#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dla n MET 2 N 0.00 3.56 -4.23 2.12 0.00 -1.26 -5.03 117.12 112.29 2dla n MET 2 Ca 0.00 -4.57 -0.29 0.00 0.00 0.00 0.00 57.70 52.84 2dla n MET 2 Cb 0.00 -2.43 -0.10 0.00 0.00 0.00 0.00 33.22 30.69 2dla n MET 2 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 175.97 176.39 2dla s ILE 3 N -2.33 3.36 -0.21 2.02 1.01 -1.26 -3.99 121.20 119.80 2dla s ILE 3 Ca 0.33 -1.30 -0.29 0.00 0.00 0.00 0.00 60.65 59.38 2dla s ILE 3 Cb 0.04 -2.58 -0.01 0.00 0.01 0.00 0.00 42.46 39.92 2dla s ILE 3 CO 0.02 0.09 1.30 -0.04 0.00 0.00 0.00 174.94 176.31 2dla s MET 4 N -2.27 4.10 -0.13 2.79 -1.94 -1.26 -4.86 119.30 115.73 2dla s MET 4 Ca 0.22 1.53 0.18 0.00 -1.71 0.00 0.00 55.69 55.91 2dla s MET 4 Cb -0.11 -3.82 -0.25 0.00 2.01 0.00 0.00 34.83 32.66 2dla s MET 4 CO 0.14 -0.88 0.27 1.28 -0.01 0.00 0.00 175.02 175.82 2dla n LEU 5 N 7.05 0.16 -3.64 -0.03 4.77 -1.26 -4.87 117.00 119.18 2dla n LEU 5 Ca 0.14 0.07 -0.10 0.00 -0.03 0.00 0.00 56.01 56.10 2dla n LEU 5 Cb 0.45 0.34 -0.10 0.00 -2.33 0.00 0.00 43.42 41.78 2dla n LEU 5 CO 0.59 0.36 -0.02 -0.62 -1.33 0.00 0.00 177.39 176.37 2dla s ASP 6 N -5.39 -0.07 0.00 -1.43 -1.08 -1.23 -4.79 116.67 102.68 2dla s ASP 6 Ca -0.08 0.85 0.13 0.00 -0.52 0.00 0.00 52.55 52.92 2dla s ASP 6 Cb 0.08 1.18 0.70 0.00 -1.46 0.00 0.00 42.92 43.42 2dla s ASP 6 CO 0.84 -0.24 1.31 -2.65 0.52 0.00 0.00 175.17 174.95 2dla n PRO 7 N 5.38 0.25 -0.06 4.34 -0.02 -1.26 -2.09 135.00 141.54 2dla n PRO 7 Ca -0.08 0.12 0.02 0.00 -2.02 0.00 0.00 63.50 61.55 2dla n PRO 7 Cb 0.50 -1.50 0.06 0.00 -0.02 0.00 0.00 33.50 32.53 2dla n PRO 7 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2dla n PHE 8 N -1.21 0.16 -1.34 6.00 3.01 -1.26 -4.71 117.46 118.11 2dla n PHE 8 Ca 0.07 -0.43 -0.30 0.00 1.01 0.00 0.00 57.45 57.81 2dla n PHE 8 Cb 0.09 -0.03 0.13 0.00 -0.01 0.00 0.00 39.48 39.65 2dla n PHE 8 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 2dla s SER 9 N -0.91 3.67 0.33 4.37 1.04 -0.89 -4.68 113.70 116.63 2dla s SER 9 Ca 0.09 1.33 0.01 0.00 0.48 0.00 0.00 55.95 57.86 2dla s SER 9 Cb 0.05 -2.02 0.56 0.00 0.10 0.00 0.00 66.02 64.71 2dla s SER 9 CO 0.06 -2.49 1.95 -0.33 0.98 0.00 0.00 173.24 173.41 2dla h GLU 10 N -1.45 0.83 -0.61 4.02 5.08 -1.72 0.15 114.58 120.89 2dla h GLU 10 Ca -0.49 -0.08 -0.02 0.00 -1.00 0.00 0.00 59.36 57.76 2dla h GLU 10 Cb 1.29 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 30.34 2dla h GLU 10 CO 0.57 0.61 0.28 -0.22 -1.00 0.00 0.00 179.01 179.26 2dla h LYS 11 N 0.84 0.86 -0.02 2.33 1.63 -1.70 0.95 116.57 121.47 2dla h LYS 11 Ca 0.22 -0.12 -0.24 0.00 -0.85 0.00 0.00 60.65 59.66 2dla h LYS 11 Cb 0.02 -0.16 0.02 0.00 -0.60 0.00 0.00 32.23 31.51 2dla h LYS 11 CO -0.04 0.68 -0.93 0.00 -3.45 0.00 0.00 179.45 175.72 2dla h ALA 12 N 1.45 0.14 -0.34 5.00 0.00 -1.39 -2.93 119.26 121.19 2dla h ALA 12 Ca 0.21 -0.66 -0.02 0.00 0.00 0.00 0.00 54.91 54.44 2dla h ALA 12 Cb 0.11 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2dla h ALA 12 CO -0.03 0.62 0.15 0.87 0.00 0.00 0.00 179.25 180.86 2dla h LYS 13 N 0.32 0.50 0.14 0.00 1.57 -0.27 -2.28 116.57 116.54 2dla h LYS 13 Ca -0.11 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.58 2dla h LYS 13 Cb 1.59 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.81 2dla h LYS 13 CO 0.18 0.48 -0.07 0.93 -0.57 0.00 0.00 179.45 180.40 2dla h GLU 14 N 0.40 -0.19 -0.84 3.15 5.08 -0.92 -2.46 114.58 118.81 2dla h GLU 14 Ca 0.11 0.01 0.18 0.00 -1.00 0.00 0.00 59.36 58.67 2dla h GLU 14 Cb 0.16 0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.39 2dla h GLU 14 CO -0.01 -0.11 0.56 1.25 -1.00 0.00 0.00 179.01 179.70 2dla h LEU 15 N -0.21 0.39 0.00 1.33 5.85 -1.42 0.22 115.31 121.47 2dla h LEU 15 Ca -0.02 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.73 2dla h LEU 15 Cb 0.16 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.15 2dla h LEU 15 CO 0.03 0.18 0.00 0.18 -0.34 0.00 0.00 178.44 178.49 2dla n LEU 16 N -4.49 0.00 0.12 2.25 4.77 -0.87 -3.12 117.00 115.65 2dla