 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1apy n ASP 47 N 7.05 -5.59 -0.10 0.00 2.03 -1.26 -1.70 116.55 116.99 1apy n ASP 47 Ca 0.38 0.42 -0.01 0.00 0.52 0.00 0.00 54.79 56.10 1apy n ASP 47 Cb 0.10 -4.60 -0.01 0.00 -0.72 0.00 0.00 41.12 35.89 1apy n ASP 47 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1apy n GLY 48 N -0.13 0.18 0.61 0.27 0.00 0.61 -4.78 105.19 101.96 1apy n GLY 48 Ca -0.17 -0.01 0.06 0.00 0.00 0.00 0.00 46.02 45.90 1apy n GLY 48 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1apy n SER 49 N -0.89 2.99 -3.83 1.61 3.41 -0.69 -3.99 113.62 112.23 1apy n SER 49 Ca -0.01 -2.18 -0.12 0.00 -0.26 0.00 0.00 58.87 56.29 1apy n SER 49 Cb 0.45 -0.26 -0.13 0.00 -0.26 0.00 0.00 64.21 64.01 1apy n SER 49 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1apy s VAL 50 N -1.32 -0.00 0.04 -3.33 1.01 -1.18 -5.00 120.40 110.61 1apy s VAL 50 Ca 0.24 0.01 0.00 0.00 0.00 0.00 0.00 61.98 62.24 1apy s VAL 50 Cb 0.15 -0.15 0.00 0.00 0.00 0.00 0.00 36.38 36.38 1apy s VAL 50 CO 0.13 0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.85 1apy n GLY 51 N 3.12 -2.21 3.31 4.51 0.00 -1.26 -4.01 105.19 108.65 1apy n GLY 51 Ca -0.13 -1.48 -0.30 0.00 0.00 0.00 0.00 46.02 44.10 1apy n GLY 51 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1apy s PHE 52 N -1.08 -0.50 -1.87 1.61 -0.71 -1.26 -4.11 117.98 110.05 1apy s PHE 52 Ca 0.00 0.63 0.00 0.00 -1.04 0.00 0.00 56.93 56.52 1apy s PHE 52 Cb 0.00 -2.89 0.00 0.00 -1.21 0.00 0.00 43.02 38.92 1apy s PHE 52 CO 0.00 -4.95 0.00 0.41 -1.34 0.00 0.00 175.22 169.34 1apy n GLY 53 N 1.43 0.54 3.36 1.99 0.00 0.10 -4.91 105.19 107.70 1apy n GLY 53 Ca 0.12 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.04 1apy n GLY 53 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1apy s GLY 54 N -2.32 0.37 -1.35 -0.02 0.00 -1.26 -4.39 107.32 98.34 1apy s GLY 54 Ca 0.00 -0.77 -0.19 0.00 0.00 0.00 0.00 44.72 43.76 1apy s GLY 54 CO 0.00 -0.74 0.41 1.44 0.00 0.00 0.00 173.10 174.21 1apy n SER 55 N -0.23 -2.03 -4.77 1.64 7.64 -1.26 -4.69 113.62 109.92 1apy n SER 55 Ca -0.08 -1.27 -0.40 0.00 1.01 0.00 0.00 58.87 58.12 1apy n SER 55 Cb 0.63 -1.76 0.01 0.00 -1.01 0.00 0.00 64.21 62.08 1apy n SER 55 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1apy s PRO 56 N -7.34 3.84 0.00 1.43 0.04 -1.26 -4.73 135.00 126.99 1apy s PRO 56 Ca 0.28 2.51 0.00 0.00 0.04 0.00 0.00 61.00 63.83 1apy s PRO 56 Cb -0.15 -2.78 0.00 0.00 0.04 0.00 0.00 34.50 31.61 1apy s PRO 56 CO 0.98 -0.73 0.00 -0.40 0.04 0.00 0.00 177.00 176.89 1apy n ASP 57 N 0.06 -0.08 0.22 6.66 5.68 -0.02 -4.79 116.55 124.27 1apy n ASP 57 Ca 0.03 -0.73 0.07 0.00 -0.50 0.00 0.00 54.79 53.66 1apy n ASP 57 Cb 0.40 0.00 0.59 0.00 -1.14 0.00 0.00 41.12 40.97 1apy n ASP 57 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1apy h GLU 58 N 0.00 0.07 -0.01 0.11 5.08 -1.95 -0.68 114.58 117.20 1apy h GLU 58 Ca 0.00 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1apy h GLU 58 Cb 0.00 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.24 1apy h GLU 58 CO 0.00 0.08 -0.09 1.28 -1.00 0.00 0.00 179.01 179.28 1apy n LEU 59 N -4.49 1.38 0.00 1.33 4.77 -1.26 -4.93 117.00 113.80 1apy n LEU 59 Ca -0.02 -0.43 0.00 0.00 -0.03 0.00 0.00 56.01 55.53 1apy n LEU 59 Cb 0.12 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 1apy n LEU 59 CO 0.35 0.24 0.00 0.61 -1.33 0.00 0.00 177.39 177.25 1apy n GLY 60 N 1.24 0.75 3.83 -0.72 0.00 -0.26 -5.05 105.19 104.97 1apy n GLY 60 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 1apy n GLY 60 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1apy s GLU 61 N -0.53 3.92 -0.26 1.61 2.12 -1.26 -4.56 118.70 119.75 1apy s GLU 61 Ca 0.00 0.34 -0.14 0.00 0.36 0.00 0.00 54.97 55.53 1apy s GLU 61 Cb 0.00 -3.25 -0.04 0.00 0.26 0.00 0.00 34.13 31.10 1apy s GLU 61 CO 0.00 0.64 0.32 0.99 -0.54 0.00 0.00 175.26 