n LEU 16 Ca 0.17 0.34 -0.01 0.00 -0.03 0.00 0.00 56.01 56.48 2dla n LEU 16 Cb 0.63 -0.34 0.05 0.00 -2.33 0.00 0.00 43.42 41.42 2dla n LEU 16 CO 0.32 -0.02 0.38 0.11 -1.33 0.00 0.00 177.39 176.85 2dla h LYS 17 N 0.00 0.00 0.00 3.23 6.56 -0.29 -3.00 116.57 123.07 2dla h LYS 17 Ca 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 2dla h LYS 17 Cb 0.33 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.99 2dla h LYS 17 CO 0.00 0.69 0.21 0.78 -2.06 0.00 0.00 179.45 179.07 2dla h GLY 18 N 2.77 0.00 0.00 3.86 0.00 -1.62 1.63 103.07 109.71 2dla h GLY 18 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.32 2dla h GLY 18 CO 0.09 0.00 -0.82 0.69 0.00 0.00 0.00 176.54 176.50 2dla n PHE 19 N -2.56 0.00 0.00 5.60 3.01 -1.14 -5.05 117.46 117.32 2dla n PHE 19 Ca -0.02 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.44 2dla n PHE 19 Cb 0.25 -0.02 0.00 0.00 -0.01 0.00 0.00 39.48 39.70 2dla n PHE 19 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2dla n GLY 20 N 1.39 1.56 3.77 1.37 0.00 0.55 -4.61 105.19 109.22 2dla n GLY 20 Ca 0.03 -0.05 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 2dla n GLY 20 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dla s SER 21 N -4.00 6.64 0.46 1.61 0.15 -1.26 -4.65 113.70 112.65 2dla s SER 21 Ca 0.00 2.52 0.16 0.00 0.70 0.00 0.00 55.95 59.33 2dla s SER 21 Cb 0.00 -2.63 1.09 0.00 -1.71 0.00 0.00 66.02 62.77 2dla s SER 21 CO 0.00 -0.61 2.02 0.40 1.20 0.00 0.00 173.24 176.25 2dla h ILE 22 N 2.67 1.04 -0.92 6.45 5.03 -1.90 -1.44 117.51 128.44 2dla h ILE 22 Ca -0.49 -0.57 0.02 0.00 -0.12 0.00 0.00 64.86 63.70 2dla h ILE 22 Cb 1.23 1.31 -0.05 0.00 -3.03 0.00 0.00 36.82 36.29 2dla h ILE 22 CO 0.64 0.16 0.61 0.78 -0.68 0.00 0.00 178.15 179.66 2dla h ASN 23 N 0.00 1.03 -0.41 1.72 2.35 -1.94 0.76 115.58 119.09 2dla h ASN 23 Ca -0.00 -0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.71 2dla h ASN 23 Cb 0.30 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.40 2dla h ASN 23 CO 0.02 0.73 0.17 0.44 -1.65 0.00 0.00 177.43 177.14 2dla h ASP 24 N 1.21 0.57 -0.26 5.81 3.32 -1.56 0.09 116.42 125.60 2dla h ASP 24 Ca 0.35 -0.16 -0.01 0.00 0.02 0.00 0.00 57.03 57.23 2dla h ASP 24 Cb -0.08 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.31 2dla h ASP 24 CO -0.10 0.58 0.14 0.15 -1.72 0.00 0.00 179.24 178.29 2dla h PHE 25 N 0.52 0.36 -0.66 4.55 3.57 -1.12 -0.24 116.94 123.93 2dla h PHE 25 Ca 0.14 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.69 2dla h PHE 25 Cb 0.19 -0.12 -0.04 0.00 2.79 0.00 0.00 35.95 38.77 2dla h PHE 25 CO -0.00 0.32 0.43 0.52 -2.23 0.00 0.00 178.31 177.35 2dla h MET 26 N 0.30 0.62 -0.08 1.11 2.86 -0.53 0.16 114.93 119.38 2dla h MET 26 Ca 0.09 -0.04 -0.16 0.00 -2.06 0.00 0.00 59.70 57.54 2dla h MET 26 Cb 0.08 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 31.59 2dla h MET 26 CO -0.01 0.41 -0.64 -0.44 1.06 0.00 0.00 176.91 177.28 2dla h ASP 27 N 0.64 0.34 -0.15 1.22 3.32 -0.41 -3.28 116.42 118.10 2dla h ASP 27 Ca 0.29 -0.21 -0.20 0.00 0.02 0.00 0.00 57.03 56.93 2dla h ASP 27 Cb 0.30 -0.10 0.01 0.00 0.22 0.00 0.00 39.33 39.76 2dla h ASP 27 CO -0.09 0.90 -0.67 0.00 -1.72 0.00 0.00 179.24 177.65 2dla h ALA 28 N 1.10 0.28 -0.88 3.45 0.00 0.93 -3.36 119.26 120.79 2dla h ALA 28 Ca -0.01 -0.56 0.23 0.00 0.00 0.00 0.00 54.91 54.56 2dla h ALA 28 Cb 1.18 -0.02 -0.17 0.00 0.00 0.00 0.00 17.79 18.78 2dla h ALA 28 CO 0.10 0.59 -0.03 -0.89 0.00 0.00 0.00 179.25 179.02 2dla n ILE 29 N -4.04 -0.37 0.29 0.00 5.41 0.32 0.36 119.36 121.34 2dla n ILE 29 Ca -0.07 1.96 0.15 0.00 1.00 0.00 0.00 62.75 65.78 2dla n ILE 29 Cb 0.69 -2.83 0.90 0.00 -0.71 0.00 0.00 39.64 37.69 2dla n ILE 29 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 176.55 175.90 2dla h PRO 30 N 0.00 0.00 0.00 0.38 0.11 -1.77 -0.39 132.00 130.33 2dla h PRO 30 Ca 0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.62 2dla h PRO 30 Cb 1.01 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.12 2dla h PRO 30 CO -0.85 0.01 -0.23 1.63 -0.21 0.00 0.00 178.00 178.36 2dla n LYS 31 N -3.82 0.23 -0.11 1.05 5.02 0.16 -4.09 118.16 116.59 2dla n LYS 31 Ca -0.03 0.14 -0.21 0.00 -2.02 0.00 0.00 58.31 56.18 2dla n LYS 31 Cb 0.10 -1.72 -0.12 0.00 -0.02 0.00 0.00 35.03 33.28 2dla n LYS 31 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 2dla n ILE 32 N -2.08 1.54 -4.44 -0.18 5.41 -0.27 -5.04 119.36 114.30 2dla n ILE 32 Ca 0.05 -0.51 -0.21 0.00 1.00 0.00 0.00 62.75 63.07 2dla n ILE 32 Cb 0.42 -1.60 -0.10 0.00 -0.71 0.00 0.00 39.64 37.64 2dla n ILE 32 CO 0.00 0.00 0.00 0.68 0.00 0.00 0.00 176.55 177.23 2dla s VAL 33 N -2.52 1.65 0.09 1.39 -7.23 -0.52 -5.13 120.40 108.14 2dla s VAL 33 Ca -0.34 -2.12 0.03 0.00 -1.81 0.00 0.00 61.98 57.74 2dla s VAL 33 Cb 0.10 -2.48 -0.04 0.00 0.56 0.00 0.00 36.38 34.52 2dla s VAL 33 CO 0.60 -0.28 0.10 -0.94 -0.31 0.00 0.00 175.10 174.27 2dla s SER 34 N -3.45 5.61 0.21 4.85 1.04 -1.26 -4.65 113.70 116.04 2dla s SER 34 Ca 0.30 -0.00 -0.09 0.00 0.48 0.00 0.00 55.95 56.63 2dla s SER 34 Cb 0.04 -1.52 0.27 0.00 0.10 0.00 0.00 66.02 64.91 2dla s SER 34 CO 0.12 0.15 1.75 0.58 0.98 0.00 0.00 173.24 176.83 2dla h VAL 35 N 2.44 0.80 -0.61 5.02 2.07 -1.96 -0.76 116.25 123.26 2dla h VAL 35 Ca -0.47 -0.16 0.09 0.00 0.82 0.00 0.00 66.70 66.99 2dla h VAL 35 Cb 1.17 0.31 -0.07 0.00 -1.52 0.00 0.00 31.29 31.18 2dla h VAL 35 CO 0.66 0.08 0.22 0.44 0.02 0.00 0.00 177.57 179.00 2dla h ASP 36 N 0.45 0.21 -0.54 0.57 3.45 -1.99 0.14 116.42 118.72 2dla h ASP 36 Ca 0.31 0.08 -0.00 0.00 0.43 0.00 0.00 57.03 57.84 2dla h ASP 36 Cb 0.35 0.06 -0.03 0.00 -0.56 0.00 0.00 39.33 39.16 2dla h ASP 36 CO -0.28 0.13 0.33 0.44 -1.57 0.00 0.00 179.24 178.29 2dla h ASP 37 N 0.40 0.65 0.22 6.45 3.32 -1.57 -0.76 116.42 125.12 2dla h ASP 37 Ca 0.31 -0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.29 2dla h ASP 37 Cb 0.38 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.77 2dla h ASP 37 CO -0.31 0.51 -0.11 0.58 -1.72 0.00 0.00 179.24 178.19 2dla h VAL 38 N 0.73 0.82 -0.84 -1.35 2.07 -0.41 -2.64 116.25 114.63 2dla h VAL 38 Ca 0.20 -0.22 0.09 0.00 0.82 0.00 0.00 66.70 67.58 2dla h VAL 38 Cb -0.02 0.95 -0.06 0.00 -1.52 0.00 0.00 31.29 30.64 2dla h VAL 38 CO -0.04 0.05 0.55 0.40 0.02 0.00 0.00 177.57 178.55 2dla h ILE 39 N -0.41 0.99 -0.76 4.57 1.08 -0.62 -0.20 117.51 122.16 2dla h ILE 39 Ca -0.03 -0.29 -0.01 0.00 -0.39 0.00 0.00 64.86 64.14 2dla h ILE 39 Cb 0.31 0.06 -0.04 0.00 -3.07 0.00 0.00 36.82 34.09 2dla h ILE 39 CO 0.05 0.16 0.43 -0.08 -0.69 0.00 0.00 178.15 178.02 2dla h GLU 40 N 0.85 1.04 -0.94 2.37 4.81 -0.94 -1.01 114.58 120.77 2dla h GLU 40 Ca 0.38 -0.11 0.19 0.00 -0.13 0.00 0.00 59.36 59.69 2dla h GLU 40 Cb 0.36 -0.21 -0.08 0.00 0.63 0.00 0.00 28.75 29.44 2dla h GLU 40 CO -0.15 0.75 0.60 -0.09 -0.73 0.00 0.00 179.01 179.39 2dla h ARG 41 N 1.06 0.57 -0.12 1.92 2.43 -0.67 -0.65 114.38 118.92 2dla h ARG 41 Ca 0.27 -0.03 -0.18 0.00 -0.81 0.00 0.00 59.98 59.23 2dla h ARG 41 Cb -0.00 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 29.41 2dla h ARG 41 CO -0.05 0.38 -0.66 0.82 -1.51 0.00 0.00 179.97 178.96 2dla h ILE 42 N 0.59 1.35 0.00 1.20 2.04 -1.09 -3.19 117.51 118.41 2dla h ILE 42 Ca 0.50 -1.98 0.00 0.00 1.00 0.00 0.00 64.86 64.38 2dla h ILE 42 Cb 0.98 1.96 0.00 0.00 -0.74 0.00 0.00 36.82 39.03 2dla h ILE 42 CO -0.25 0.60 0.00 0.54 0.00 0.00 0.00 178.15 179.05 2dla n ARG 43 N -3.90 0.09 0.00 2.37 1.74 -0.25 -2.27 116.66 114.45 2dla n ARG 43 Ca -0.04 0.00 0.07 0.00 -0.77 0.00 0.00 57.85 57.11 2dla n ARG 43 Cb 0.66 -1.32 0.34 0.00 -1.02 0.00 0.00 32.46 31.12 2dla n ARG 43 CO 0.00 0.00 0.00 1.55 -1.52 0.00 0.00 177.63 177.66 2dla n VAL 44 N -0.82 0.65 0.01 1.55 3.14 -1.20 -1.38 118.33 120.27 2dla n VAL 44 Ca 0.01 0.16 -0.02 0.00 -2.96 0.00 0.00 64.34 61.54 2dla n VAL 44 Cb 0.01 -0.94 -0.10 0.00 -1.06 0.00 0.00 33.84 31.75 2dla n VAL 44 CO 0.00 0.00 0.00 0.52 -6.46 0.00 0.00 176.83 170.89 2dla n VAL 45 N -1.30 1.26 -0.06 1.55 0.31 -0.96 -4.61 118.33 114.52 2dla n VAL 45 Ca 0.06 -0.72 -0.06 0.00 -0.01 0.00 0.00 64.34 63.62 2dla n VAL 45 Cb 