176.67 1apy s THR 62 N -0.86 5.22 -0.03 -1.70 2.01 -1.26 -0.84 115.64 118.18 1apy s THR 62 Ca 0.23 0.49 0.06 0.00 0.31 0.00 0.00 61.69 62.78 1apy s THR 62 Cb -0.16 -3.65 -0.01 0.00 0.01 0.00 0.00 72.50 68.68 1apy s THR 62 CO 0.12 0.21 -0.23 0.42 -0.69 0.00 0.00 174.62 174.45 1apy s THR 63 N 1.77 1.81 0.04 -0.82 -4.23 -1.26 -4.65 115.64 108.30 1apy s THR 63 Ca 0.14 -0.96 0.01 0.00 -1.18 0.00 0.00 61.69 59.70 1apy s THR 63 Cb -0.15 -1.51 -0.04 0.00 1.34 0.00 0.00 72.50 72.13 1apy s THR 63 CO 0.09 0.51 0.10 -0.76 -0.54 0.00 0.00 174.62 174.02 1apy s LEU 64 N -0.36 3.91 -0.04 4.79 1.43 -0.75 -4.82 118.68 122.84 1apy s LEU 64 Ca 0.04 0.09 0.05 0.00 -1.03 0.00 0.00 54.13 53.28 1apy s LEU 64 Cb -0.10 -2.45 -0.01 0.00 0.03 0.00 0.00 46.19 43.66 1apy s LEU 64 CO 0.01 0.22 -0.18 -1.81 0.23 0.00 0.00 176.35 174.81 1apy s ASP 65 N -2.12 2.23 0.04 2.29 1.01 -1.26 -1.31 116.67 117.54 1apy s ASP 65 Ca 0.27 -0.36 -0.27 0.00 0.71 0.00 0.00 52.55 52.90 1apy s ASP 65 Cb -0.12 -0.51 0.07 0.00 1.01 0.00 0.00 42.92 43.36 1apy s ASP 65 CO 0.19 0.18 0.63 0.00 0.21 0.00 0.00 175.17 176.39 1apy s ALA 66 N -0.11 -1.66 0.04 5.23 0.00 -0.79 -4.95 121.76 119.51 1apy s ALA 66 Ca -0.01 0.94 -0.19 0.00 0.00 0.00 0.00 51.96 52.70 1apy s ALA 66 Cb -0.10 0.37 0.04 0.00 0.00 0.00 0.00 23.12 23.42 1apy s ALA 66 CO 0.01 -0.53 0.43 0.00 0.00 0.00 0.00 175.76 175.67 1apy s MET 67 N -2.26 0.92 -0.01 0.00 0.23 -1.26 -1.21 119.30 115.70 1apy s MET 67 Ca -0.06 -0.30 0.00 0.00 -1.03 0.00 0.00 55.69 54.30 1apy s MET 67 Cb -0.00 0.41 0.02 0.00 -1.53 0.00 0.00 34.83 33.73 1apy s MET 67 CO 0.00 -0.31 0.02 -1.50 -2.03 0.00 0.00 175.02 171.19 1apy s ILE 68 N -2.32 -0.02 -0.06 3.16 2.07 0.01 -5.00 121.20 119.04 1apy s ILE 68 Ca -0.06 0.11 0.04 0.00 -1.41 0.00 0.00 60.65 59.33 1apy s ILE 68 Cb -0.01 -0.05 0.00 0.00 0.13 0.00 0.00 42.46 42.53 1apy s ILE 68 CO -0.01 0.05 -0.16 -0.32 -1.91 0.00 0.00 174.94 172.59 1apy s MET 69 N 0.58 1.94 -0.35 3.50 -2.45 -1.26 -1.60 119.30 119.66 1apy s MET 69 Ca -0.05 -0.58 -0.19 0.00 -1.25 0.00 0.00 55.69 53.63 1apy s MET 69 Cb -0.07 -1.61 -0.00 0.00 1.25 0.00 0.00 34.83 34.40 1apy s MET 69 CO -0.02 0.16 0.54 0.34 1.05 0.00 0.00 175.02 177.09 1apy s ASP 70 N 0.30 6.34 0.11 1.11 -1.08 -0.33 -4.96 116.67 118.17 1apy s ASP 70 Ca -0.10 0.01 0.22 0.00 -0.52 0.00 0.00 52.55 52.17 1apy s ASP 70 Cb -0.14 -2.28 0.89 0.00 -1.46 0.00 0.00 42.92 39.94 1apy s ASP 70 CO 0.04 -0.50 1.70 0.61 0.52 0.00 0.00 175.17 177.53 1apy n GLY 71 N 4.76 -1.32 0.08 2.66 0.00 -1.26 -0.04 105.19 110.07 1apy n GLY 71 Ca -0.04 -0.02 -0.16 0.00 0.00 0.00 0.00 46.02 45.80 1apy n GLY 71 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1apy h THR 72 N 0.00 1.48 0.00 2.61 2.02 -1.96 -3.38 112.91 113.68 1apy h THR 72 Ca 0.00 -2.25 0.00 0.00 0.77 0.00 0.00 66.41 64.93 1apy h THR 72 Cb 0.43 2.93 0.00 0.00 -1.74 0.00 0.00 68.15 69.77 1apy h THR 72 CO 0.00 0.50 -1.55 0.35 0.37 0.00 0.00 175.52 175.19 1apy n THR 73 N -4.57 0.18 -2.23 3.16 -2.24 -1.24 -4.97 114.28 102.37 1apy n THR 73 Ca -0.16 -0.45 -0.13 0.00 -2.27 0.00 0.00 64.05 61.04 1apy n THR 73 Cb 0.52 -0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.74 1apy n THR 73 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1apy n MET 74 N -2.28 -1.06 -2.80 -0.78 2.81 0.94 -5.01 117.12 108.94 1apy n MET 74 Ca -0.02 0.65 -0.35 0.00 -1.81 0.00 0.00 57.70 56.17 1apy n MET 74 Cb 0.53 -4.89 -0.07 0.00 -0.71 0.00 0.00 33.22 28.09 1apy n MET 74 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1apy s ASP 75 N -2.41 7.18 0.02 7.83 1.01 -1.17 -4.86 116.67 124.28 1apy s ASP 75 Ca 0.00 1.77 0.02 0.00 0.71 0.00 0.00 52.55 55.05 1apy s ASP 75 Cb 0.00 -2.56 -0.01 0.00 1.01 0.00 0.00 42.92 41.36 1apy s ASP 75 CO 0.00 -0.17 -0.06 -0.69 0.21 0.00 0.00 175.17 174.46 1apy s VAL 76 N -1.82 0.39 -0.06 -1.27 1.01 -1.26 -1.18 120.40 116.20 