0.11 -0.77 -0.02 0.00 -0.91 0.00 0.00 33.84 32.25 2dla n VAL 45 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 2dla n LYS 46 N -2.90 0.39 -3.14 5.55 4.81 -0.52 -4.86 118.16 117.50 2dla n LYS 46 Ca -0.13 0.30 -0.43 0.00 -0.87 0.00 0.00 58.31 57.18 2dla n LYS 46 Cb 0.90 -1.35 -0.07 0.00 0.02 0.00 0.00 35.03 34.54 2dla n LYS 46 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 2dla s ASN 47 N -5.39 6.27 0.39 3.14 0.02 -0.48 -4.94 114.94 113.94 2dla s ASN 47 Ca -0.18 -0.62 0.15 0.00 -1.02 0.00 0.00 52.86 51.19 2dla s ASN 47 Cb 0.02 -2.30 0.79 0.00 0.02 0.00 0.00 41.25 39.78 2dla s ASN 47 CO 0.26 -0.83 1.84 -0.08 0.02 0.00 0.00 177.10 178.31 2dla h GLU 48 N 8.94 0.00 0.00 -0.60 4.81 -1.83 -2.48 114.58 123.41 2dla h GLU 48 Ca -0.26 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 58.94 2dla h GLU 48 Cb 1.10 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.47 2dla h GLU 48 CO 0.92 0.35 -0.12 0.87 -0.73 0.00 0.00 179.01 180.30 2dla h LYS 49 N 0.00 0.00 0.00 1.92 1.57 -1.95 -2.78 116.57 115.33 2dla h LYS 49 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2dla h LYS 49 Cb 0.67 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.98 2dla h LYS 49 CO 0.05 0.12 0.03 -0.07 -0.57 0.00 0.00 179.45 179.01 2dla h LEU 50 N 0.00 0.00 -0.35 2.94 3.38 -1.80 -3.12 115.31 116.36 2dla h LEU 50 Ca -0.00 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 2dla h LEU 50 Cb 0.26 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 2dla h LEU 50 CO 0.02 0.00 -0.24 0.40 0.09 0.00 0.00 178.44 178.70 2dla h ILE 51 N 0.00 1.29 -0.82 1.22 2.04 -1.68 -3.32 117.51 116.23 2dla h ILE 51 Ca 0.00 -1.39 0.20 0.00 1.00 0.00 0.00 64.86 64.67 2dla h ILE 51 Cb 0.07 1.42 -0.12 0.00 -0.74 0.00 0.00 36.82 37.45 2dla h ILE 51 CO 0.00 0.46 0.23 0.44 0.00 0.00 0.00 178.15 179.28 2dla h ASP 52 N 0.56 0.05 0.00 1.72 3.32 -1.79 0.92 116.42 121.20 2dla h ASP 52 Ca 0.07 0.17 0.00 0.00 0.02 0.00 0.00 57.03 57.29 2dla h ASP 52 Cb 0.80 0.22 0.00 0.00 0.22 0.00 0.00 39.33 40.57 2dla h ASP 52 CO 0.07 -0.08 0.00 2.29 -1.72 0.00 0.00 179.24 179.80 2dla n LYS 53 N -5.17 0.42 0.00 3.56 2.85 -1.25 -2.25 118.16 116.31 2dla n LYS 53 Ca 0.18 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.44 2dla n LYS 53 Cb 0.57 -1.11 0.00 0.00 -0.65 0.00 0.00 35.03 33.85 2dla n LYS 53 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 2dla n PHE 54 N -0.10 0.00 -0.24 5.58 3.01 0.31 -4.65 117.46 121.37 2dla n PHE 54 Ca 0.00 0.00 -0.01 0.00 1.01 0.00 0.00 57.45 58.45 2dla n PHE 54 Cb 0.05 0.00 0.10 0.00 -0.01 0.00 0.00 39.48 39.63 2dla n PHE 54 CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 2dla h LEU 55 N 0.00 0.60 -3.36 4.37 3.38 -1.41 -2.92 115.31 115.98 2dla h LEU 55 Ca 0.00 0.03 -0.19 0.00 0.09 0.00 0.00 57.88 57.81 2dla h LEU 55 Cb 0.00 -0.09 -0.11 0.00 0.09 0.00 0.00 40.66 40.54 2dla h LEU 55 CO 0.00 0.39 -0.11 -0.90 0.09 0.00 0.00 178.44 177.91 2dla n ASP 56 N -4.76 2.52 -4.62 -0.43 3.85 -1.26 -4.93 116.55 106.93 2dla n ASP 56 Ca 0.09 -3.81 -0.29 0.00 -0.71 0.00 0.00 54.79 50.08 2dla n ASP 56 Cb 0.17 -0.63 0.20 0.00 -1.35 0.00 0.00 41.12 39.51 2dla n ASP 56 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.20 174.61 2dla s GLN 57 N -3.27 0.05 0.45 0.11 0.74 -1.11 -5.01 119.66 111.62 2dla s GLN 57 Ca 0.45 0.69 -0.15 0.00 0.05 0.00 0.00 55.36 56.40 2dla s GLN 57 Cb 0.41 -1.68 -0.08 0.00 1.10 0.00 0.00 33.01 32.76 2dla s GLN 57 CO -0.01 -3.03 0.90 -0.51 -0.55 0.00 0.00 175.29 172.09 2dla s ASP 58 N -3.10 6.66 0.02 6.67 1.01 -1.26 -4.73 116.67 121.94 2dla s ASP 58 Ca 0.66 1.44 -0.22 0.00 0.71 0.00 0.00 52.55 55.14 2dla s ASP 58 Cb -0.21 -2.45 -0.16 0.00 1.01 0.00 0.00 42.92 41.11 2dla s ASP 58 CO 0.60 -0.47 1.35 -0.55 0.21 0.00 0.00 175.17 176.31 2dla h ASN 59 N 1.28 0.24 -0.47 0.27 -1.07 -1.95 -0.09 115.58 113.80 2dla h ASN 59 Ca -0.47 -0.45 -0.12 0.00 0.07 0.00 0.00 56.30 55.34 2dla h ASN 59 Cb 1.18 -0.07 -0.02 0.00 -2.07 0.00 0.00 38.32 37.35 2dla h ASN 59 CO 0.62 0.63 -0.14 -0.37 0.07 0.00 0.00 177.43 178.24 2dla