1apy s VAL 76 Ca 0.54 -0.60 0.02 0.00 0.00 0.00 0.00 61.98 61.94 1apy s VAL 76 Cb -0.15 -0.41 0.02 0.00 0.00 0.00 0.00 36.38 35.84 1apy s VAL 76 CO 0.20 -0.15 -0.10 -0.83 0.00 0.00 0.00 175.10 174.21 1apy s GLY 77 N -0.81 0.73 0.05 4.51 0.00 -0.63 -4.46 107.32 106.71 1apy s GLY 77 Ca -0.05 -0.35 -0.17 0.00 0.00 0.00 0.00 44.72 44.16 1apy s GLY 77 CO -0.00 0.23 0.39 0.00 0.00 0.00 0.00 173.10 173.72 1apy s ALA 78 N 0.79 -0.93 0.00 3.20 0.00 0.10 -0.81 121.76 124.11 1apy s ALA 78 Ca -0.13 0.21 0.00 0.00 0.00 0.00 0.00 51.96 52.04 1apy s ALA 78 Cb -0.15 0.38 -0.00 0.00 0.00 0.00 0.00 23.12 23.34 1apy s ALA 78 CO 0.02 -0.47 -0.01 0.14 0.00 0.00 0.00 175.76 175.45 1apy s VAL 79 N -2.64 0.03 0.00 0.00 -7.23 -0.35 -2.08 120.40 108.13 1apy s VAL 79 Ca -0.04 -0.16 0.04 0.00 -1.81 0.00 0.00 61.98 60.00 1apy s VAL 79 Cb -0.00 -0.06 -0.01 0.00 0.56 0.00 0.00 36.38 36.86 1apy s VAL 79 CO -0.04 -0.08 -0.12 -0.83 -0.31 0.00 0.00 175.10 173.72 1apy s GLY 80 N -0.25 0.60 -1.38 2.32 0.00 -0.88 -1.89 107.32 105.83 1apy s GLY 80 Ca -0.03 -0.56 -0.09 0.00 0.00 0.00 0.00 44.72 44.05 1apy s GLY 80 CO -0.00 -0.49 1.09 1.34 0.00 0.00 0.00 173.10 175.03 1apy n ASP 81 N 2.59 -5.16 -4.70 1.64 2.03 -1.11 -1.12 116.55 110.72 1apy n ASP 81 Ca -0.15 -0.63 -0.42 0.00 0.52 0.00 0.00 54.79 54.11 1apy n ASP 81 Cb 0.56 -4.70 -0.03 0.00 -0.72 0.00 0.00 41.12 36.23 1apy n ASP 81 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1apy s LEU 82 N -7.16 4.34 -0.08 -2.67 2.96 -0.43 -2.15 118.68 113.50 1apy s LEU 82 Ca 0.50 2.13 0.02 0.00 -0.22 0.00 0.00 54.13 56.56 1apy s LEU 82 Cb -0.23 -3.57 -0.02 0.00 0.50 0.00 0.00 46.19 42.86 1apy s LEU 82 CO 0.76 -0.63 -0.13 -0.13 -1.32 0.00 0.00 176.35 174.90 1apy s ARG 83 N 1.70 2.84 -1.70 1.98 0.52 -1.26 -1.80 118.95 121.22 1apy s ARG 83 Ca 0.62 -0.67 -0.01 0.00 -0.52 0.00 0.00 55.73 55.15 1apy s ARG 83 Cb -0.32 -2.50 0.00 0.00 0.52 0.00 0.00 34.95 32.65 1apy s ARG 83 CO 0.28 0.49 0.20 0.54 0.02 0.00 0.00 175.30 176.83 1apy n ARG 84 N 2.70 -2.70 -3.70 3.54 1.74 -1.26 -4.70 116.66 112.29 1apy n ARG 84 Ca -0.18 0.97 -0.18 0.00 -0.77 0.00 0.00 57.85 57.70 1apy n ARG 84 Cb 0.52 -5.69 -0.17 0.00 -1.02 0.00 0.00 32.46 26.10 1apy n ARG 84 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1apy s ILE 85 N -3.08 -0.10 0.07 0.55 -1.09 -1.26 -0.63 121.20 115.66 1apy s ILE 85 Ca 0.10 0.36 -0.14 0.00 -2.23 0.00 0.00 60.65 58.74 1apy s ILE 85 Cb -0.04 -0.13 -0.25 0.00 -1.58 0.00 0.00 42.46 40.46 1apy s ILE 85 CO 0.12 0.15 1.16 0.11 -1.23 0.00 0.00 174.94 175.25 1apy h LYS 86 N 8.08 0.68 -3.90 2.79 1.57 -1.89 -3.40 116.57 120.50 1apy h LYS 86 Ca -0.23 -0.78 -0.74 0.00 -1.87 0.00 0.00 60.65 57.04 1apy h LYS 86 Cb 1.12 0.23 -0.12 0.00 0.08 0.00 0.00 32.23 33.54 1apy h LYS 86 CO 0.25 1.34 2.28 -1.71 -0.57 0.00 0.00 179.45 181.05 1apy n ASN 87 N -3.85 4.75 -0.06 0.86 4.05 -1.26 -4.71 115.26 115.04 1apy n ASN 87 Ca -0.12 -3.01 -0.08 0.00 0.45 0.00 0.00 54.58 51.82 1apy n ASN 87 Cb 0.91 -1.55 -0.02 0.00 1.23 0.00 0.00 39.78 40.35 1apy n ASN 87 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1apy h ALA 88 N 6.06 0.20 0.00 5.20 0.00 -1.97 -1.37 119.26 127.37 1apy h ALA 88 Ca 0.44 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.42 1apy h ALA 88 Cb 0.67 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.59 1apy h ALA 88 CO 1.65 -0.44 0.00 0.97 0.00 0.00 0.00 179.25 181.44 1apy h ILE 89 N 0.05 0.00 -0.07 0.00 2.10 -1.91 -1.04 117.51 116.64 1apy h ILE 89 Ca 0.12 -0.38 -0.16 0.00 1.08 0.00 0.00 64.86 65.51 1apy h ILE 89 Cb 0.16 1.31 0.01 0.00 -1.09 0.00 0.00 36.82 37.21 1apy h ILE 89 CO -0.21 0.00 -0.60 1.23 -1.08 0.00 0.00 178.15 177.50 1apy h GLY 90 N 1.80 0.59 1.26 8.18 0.00 -1.64 -2.43 103.07 110.82 1apy h GLY 90 Ca 0.00 -0.89 -0.10 0.00 0.00 0.00 0.00 47.33 46.35 1apy h GLY 90 CO 0.00 0.79 -0.08 -2.08 0.00 0.00 0.00 176.54 175.17 1apy h VAL 91 N 0.12 1.26 -0.86 4.60 2.07 -0.72 -2.45 116.25 120.27 1apy h VAL 91 Ca -0.05 -1.17 0.01 0.00 0.82 0.00 0.00 66.70 66.31 1apy h VAL 91 Cb 1.26 0.96 -0.04 0.00 -1.52 0.00 0.00 31.29 31.95 1apy h VAL 91 CO 0.12 0.41 0.57 0.00 0.02 0.00 0.00 177.57 178.69 1apy h ALA 92 N 1.11 1.10 -0.22 1.67 0.00 -1.20 -1.59 119.26 120.12 1apy h ALA 92 Ca 0.14 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 1apy h ALA 92 Cb 0.59 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1apy h ALA 92 CO 0.04 0.49 -0.27 -0.09 0.00 0.00 0.00 179.25 179.41 1apy h ARG 93 N 1.16 0.43 0.00 0.00 2.43 -1.13 -2.26 114.38 115.00 1apy h ARG 93 Ca 0.32 -0.16 -0.08 0.00 -0.81 0.00 0.00 59.98 59.25 1apy h ARG 93 Cb -0.12 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.40 1apy h ARG 93 CO -0.07 0.67 -0.38 0.87 -1.51 0.00 0.00 179.97 179.54 1apy h LYS 94 N 0.38 0.00 -0.58 0.20 1.79 -0.89 -0.92 116.57 116.55 1apy h LYS 94 Ca 0.05 0.00 -0.10 0.00 -2.18 0.00 0.00 60.65 58.42 1apy h LYS 94 Cb 0.68 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.30 1apy h LYS 94 CO 0.05 0.38 -0.04 0.28 -1.08 0.00 0.00 179.45 179.04 1apy h VAL 95 N 0.00 1.27 -0.46 0.50 2.07 -0.75 0.55 116.25 119.42 1apy h VAL 95 Ca -0.00 -1.19 -0.10 0.00 0.82 0.00 0.00 66.70 66.22 1apy h VAL 95 Cb 0.70 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 1apy h VAL 95 CO 0.05 0.43 -0.10 0.25 0.02 0.00 0.00 177.57 178.21 1apy h LEU 96 N 0.94 0.89 0.00 2.57 5.85 -0.99 -2.62 115.31 121.95 1apy h LEU 96 Ca 0.16 -0.36 -0.23 0.00 0.84 0.00 0.00 57.88 58.30 1apy h LEU 96 Cb 0.60 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.35 1apy h LEU 96 CO 0.04 1.04 -1.30 -0.33 -0.34 0.00 0.00 178.44 177.55 1apy h GLU 97 N 0.73 0.00 -0.17 1.25 5.08 -1.11 -3.39 114.58 116.96 1apy h GLU 97 Ca 0.12 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1apy h GLU 97 Cb 0.65 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.90 1apy h GLU 97 CO 0.04 0.64 0.00 0.72 -1.00 0.00 0.00 179.01 179.41 1apy n HIS 98 N -3.14 0.22 -4.16 4.33 8.25 0.18 -5.01 115.22 115.88 1apy n HIS 98 Ca -0.08 -0.22 -0.11 0.00 -0.26 0.00 0.00 57.72 57.04 1apy n HIS 98 Cb 0.95 -0.01 -0.09 0.00 1.12 0.00 0.00 29.99 31.96 1apy n HIS 98 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1apy s THR 99 N -0.99 0.01 -1.65 1.59 -4.23 -0.99 -5.02 115.64 104.36 1apy s THR 99 Ca 0.18 -1.90 0.17 0.00 -1.18 0.00 0.00 61.69 58.97 1apy s THR 99 Cb 0.11 -2.40 0.37 0.00 1.34 0.00 0.00 72.50 71.93 1apy s THR 99 CO 0.16 -0.05 1.29 0.35 -0.54 0.00 0.00 174.62 175.82 1apy n THR 100 N -0.27 0.70 -2.25 3.99 -2.24 -1.26 -4.73 114.28 108.22 1apy n THR 100 Ca 0.01 -0.85 -0.26 0.00 -2.27 0.00 0.00 64.05 60.68 1apy n THR 100 Cb 0.65 0.76 0.10 0.00 -2.10 0.00 0.00 70.33 69.74 1apy n THR 100 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1apy s HIS 101 N -1.13 2.29 -0.05 4.78 3.76 -1.26 -5.05 115.29 118.63 1apy s HIS 101 Ca 0.31 0.22 0.01 0.00 -0.15 0.00 0.00 55.06 55.45 1apy s HIS 101 Cb 0.17 -3.33 -0.03 0.00 1.11 0.00 0.00 32.58 30.50 1apy s HIS 101 CO 0.24 -1.74 -0.04 2.41 -0.85 0.00 0.00 174.74 174.76 1apy n THR 102 N -3.06 0.29 -4.14 1.30 -1.04 -1.26 -4.74 114.28 101.63 1apy n THR 102 Ca 0.11 -0.11 -0.19 0.00 -2.04 0.00 0.00 64.05 61.82 1apy n THR 102 Cb 0.60 -0.69 -0.16 0.00 -1.82 0.00 0.00 70.33 68.26 1apy n THR 102 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 1apy s LEU 103 N -5.24 1.35 -0.02 -4.42 2.96 -1.26 -0.72 118.68 111.31 1apy s LEU 103 Ca -0.07 -0.11 0.06 0.00 -0.22 0.00 0.00 54.13 53.80 1apy s LEU 103 Cb 0.02 -0.40 -0.01 0.00 0.50 0.00 0.00 46.19 46.29 1apy s LEU 103 CO 0.12 -0.05 -0.22 -0.76 -1.32 0.00 0.00 176.35 174.12 1apy s LEU 104 N 0.86 2.03 0.23 -0.68 1.02 -0.88 -5.01 118.68 116.25 1apy s LEU 104 Ca -0.11 -0.41 0.05 0.00 0.02 0.00 0.00 54.13 53.68 1apy s LEU 104 Cb -0.14 -1.15 -0.05 0.00 0.02 0.00 