h VAL 60 N -0.15 1.27 -0.29 6.14 -1.51 -1.94 0.50 116.25 120.26 2dla h VAL 60 Ca 0.02 -1.29 -0.04 0.00 -1.23 0.00 0.00 66.70 64.16 2dla h VAL 60 Cb 0.55 1.03 -0.02 0.00 -2.13 0.00 0.00 31.29 30.73 2dla h VAL 60 CO 0.02 0.45 0.01 -0.03 -1.23 0.00 0.00 177.57 176.79 2dla h MET 61 N 0.85 0.43 0.04 5.19 -1.53 -1.96 0.12 114.93 118.08 2dla h MET 61 Ca 0.13 -0.08 -0.00 0.00 -3.44 0.00 0.00 59.70 56.31 2dla h MET 61 Cb 0.70 -0.07 0.00 0.00 -0.55 0.00 0.00 31.60 31.68 2dla h MET 61 CO 0.05 0.45 -0.02 0.22 0.14 0.00 0.00 176.91 177.75 2dla h ASP 62 N 0.42 -0.05 -0.50 1.39 3.58 -0.40 -2.84 116.42 118.03 2dla h ASP 62 Ca 0.10 -0.55 0.03 0.00 0.42 0.00 0.00 57.03 57.03 2dla h ASP 62 Cb 0.26 0.01 -0.03 0.00 1.72 0.00 0.00 39.33 41.29 2dla h ASP 62 CO 0.01 0.55 0.29 -0.07 -2.88 0.00 0.00 179.24 177.13 2dla h LEU 63 N -0.66 0.47 -0.52 2.28 3.38 -0.66 0.28 115.31 119.87 2dla h LEU 63 Ca -0.01 0.01 0.09 0.00 0.09 0.00 0.00 57.88 58.06 2dla h LEU 63 Cb 0.59 -0.09 -0.07 0.00 0.09 0.00 0.00 40.66 41.18 2dla h LEU 63 CO 0.01 0.33 0.13 0.00 0.09 0.00 0.00 178.44 179.00 2dla h ALA 64 N 1.23 0.61 -0.18 1.53 0.00 -0.81 0.45 119.26 122.09 2dla h ALA 64 Ca 0.20 0.10 -0.03 0.00 0.00 0.00 0.00 54.91 55.18 2dla h ALA 64 Cb 0.04 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2dla h ALA 64 CO -0.10 -0.28 -0.01 1.96 0.00 0.00 0.00 179.25 180.82 2dla h GLN 65 N 0.28 0.32 -0.81 0.00 4.20 -1.18 -1.65 115.11 116.27 2dla h GLN 65 Ca 0.26 -0.11 0.02 0.00 0.06 0.00 0.00 58.65 58.88 2dla h GLN 65 Cb 0.34 -0.03 -0.04 0.00 0.30 0.00 0.00 27.48 28.05 2dla h GLN 65 CO -0.31 0.54 0.53 0.35 -0.67 0.00 0.00 178.83 179.27 2dla h PHE 66 N 0.07 1.00 0.00 2.96 3.57 -0.43 -1.81 116.94 122.29 2dla h PHE 66 Ca 0.05 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.57 2dla h PHE 66 Cb 0.40 -0.34 0.00 0.00 2.79 0.00 0.00 35.95 38.81 2dla h PHE 66 CO 0.04 0.61 0.00 0.66 -2.23 0.00 0.00 178.31 177.39 2dla n TYR 67 N -4.54 0.00 0.09 0.41 4.02 0.15 -2.50 117.16 114.79 2dla n TYR 67 Ca 0.09 0.00 -0.22 0.00 -0.01 0.00 0.00 57.90 57.76 2dla n TYR 67 Cb 0.04 -0.43 -0.14 0.00 -0.02 0.00 0.00 39.34 38.78 2dla n TYR 67 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2dla h ALA 68 N 3.09 -0.09 -0.51 -0.72 0.00 -0.48 -2.39 119.26 118.17 2dla h ALA 68 Ca 0.00 -0.76 -0.02 0.00 0.00 0.00 0.00 54.91 54.13 2dla h ALA 68 Cb 0.42 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 2dla h ALA 68 CO 0.00 0.54 0.24 -0.07 0.00 0.00 0.00 179.25 179.97 2dla h LEU 69 N -0.04 0.67 -0.49 0.00 3.38 -1.21 -1.71 115.31 115.90 2dla h LEU 69 Ca -0.19 -0.13 -0.07 0.00 0.09 0.00 0.00 57.88 57.58 2dla h LEU 69 Cb 1.85 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 42.41 2dla h LEU 69 CO 0.21 0.61 0.04 -0.07 0.09 0.00 0.00 178.44 179.32 2dla h LEU 70 N 0.67 0.82 -1.25 1.67 3.38 -1.57 -1.72 115.31 117.32 2dla h LEU 70 Ca 0.17 -0.29 0.11 0.00 0.09 0.00 0.00 57.88 57.97 2dla h LEU 70 Cb 0.12 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 40.59 2dla h LEU 70 CO -0.02 0.91 0.56 1.23 0.09 0.00 0.00 178.44 181.21 2dla h GLY 71 N 0.71 1.22 2.00 0.83 0.00 -1.10 0.88 103.07 107.61 2dla h GLY 71 Ca 0.14 -0.34 -0.14 0.00 0.00 0.00 0.00 47.33 47.00 2dla h GLY 71 CO 0.02 0.17 -0.65 0.00 0.00 0.00 0.00 176.54 176.07 2dla h ALA 72 N 1.58 0.78 0.00 3.60 0.00 -0.90 -2.83 119.26 121.49 2dla h ALA 72 Ca 0.41 -0.59 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2dla h ALA 72 Cb 0.50 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2dla h ALA 72 CO -0.18 0.82 0.00 -0.07 0.00 0.00 0.00 179.25 179.82 2dla h LEU 73 N 0.00 0.00 -2.06 0.00 3.38 -0.07 -3.07 115.31 113.48 2dla h LEU 73 Ca -0.01 0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.06 2dla h LEU 73 Cb 1.26 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.00 2dla h LEU 73 CO 0.08 0.00 0.28 0.77 0.09 0.00 0.00 178.44 179.67 2dla h SER 74 N 0.00 0.00 0.16 -0.43 4.64 -0.66 -1.54 113.55 115.72 2dla h SER 74 Ca 0.00 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.08 2dla h SER 74 Cb 0.80 