0.00 46.19 44.87 1apy s LEU 104 CO 0.00 0.26 -0.04 0.68 0.02 0.00 0.00 176.35 177.27 1apy s VAL 105 N -0.42 1.26 0.00 -1.59 -7.23 -1.26 -2.07 120.40 109.09 1apy s VAL 105 Ca 0.06 -2.07 0.00 0.00 -1.81 0.00 0.00 61.98 58.15 1apy s VAL 105 Cb -0.09 -2.28 0.00 0.00 0.56 0.00 0.00 36.38 34.56 1apy s VAL 105 CO 0.00 -0.40 0.00 0.61 -0.31 0.00 0.00 175.10 175.00 1apy n GLY 106 N -0.43 1.06 0.32 2.32 0.00 -0.27 -1.94 105.19 106.26 1apy n GLY 106 Ca -0.06 -0.57 0.21 0.00 0.00 0.00 0.00 46.02 45.59 1apy n GLY 106 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1apy h GLU 107 N 0.00 0.00 -0.12 1.61 9.09 -1.93 -1.32 114.58 121.91 1apy h GLU 107 Ca 0.00 0.00 -0.20 0.00 0.05 0.00 0.00 59.36 59.21 1apy h GLU 107 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 1apy h GLU 107 CO 0.00 0.01 -0.75 0.77 0.05 0.00 0.00 179.01 179.09 1apy h SER 108 N 0.00 0.72 0.44 3.06 0.02 -1.91 -2.94 113.55 112.94 1apy h SER 108 Ca -0.00 -0.47 -0.07 0.00 -0.84 0.00 0.00 61.79 60.42 1apy h SER 108 Cb 0.07 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.38 1apy h SER 108 CO 0.00 1.24 -0.31 0.00 -1.14 0.00 0.00 176.83 176.62 1apy h ALA 109 N 0.75 1.31 -0.16 3.77 0.00 -0.56 -2.43 119.26 121.94 1apy h ALA 109 Ca -0.04 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.57 1apy h ALA 109 Cb 1.35 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 1apy h ALA 109 CO 0.14 0.39 0.01 1.15 0.00 0.00 0.00 179.25 180.94 1apy h THR 110 N 0.00 1.24 -0.55 0.00 2.02 -1.38 -0.05 112.91 114.19 1apy h THR 110 Ca -0.00 -0.79 0.05 0.00 0.77 0.00 0.00 66.41 66.43 1apy h THR 110 Cb 0.61 1.46 -0.05 0.00 -1.74 0.00 0.00 68.15 68.44 1apy h THR 110 CO 0.04 0.24 0.28 0.74 0.37 0.00 0.00 175.52 177.19 1apy h THR 111 N 0.03 0.96 -0.27 3.16 2.02 -1.34 0.06 112.91 117.53 1apy h THR 111 Ca 0.05 -0.19 0.01 0.00 0.77 0.00 0.00 66.41 67.05 1apy h THR 111 Cb 0.35 0.36 -0.02 0.00 -1.74 0.00 0.00 68.15 67.11 1apy h THR 111 CO 0.01 0.10 0.15 0.15 0.37 0.00 0.00 175.52 176.30 1apy h PHE 112 N 0.54 0.28 -0.73 3.16 3.57 -1.26 -1.92 116.94 120.59 1apy h PHE 112 Ca 0.24 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.76 1apy h PHE 112 Cb 0.15 -0.09 -0.04 0.00 2.79 0.00 0.00 35.95 38.76 1apy h PHE 112 CO -0.10 0.17 0.49 0.00 -2.23 0.00 0.00 178.31 176.64 1apy h ALA 113 N 1.12 1.49 -0.35 2.41 0.00 -0.21 -1.19 119.26 122.54 1apy h ALA 113 Ca 0.10 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.85 1apy h ALA 113 Cb 0.00 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 1apy h ALA 113 CO -0.05 0.47 -0.25 1.96 0.00 0.00 0.00 179.25 181.38 1apy h GLN 114 N 0.98 0.70 -0.23 0.00 4.20 -0.67 0.38 115.11 120.47 1apy h GLN 114 Ca 0.27 -0.29 -0.05 0.00 0.06 0.00 0.00 58.65 58.65 1apy h GLN 114 Cb -0.09 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.65 1apy h GLN 114 CO -0.06 0.88 -0.06 0.77 -0.67 0.00 0.00 178.83 179.69 1apy h SER 115 N 0.61 0.34 -0.09 1.46 0.02 -0.45 -1.79 113.55 113.64 1apy h SER 115 Ca 0.08 -0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 1apy h SER 115 Cb 0.74 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.19 1apy h SER 115 CO 0.06 0.44 0.00 0.23 -1.14 0.00 0.00 176.83 176.42 1apy n MET 116 N -4.29 1.33 -0.14 3.45 2.81 -0.70 -4.90 117.12 114.68 1apy n MET 116 Ca 0.00 -0.51 0.00 0.00 -1.81 0.00 0.00 57.70 55.39 1apy n MET 116 Cb 0.24 -1.28 0.00 0.00 -0.71 0.00 0.00 33.22 31.47 1apy n MET 116 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1apy n GLY 117 N 0.89 0.82 3.81 3.03 0.00 -0.67 -5.06 105.19 108.00 1apy n GLY 117 Ca 0.13 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 1apy n GLY 117 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1apy s PHE 118 N -2.08 3.58 -0.18 1.61 0.40 0.08 -4.98 117.98 116.39 1apy s PHE 118 Ca 0.00 1.56 -0.25 0.00 -0.60 0.00 0.00 56.93 57.64 1apy s PHE 118 Cb 0.00 -2.76 -0.01 0.00 0.51 0.00 0.00 