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.91 2dla h SER 74 CO 0.00 0.00 -1.12 1.88 -0.87 0.00 0.00 176.83 176.72 2dla h TYR 75 N 0.00 0.62 -2.40 4.77 -1.99 -1.70 -3.39 116.97 112.88 2dla h TYR 75 Ca 0.16 -0.45 -0.67 0.00 2.00 0.00 0.00 58.73 59.77 2dla h TYR 75 Cb 0.72 -0.02 -0.37 0.00 2.00 0.00 0.00 36.73 39.05 2dla h TYR 75 CO 0.00 1.43 -0.14 0.45 -0.00 0.00 0.00 178.16 179.90 2dla n SER 76 N -3.98 4.76 0.10 3.88 2.88 -0.66 -4.94 113.62 115.67 2dla n SER 76 Ca -0.17 -3.48 0.09 0.00 -1.33 0.00 0.00 58.87 53.97 2dla n SER 76 Cb 0.91 -0.84 0.41 0.00 -0.75 0.00 0.00 64.21 63.94 2dla n SER 76 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 2dla n PRO 77 N 0.79 0.11 0.00 -1.46 -0.02 -0.74 -3.36 135.00 130.32 2dla n PRO 77 Ca 0.30 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 2dla n PRO 77 Cb 0.38 -1.78 0.00 0.00 -0.02 0.00 0.00 33.50 32.07 2dla n PRO 77 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2dla n TYR 78 N -2.01 0.00 -0.86 6.00 4.02 -1.26 -4.96 117.16 118.10 2dla n TYR 78 Ca 0.01 -0.21 -0.01 0.00 -0.01 0.00 0.00 57.90 57.67 2dla n TYR 78 Cb 0.10 -0.02 0.01 0.00 -0.02 0.00 0.00 39.34 39.41 2dla n TYR 78 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2dla n GLY 79 N -0.21 -1.61 0.04 2.72 0.00 -1.21 -4.95 105.19 99.96 2dla n GLY 79 Ca 0.00 -1.59 0.14 0.00 0.00 0.00 0.00 46.02 44.56 2dla n GLY 79 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2dla n ILE 80 N -2.27 0.00 -0.12 -0.61 0.13 -1.26 -3.45 119.36 111.78 2dla n ILE 80 Ca 0.01 -0.02 -0.13 0.00 -1.10 0.00 0.00 62.75 61.50 2dla n ILE 80 Cb 0.03 -0.16 -0.03 0.00 -0.84 0.00 0.00 39.64 38.65 2dla n ILE 80 CO 0.00 0.00 0.00 -0.33 2.80 0.00 0.00 176.55 179.02 2dla h GLU 81 N 0.22 0.89 -0.83 9.51 3.07 -1.92 -2.70 114.58 122.82 2dla h GLU 81 Ca 0.00 -0.47 0.18 0.00 -0.50 0.00 0.00 59.36 58.57 2dla h GLU 81 Cb 0.44 0.01 -0.06 0.00 -0.84 0.00 0.00 28.75 28.31 2dla h GLU 81 CO 0.00 1.12 0.55 1.25 -1.40 0.00 0.00 179.01 180.53 2dla h LEU 82 N 0.70 0.39 -0.01 1.33 5.85 -1.82 0.62 115.31 122.36 2dla h LEU 82 Ca 0.06 0.03 -0.19 0.00 0.84 0.00 0.00 57.88 58.62 2dla h LEU 82 Cb 0.95 -0.04 0.01 0.00 0.37 0.00 0.00 40.66 41.95 2dla h LEU 82 CO 0.09 0.18 -0.75 -0.33 -0.34 0.00 0.00 178.44 177.29 2dla h GLU 83 N 0.40 0.53 -0.74 1.25 4.39 -1.67 -2.05 114.58 116.68 2dla h GLU 83 Ca 0.42 -0.55 0.03 0.00 0.34 0.00 0.00 59.36 59.59 2dla h GLU 83 Cb 1.02 0.15 -0.04 0.00 -0.10 0.00 0.00 28.75 29.78 2dla h GLU 83 CO -0.14 1.18 0.48 1.25 -1.16 0.00 0.00 179.01 180.61 2dla h LEU 84 N 0.10 0.79 -0.15 1.33 5.85 -0.89 0.19 115.31 122.53 2dla h LEU 84 Ca -0.09 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.60 2dla h LEU 84 Cb 1.43 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 42.28 2dla h LEU 84 CO 0.15 0.55 -0.00 0.58 -0.34 0.00 0.00 178.44 179.38 2dla h VAL 85 N 0.94 1.26 -0.63 1.05 2.07 -0.98 -0.72 116.25 119.25 2dla h VAL 85 Ca 0.29 -0.86 0.10 0.00 0.82 0.00 0.00 66.70 67.06 2dla h VAL 85 Cb -0.01 1.53 -0.08 0.00 -1.52 0.00 0.00 31.29 31.20 2dla h VAL 85 CO -0.10 0.25 0.22 0.11 0.02 0.00 0.00 177.57 178.07 2dla h LYS 86 N 0.01 0.37 0.15 1.57 1.57 -0.95 -2.27 116.57 117.02 2dla h LYS 86 Ca 0.04 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 2dla h LYS 86 Cb 0.39 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.61 2dla h LYS 86 CO 0.01 0.24 -0.07 -0.22 -0.57 0.00 0.00 179.45 178.84 2dla h LYS 87 N 0.38 -0.19 0.28 3.15 1.63 -0.44 -2.19 116.57 119.19 2dla h LYS 87 Ca 0.32 0.01 -0.00 0.00 -0.85 0.00 0.00 60.65 60.13 2dla h LYS 87 Cb 0.43 0.04 -0.02 0.00 -0.60 0.00 0.00 32.23 32.08 2dla h LYS 87 CO -0.34 0.11 -0.37 0.00 -3.45 0.00 0.00 179.45 175.40 2dla h ALA 88 N 0.31 -0.99 -0.83 5.00 0.00 -0.98 -2.33 119.26 119.44 2dla h ALA 88 Ca -0.02 -0.12 0.10 0.00 0.00 0.00 0.00 54.91 54.87 2dla h ALA 88 Cb 0.38 0.66 -0.06 0.00 0.00 0.00 0.00 17.79 18.77 2dla h ALA 88 CO 0.03 -1.04 0.54 -0.91 0.00 0.00 0.00 179.25 177.88 2dla h ASN 89 N -0.67 0.69 -0.71 0.00 2.35 -1.52 -0.35 115.58 115.37 2dla h ASN 89 Ca -0.03 0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 2dla h ASN 89 Cb 0.60 -0.12 -0.04 0.00 0.05 0.00 0.00 38.32 38.82 2dla h ASN 89 CO -0.10 0.40 0.46 0.25 -1.65 0.00 0.00 177.43 176.79 2dla h LEU 90 N 0.75 0.82 -0.04 1.61 5.85 -1.13 -0.68 115.31 122.50 2dla h LEU 90 Ca 0.39 -0.03 -0.00 0.00 0.84 0.00 0.00 57.88 59.08 2dla h LEU 90 Cb 0.48 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.30 2dla h LEU 90 CO -0.16 0.61 0.02 0.40 -0.34 0.00 0.00 178.44 178.97 2dla h ILE 91 N 0.97 1.11 0.73 4.05 2.04 -0.52 -1.38 117.51 124.50 2dla h ILE 91 Ca 0.26 -0.33 -0.04 0.00 1.00 0.00 0.00 64.86 65.75 2dla h ILE 91 Cb -0.09 1.26 0.01 0.00 -0.74 0.00 0.00 36.82 37.26 2dla h ILE 91 CO -0.05 0.09 -0.35 0.40 0.00 0.00 0.00 178.15 178.24 2dla h ILE 92 N -0.07 0.00 -0.90 -0.67 2.04 -1.08 -0.92 117.51 115.91 2dla h ILE 92 Ca 0.01 -0.06 0.09 0.00 1.00 0.00 0.00 64.86 65.91 2dla h ILE 92 Cb 0.13 0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 36.15 2dla h ILE 92 CO -0.00 0.00 0.58 1.88 0.00 0.00 0.00 178.15 180.61 2dla h TYR 93 N -1.04 0.98 0.29 1.37 -1.99 -1.24 -1.77 116.97 113.58 2dla h TYR 93 Ca -0.10 0.03 -0.01 0.00 2.00 0.00 0.00 58.73 60.64 2dla h TYR 93 Cb 0.75 -0.32 0.00 0.00 2.00 0.00 0.00 36.73 39.17 2dla h TYR 93 CO 0.05 0.46 -0.14 0.77 -0.00 0.00 0.00 178.16 179.29 2dla h SER 94 N 0.91 -0.33 -0.97 3.88 0.02 -1.21 -1.11 113.55 114.73 2dla h SER 94 Ca 0.42 -0.05 0.25 0.00 -0.84 0.00 0.00 61.79 61.56 2dla h SER 94 Cb 0.38 0.09 -0.07 0.00 0.14 0.00 0.00 62.40 62.94 2dla h SER 94 CO -0.18 -0.16 0.65 -0.33 -1.14 0.00 0.00 176.83 175.67 2dla h GLU 95 N -0.49 0.28 0.00 3.45 4.39 -0.35 0.32 114.58 122.19 2dla h GLU 95 Ca -0.04 -0.02 -0.12 0.00 0.34 0.00 0.00 59.36 59.52 2dla h GLU 95 Cb 0.36 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.93 2dla h GLU 95 CO 0.07 0.19 -0.57 0.00 -1.16 0.00 0.00 179.01 177.54 2dla h ARG 96 N 0.29 0.00 -0.02 2.33 3.08 -0.92 -3.27 114.38 115.86 2dla h ARG 96 Ca 0.51 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 60.32 2dla h ARG 96 Cb 1.48 0.00 0.02 0.00 0.08 0.00 0.00 29.97 31.55 2dla h ARG 96 CO -0.17 0.57 -0.93 -0.07 -1.07 0.00 0.00 179.97 178.30 2dla h LEU 97 N 0.00 0.86 -0.33 3.04 3.38 0.88 -2.78 115.31 120.36 2dla h LEU 97 Ca -0.01 -0.72 0.00 0.00 0.09 0.00 0.00 57.88 57.24 2dla h LEU 97 Cb 1.42 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.91 2dla h LEU 97 CO 0.07 1.46 0.00 2.29 0.09 0.00 0.00 178.44 182.36 2dla n LYS 98 N -3.93 1.21 0.00 1.13 2.85 -0.65 -2.74 118.16 116.02 2dla n LYS 98 Ca -0.10 -0.32 0.01 0.00 -1.05 0.00 0.00 58.31 56.85 2dla n LYS 98 Cb 0.83 -1.09 0.00 0.00 -0.65 0.00 0.00 35.03 34.12 2dla n LYS 98 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 2dla n ARG 99 N -0.26 0.42 -3.02 -1.58 1.74 -1.17 -5.03 116.66 107.76 2dla n ARG 99 Ca 0.04 -0.51 -0.39 0.00 -0.77 0.00 0.00 57.85 56.22 2dla n ARG 99 Cb 0.08 -0.96 -0.06 0.00 -1.02 0.00 0.00 32.46 30.50 2dla n ARG 99 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 2dla s LYS 100 N -0.31 4.52 -0.01 5.56 2.36 -1.06 -5.00 119.74 125.81 2dla s LYS 100 Ca 0.02 1.11 -0.04 0.00 -2.55 0.00 0.00 55.97 54.50 2dla s LYS 100 Cb 0.01 -3.26 -0.02 0.00 -1.05 0.00 0.00 37.83 33.51 2dla s LYS 100 CO 0.03 0.57 0.40 0.87 1.55 0.00 0.00 175.35 178.78 2dla h LYS 101 N 4.38 -0.13 -4.96 4.03 6.56 -1.92 -3.44 116.57 121.08 2dla h LYS 101 Ca -0.47 0.01 -0.66 0.00 -1.06 0.00 0.00 60.65 58.47 2dla h LYS 101 Cb 1.21 0.03 -0.28 0.00 -0.57 0.00 0.00 32.23 32.62 2dla h LYS 101 CO 0.66 -0.09 -0.71 -2.00 -2.06 0.00 0.00 179.45 175.25 2dla s GLU 102 N -2.10 3.29 -0.65 3.15 2.56 -1.26 -5.06 118.70 118.62 2dla s GLU 102 Ca -0.02 -0.69 -0.18 0.00 0.00 0.00 0.00 54.97 54.08 2dla s GLU 102 Cb 0.00 -3.06 0.13 0.00 2.00 0.00 0.00 34.13 33.20 2dla s GLU 102 CO 0.06 -0.25 0.72 0.42 -0.56 0.00 0.00 175.26 175.65 2dla s ILE 103 N 1.47 4.99 0.66 -3.70 1.01 -1.26 -5.04 121.20 119.33 2dla s ILE 103 Ca 0.05 -1.36 -0.15 0.00 0.00 0.00 0.00 60.65 59.19 2dla s ILE 103 Cb -0.15 -4.49 0.00 0.00 0.01 0.00 