43.02 40.75 1apy s PHE 118 CO 0.00 0.19 0.83 0.42 0.70 0.00 0.00 175.22 177.36 1apy s ILE 119 N -1.72 4.87 -0.38 0.64 1.01 -1.26 -4.23 121.20 120.14 1apy s ILE 119 Ca 0.50 1.61 -0.29 0.00 0.00 0.00 0.00 60.65 62.48 1apy s ILE 119 Cb -0.15 -4.13 0.02 0.00 0.01 0.00 0.00 42.46 38.21 1apy s ILE 119 CO 0.20 0.01 1.10 0.21 0.00 0.00 0.00 174.94 176.46 1apy s ASN 120 N 1.19 6.81 0.06 3.58 3.84 -1.26 -4.59 114.94 124.57 1apy s ASN 120 Ca 0.37 0.81 -0.08 0.00 0.21 0.00 0.00 52.86 54.17 1apy s ASN 120 Cb -0.16 -2.54 -0.00 0.00 -0.55 0.00 0.00 41.25 37.99 1apy s ASN 120 CO 0.11 -1.03 0.17 -1.83 -2.79 0.00 0.00 177.10 171.74 1apy s GLU 121 N 3.97 0.75 0.31 0.43 -1.05 0.20 -5.03 118.70 118.28 1apy s GLU 121 Ca 0.46 -0.82 -0.29 0.00 -0.15 0.00 0.00 54.97 54.17 1apy s GLU 121 Cb -0.10 0.30 -0.10 0.00 -0.44 0.00 0.00 34.13 33.79 1apy s GLU 121 CO 0.22 -0.22 1.39 0.34 0.95 0.00 0.00 175.26 177.94 1apy s ASP 122 N -2.49 6.63 0.00 0.83 2.15 -1.26 -4.09 116.67 118.45 1apy s ASP 122 Ca 0.00 2.77 0.23 0.00 0.43 0.00 0.00 52.55 55.98 1apy s ASP 122 Cb 0.02 -2.64 0.41 0.00 -0.30 0.00 0.00 42.92 40.41 1apy s ASP 122 CO -0.08 -0.67 1.39 0.18 -0.17 0.00 0.00 175.17 175.83 1apy n LEU 123 N 1.24 3.20 -4.89 -1.34 4.77 -1.26 -4.97 117.00 113.75 1apy n LEU 123 Ca 0.03 -1.31 -0.29 0.00 -0.03 0.00 0.00 56.01 54.41 1apy n LEU 123 Cb 0.41 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 1apy n LEU 123 CO 0.61 0.65 0.55 -0.44 -1.33 0.00 0.00 177.39 177.43 1apy s SER 124 N -1.62 6.27 0.09 -1.43 0.01 -1.26 -0.72 113.70 115.04 1apy s SER 124 Ca 0.36 1.12 -0.03 0.00 1.31 0.00 0.00 55.95 58.71 1apy s SER 124 Cb 0.22 -2.33 -0.03 0.00 0.21 0.00 0.00 66.02 64.08 1apy s SER 124 CO 0.31 -0.67 0.06 0.42 0.41 0.00 0.00 173.24 173.76 1apy s THR 125 N -2.88 0.16 0.39 1.44 -4.23 -1.26 -4.77 115.64 104.50 1apy s THR 125 Ca 0.50 -1.70 0.10 0.00 -1.18 0.00 0.00 61.69 59.41 1apy s THR 125 Cb -0.11 -1.66 0.31 0.00 1.34 0.00 0.00 72.50 72.39 1apy s THR 125 CO 0.47 -0.74 1.96 0.77 -0.54 0.00 0.00 174.62 176.54 1apy h SER 126 N 2.96 0.52 -0.44 3.99 4.64 -1.99 -0.18 113.55 123.06 1apy h SER 126 Ca -0.34 0.01 -0.06 0.00 -0.47 0.00 0.00 61.79 60.93 1apy h SER 126 Cb 1.17 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 63.15 1apy h SER 126 CO 0.61 0.32 0.02 0.00 -0.87 0.00 0.00 176.83 176.91 1apy h ALA 127 N 1.65 0.59 0.00 5.18 0.00 -1.96 -1.74 119.26 122.98 1apy h ALA 127 Ca 0.32 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 1apy h ALA 127 Cb 0.46 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1apy h ALA 127 CO -0.10 0.36 -0.34 0.66 0.00 0.00 0.00 179.25 179.83 1apy h SER 128 N 0.60 0.00 0.01 0.00 4.64 -1.56 -2.62 113.55 114.63 1apy h SER 128 Ca 0.13 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.25 1apy h SER 128 Cb 0.46 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.55 1apy h SER 128 CO 0.02 0.34 -0.70 1.56 -0.87 0.00 0.00 176.83 177.17 1apy h GLN 129 N 0.00 0.62 -0.14 4.77 4.20 -0.82 -2.77 115.11 120.96 1apy h GLN 129 Ca -0.00 -0.48 -0.04 0.00 0.06 0.00 0.00 58.65 58.19 1apy h GLN 129 Cb 1.04 0.09 -0.00 0.00 0.30 0.00 0.00 27.48 28.91 1apy h GLN 129 CO 0.04 1.10 -0.07 0.00 -0.67 0.00 0.00 178.83 179.24 1apy h ALA 130 N 0.77 0.20 -0.85 3.87 0.00 -1.28 -2.24 119.26 119.74 1apy h ALA 130 Ca -0.03 -0.26 0.16 0.00 0.00 0.00 0.00 54.91 54.77 1apy h ALA 130 Cb 1.30 -0.05 -0.10 0.00 0.00 0.00 0.00 17.79 18.94 1apy h ALA 130 CO 0.14 -0.00 0.43 1.25 0.00 0.00 0.00 179.25 181.06 1apy h LEU 131 N -0.03 0.50 -0.41 0.00 5.85 -1.48 0.99 115.31 120.72 1apy h LEU 131 Ca 0.03 0.10 -0.16 0.00 0.84 0.00 0.00 57.88 58.69 1apy h LEU 131 Cb 0.53 0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.58 1apy h LEU 131 CO 0.02 0.19 -0.45 -0.74 -0.34 0.00 0.00 178.44 177.12 1apy h HIS 132 N 0.59 1.04 -0.06 1.25 2.76 -1.38 -1.95 115.15 117.41 1apy h HIS 132 Ca 0.47 -0.33 -0.16 0.00 -2.20 0.00 0.00 60.37 58.16 1apy h HIS 132 Cb 0.71 -0.21 -0.01 0.00 1.55 0.00 0.00 27.41 29.44 1apy h HIS 132 CO -0.10 1.14 -0.65 0.66 -1.30 0.00 0.00 177.93 177.68 1apy h SER 133 N 0.68 0.26 0.13 3.26 4.64 -0.66 -1.71 113.55 120.16 1apy h SER 133 Ca 0.04 -0.16 -0.14 0.00 -0.47 0.00 0.00 61.79 61.06 1apy h SER 133 Cb 1.03 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 63.04 1apy h SER 133 CO 0.10 0.84 -0.51 0.44 -0.87 0.00 0.00 176.83 176.84 1apy h ASP 134 N 0.16 0.46 -0.52 4.97 3.32 -0.82 -1.60 116.42 122.40 1apy h ASP 134 Ca -0.01 -0.23 -0.07 0.00 0.02 0.00 0.00 57.03 56.73 1apy h ASP 134 Cb 1.18 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 40.58 1apy h ASP 134 CO 0.10 0.89 0.04 -0.25 -1.72 0.00 0.00 179.24 178.31 1apy h TRP 135 N 0.33 0.95 -0.38 4.55 7.01 -1.17 -1.90 115.95 125.33 1apy h TRP 135 Ca 0.01 -0.15 -0.06 0.00 2.11 0.00 0.00 58.89 60.81 1apy h TRP 135 Cb 1.01 -0.25 -0.01 0.00 -2.10 0.00 0.00 29.16 27.80 1apy h TRP 135 CO 0.03 0.87 0.02 -0.07 -2.79 0.00 0.00 178.44 176.50 1apy h LEU 136 N 0.76 0.65 -1.77 0.65 3.38 -1.14 0.14 115.31 117.98 1apy h LEU 136 Ca 0.15 -0.30 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 1apy h LEU 136 Cb 0.46 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 1apy h LEU 136 CO 0.02 0.78 -0.08 0.00 0.09 0.00 0.00 178.44 179.26 1apy h ALA 137 N 0.89 1.81 -0.07 1.53 0.00 -1.20 -1.19 119.26 121.02 1apy h ALA 137 Ca 0.11 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1apy h ALA 137 Cb 0.44 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1apy h ALA 137 CO 0.02 0.14 0.00 -2.13 0.00 0.00 0.00 179.25 177.28 1apy n ARG 138 N -4.42 1.33 -2.59 0.00 0.63 -0.72 -4.84 116.66 106.05 1apy n ARG 138 Ca -0.02 -0.33 -0.17 0.00 -0.92 0.00 0.00 57.85 56.40 1apy n ARG 138 Cb 0.17 -1.36 0.01 0.00 0.45 0.00 0.00 32.46 31.73 1apy n ARG 138 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1apy n ASN 139 N -0.07 -5.10 -3.38 6.15 3.02 -0.45 -3.59 115.26 111.83 1apy n ASN 139 Ca 0.03 -0.12 -0.18 0.00 -0.03 0.00 0.00 54.58 54.28 1apy n ASN 139 Cb 0.23 -4.08 0.08 0.00 -0.61 0.00 0.00 39.78 35.41 1apy n ASN 139 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1apy s GLN 141 N -5.56 3.33 0.53 0.00 -1.52 -1.24 -3.88 119.66 111.33 1apy s GLN 141 Ca 0.15 -0.70 -0.01 0.00 -1.95 0.00 0.00 55.36 52.84 1apy s GLN 141 Cb -0.06 -2.66 0.02 0.00 -0.22 0.00 0.00 33.01 30.08 1apy s GLN 141 CO 0.70 0.11 0.77 -1.25 -0.25 0.00 0.00 175.29 175.38 1apy s PRO 142 N 0.60 2.79 0.25 2.91 0.04 -1.26 -4.93 135.00 135.40 1apy s PRO 142 Ca -0.08 -0.48 -0.08 0.00 0.04 0.00 0.00 61.00 60.40 1apy s PRO 142 Cb -0.16 -2.45 -0.01 0.00 0.04 0.00 0.00 34.50 31.92 1apy s PRO 142 CO 0.03 -0.57 0.40 0.54 0.04 0.00 0.00 177.00 177.43 1apy s ASN 143 N -4.33 0.12 -0.28 6.66 2.20 -1.25 -5.09 114.94 112.97 1apy s ASN 143 Ca 0.53 -1.12 0.09 0.00 -0.94 0.00 0.00 52.86 51.42 1apy s ASN 143 Cb -0.10 0.55 0.47 0.00 -2.00 0.00 0.00 41.25 40.17 1apy s ASN 143 CO 0.40 -1.10 1.38 -1.22 -2.94 0.00 0.00 177.10 173.62 1apy n TYR 144 N -0.38 1.02 -3.36 1.54 4.01 -1.26 -5.02 117.16 113.71 1apy n TYR 144 Ca -0.00 -1.70 -0.24 0.00 -0.16 0.00 0.00 57.90 55.80 1apy n TYR 144 Cb 0.63 -0.44 -0.01 0.00 -0.31 0.00 0.00 39.34 39.21 1apy n TYR 144 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 1apy s TRP 145 N -3.31 3.50 0.10 -0.72 0.52 -1.26 -5.11 118.94 112.66 1apy s TRP 145 Ca 0.44 0.36 -0.25 0.00 0.02 0.00 0.00 56.10 56.67 1apy s TRP 145 Cb 0.40 -1.91 0.08 0.00 -1.15 0.00 0.00 33.47 30.89 1apy s TRP 145 CO -0.02 0.11 0.69 -0.98 0.02 0.00 0.00 176.95 176.77 1apy s ARG 146 N -4.33 1.13 -1.30 4.98 1.70 -1.26 -4.91 118.95 114.96 1apy s ARG 146 Ca 0.40 -0.39 -0.05 0.00 -0.47 0.00 0.00 55.73 55.22 1apy s ARG 146 Cb -0.10 0.52 -0.00 0.00 -0.57 0.00 0.00 34.95 34.80 1apy s ARG 146 CO 0.36 -0.49 0.62 0.09 -1.08 0.00 0.00 175.30 174.81 1apy n ASN 147 N -0.29 -1.92 -4.02 -2.89 3.02 -1.26 -4.98 115.26 102.92 1apy n ASN 147 Ca -0.15 -0.93 -0.10 0.00 -0.03 0.00 0.00 54.58 53.38 1apy n ASN 147 Cb 0.64 -3.59 -0.06 0.00 -0.61 0.00 0.00 39.78 36.16 1apy n ASN 147 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 1apy s VAL 148 N -3.72 0.01 0.02 2.41 -7.23 -1.26 -4.47 120.40 106.15 1apy s VAL 148 Ca 0.12 -1.49 0.06 0.00 -1.81 0.00 0.00 61.98 58.85 1apy s VAL 148 Cb -0.04 -2.21 -0.02 0.00 0.56 0.00 0.00 36.38 34.68 1apy s VAL 148 CO 0.85 -0.03 -0.17 0.27 -0.31 0.00 0.00 175.10 175.71 1apy s ILE 149 N -4.03 1.32 1.10 -0.62 -4.36 0.48 -4.24 121.20 110.85 1apy s ILE 149 Ca 0.24 -0.94 -0.15 0.00 -0.26 0.00 0.00 60.65 59.55 1apy s ILE 149 Cb 0.01 -1.14 0.24 0.00 1.25 0.00 0.00 42.46 42.82 1apy s ILE 149 CO 0.08 0.19 1.09 -2.16 0.24 0.00 0.00 174.94 174.38 1apy s PRO 150 N -0.87 -0.40 -0.29 0.37 0.04 -1.26 -1.90 135.00 130.69 1apy s PRO 150 Ca 0.05 0.29 -0.33 0.00 0.04 0.00 0.00 61.00 61.05 1apy s PRO 150 Cb -0.07 -1.66 -0.09 0.00 0.04 0.00 0.00 34.50 32.71 1apy s PRO 150 CO 0.01 -3.24 2.19 -3.47 0.04 0.00 0.00 177.00 172.53 1apy n ASP 151 N -4.49 2.57 0.13 6.66 2.03 -1.26 -4.82 116.55 117.37 1apy n ASP 151 Ca 0.08 0.36 0.10 0.00 0.52 0.00 0.00 54.79 55.85 1apy n ASP 151 Cb 0.58 -1.37 0.49 0.00 -0.72 0.00 0.00 41.12 40.10 1apy n ASP 151 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1apy n PRO 152 N 8.33 0.14 -0.03 -0.67 -0.04 -1.26 -0.37 135.00 141.11 1apy n PRO 152 Ca 0.37 0.53 0.13 0.00 -0.04 0.00 0.00 63.50 64.48 1apy n PRO 152 Cb 0.31 -1.86 0.52 0.00 -0.04 0.00 0.00 33.50 32.42 1apy n PRO 152 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1apy n SER 153 N -2.14 1.33 0.00 3.54 3.41 -1.26 -4.31 113.62 114.18 1apy n SER 153 Ca 0.00 -1.52 0.00 0.00 -0.26 0.00 0.00 58.87 57.09 1apy n SER 153 Cb 0.11 -0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.02 1apy n SER 153 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1apy n LYS 154 N 0.06 0.50 -4.54 4.33 5.02 -0.16 -5.06 118.16 118.30 1apy n LYS 154 Ca 0.18 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 56.22 1apy n LYS 154 Cb 0.31 -0.60 -0.11 0.00 -0.02 0.00 0.00 35.03 34.61 1apy n LYS 154 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1apy s TYR 155 N -1.19 2.29 0.69 2.13 2.02 0.51 -4.80 117.35 118.99 1apy s TYR 155 Ca 0.00 -0.69 -0.06 0.00 -0.37 0.00 0.00 57.07 55.95 1apy s TYR 155 Cb 0.00 -1.48 0.06 0.00 -0.40 0.00 0.00 41.96 40.14 1apy s TYR 155 CO 0.00 0.37 0.99 0.00 -1.57 0.00 0.00 175.55 175.34 1apy n GLY 157 N -2.86 -0.54 3.75 0.00 0.00 -1.26 -4.78 105.19 99.50 1apy n GLY 157 Ca 0.08 -1.71 -0.38 0.00 0.00 0.00 0.00 46.02 44.01 1apy n GLY 157 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1apy s PRO 158 N -1.12 3.16 0.36 1.61 0.02 -1.26 -5.08 135.00 132.69 1apy s PRO 158 Ca 0.00 2.09 0.07 0.00 0.02 0.00 0.00 61.00 63.18 1apy s PRO 158 Cb 0.00 -2.20 -0.02 0.00 0.02 0.00 0.00 34.50 32.30 1apy s PRO 158 CO 0.00 -1.13 0.37 0.71 -0.33 0.00 0.00 177.00 176.62 1apy s TYR 159 N -1.39 2.89 -0.24 6.54 2.02 -1.26 -4.50 117.35 121.40 1apy s TYR 159 Ca 0.72 -0.34 -0.26 0.00 -0.37 0.00 0.00 57.07 56.82 1apy s TYR 159 Cb -0.37 -1.97 0.10 0.00 -0.40 0.00 0.00 41.96 39.32 1apy s TYR 159 CO 0.43 0.03 0.88 0.21 -1.57 0.00 0.00 175.55 175.53 1apy s LYS 160 N -4.09 0.69 0.35 -0.62 2.20 -0.80 -4.96 119.74 112.51 1apy s LYS 160 Ca 0.45 0.67 -0.28 0.00 -0.36 0.00 0.00 55.97 56.44 1apy s LYS 160 Cb -0.06 0.33 -0.10 0.00 -1.51 0.00 0.00 37.83 36.49 1apy s LYS 160 CO 0.28 -0.11 1.29 -1.25 -0.36 0.00 0.00 175.35 175.20 1apy s PRO 161 N 0.02 4.25 0.00 4.03 0.04 -1.26 -0.38 135.00 141.69 1apy s PRO 161 Ca 0.00 2.17 0.02 0.00 0.04 0.00 0.00 61.00 63.23 1apy s PRO 161 Cb -0.04 -2.98 0.13 0.00 0.04 0.00 0.00 34.50 31.65 1apy s PRO 161 CO -0.01 -0.26 0.61 -0.35 0.04 0.00 0.00 177.00 177.03