0.00 42.46 37.83 2dla s ILE 103 CO -0.03 -1.11 1.13 -0.54 0.00 0.00 0.00 174.94 174.39 2dla s LYS 104 N 2.13 2.72 0.24 2.79 -0.14 -1.26 -4.95 119.74 121.26 2dla s LYS 104 Ca 0.13 1.47 -0.07 0.00 -1.36 0.00 0.00 55.97 56.14 2dla s LYS 104 Cb -0.21 -1.93 0.22 0.00 -1.68 0.00 0.00 37.83 34.23 2dla s LYS 104 CO 0.02 -1.32 1.90 -1.35 -0.76 0.00 0.00 175.35 173.84 2dla h PRO 105 N 0.06 1.23 0.00 -1.68 0.11 -1.93 -2.64 132.00 127.14 2dla h PRO 105 Ca -0.47 -0.09 -0.01 0.00 0.11 0.00 0.00 66.00 65.54 2dla h PRO 105 Cb 1.26 -0.27 -0.00 0.00 0.11 0.00 0.00 31.00 32.09 2dla h PRO 105 CO 0.53 0.83 -0.04 0.93 -0.21 0.00 0.00 178.00 180.04 2dla h GLU 106 N 1.26 0.00 -0.01 1.05 3.07 -1.96 -2.59 114.58 115.39 2dla h GLU 106 Ca 0.34 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.20 2dla h GLU 106 Cb -0.11 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.80 2dla h GLU 106 CO -0.07 0.04 -0.04 0.39 -1.40 0.00 0.00 179.01 177.94 2dla n GLU 107 N -3.39 1.08 -4.13 2.33 1.02 -1.00 -1.75 120.64 114.80 2dla n GLU 107 Ca -0.02 -0.37 -0.15 0.00 -0.02 0.00 0.00 57.16 56.61 2dla n GLU 107 Cb 0.17 -1.49 -0.13 0.00 -0.02 0.00 0.00 31.44 29.97 2dla n GLU 107 CO 0.00 0.00 0.00 -1.50 1.18 0.00 0.00 177.13 176.81 2dla s ILE 108 N -2.17 0.55 0.06 -3.67 2.07 -0.98 -3.53 121.20 113.51 2dla s ILE 108 Ca 0.38 -0.74 -0.26 0.00 -1.41 0.00 0.00 60.65 58.63 2dla s ILE 108 Cb 0.21 -0.55 -0.17 0.00 0.13 0.00 0.00 42.46 42.09 2dla s ILE 108 CO 0.40 -0.15 1.57 0.28 -1.91 0.00 0.00 174.94 175.13 2dla h SER 109 N 5.13 -0.20 -3.93 4.50 0.02 -1.84 -3.43 113.55 113.81 2dla h SER 109 Ca -0.33 -0.10 -0.47 0.00 -0.84 0.00 0.00 61.79 60.05 2dla h SER 109 Cb 1.20 0.05 -0.00 0.00 0.14 0.00 0.00 62.40 63.79 2dla h SER 109 CO 0.45 -0.03 0.38 0.27 -1.14 0.00 0.00 176.83 176.76 2dla s ILE 110 N -5.63 3.96 0.08 3.27 -4.36 -1.26 -4.98 121.20 112.28 2dla s ILE 110 Ca -0.14 1.55 -0.31 0.00 -0.26 0.00 0.00 60.65 61.49 2dla s ILE 110 Cb 0.04 -3.83 -0.09 0.00 1.25 0.00 0.00 42.46 39.84 2dla s ILE 110 CO 0.64 0.06 1.67 -0.62 0.24 0.00 0.00 174.94 176.92 2dla s ASP 111 N -1.59 6.58 0.17 4.36 -1.08 -1.26 -5.00 116.67 118.84 2dla s ASP 111 Ca 0.54 2.53 -0.00 0.00 -0.52 0.00 0.00 52.55 55.10 2dla s ASP 111 Cb -0.20 -2.57 -0.04 0.00 -1.46 0.00 0.00 42.92 38.65 2dla s ASP 111 CO 0.26 -0.90 0.07 -0.69 0.52 0.00 0.00 175.17 174.43 2dla s VAL 112 N 2.53 0.18 0.12 1.11 1.01 -1.26 -4.57 120.40 119.52 2dla s VAL 112 Ca 0.74 -1.95 -0.25 0.00 0.00 0.00 0.00 61.98 60.52 2dla s VAL 112 Cb -0.41 -2.23 0.07 0.00 0.00 0.00 0.00 36.38 33.81 2dla s VAL 112 CO 0.33 -0.30 0.76 -0.55 0.00 0.00 0.00 175.10 175.34 2dla s SER 113 N -3.12 -0.42 -0.07 3.32 0.15 -0.87 -4.79 113.70 107.91 2dla s SER 113 Ca 0.29 -0.12 -0.21 0.00 0.70 0.00 0.00 55.95 56.62 2dla s SER 113 Cb 0.07 0.53 -0.04 0.00 -1.71 0.00 0.00 66.02 64.87 2dla s SER 113 CO 0.06 -0.89 0.60 -0.89 1.20 0.00 0.00 173.24 173.33 2dla s THR 114 N -3.50 5.06 0.74 6.45 2.01 -1.26 -0.63 115.64 124.52 2dla s THR 114 Ca 0.05 1.24 -0.11 0.00 0.31 0.00 0.00 61.69 63.18 2dla s THR 114 Cb -0.02 -3.94 0.04 0.00 0.01 0.00 0.00 72.50 68.59 2dla s THR 114 CO -0.08 0.32 1.08 0.00 -0.69 0.00 0.00 174.62 175.25 2dla s ALA 115 N 0.50 2.46 -0.29 7.40 0.00 -0.24 -4.91 121.76 126.68 2dla s ALA 115 Ca 0.32 0.02 0.14 0.00 0.00 0.00 0.00 51.96 52.44 2dla s ALA 115 Cb -0.17 -3.17 0.48 0.00 0.00 0.00 0.00 23.12 20.26 2dla s ALA 115 CO 0.15 -1.48 1.13 0.44 0.00 0.00 0.00 175.76 176.01 2dla n ILE 116 N -3.30 1.90 -1.17 0.00 -5.35 -1.26 -4.99 119.36 105.19 2dla n ILE 116 Ca 0.08 -3.66 0.00 0.00 -0.27 0.00 0.00 62.75 58.89 2dla n ILE 116 Cb 0.54 -0.02 0.00 0.00 -1.74 0.00 0.00 39.64 38.42 2dla n ILE 116 CO 0.00 0.00 0.00 -2.65 -1.76 0.00 0.00 176.55 172.14 2dla n PRO 134 N -0.60 -1.13 -0.01 6.28 -0.02 -1.26 -5.26 135.00 133.00 2dla n PRO 134 Ca 0.26 0.86 0.01 0.00 -2.02 0.00 0.00 63.50 62.61 2dla n PRO 134 Cb 0.87 -1.39 -0.05 0.00 -0.02 0.00 0.00 33.50 32.91 2dla n PRO 134 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 2dla n GLU 135 N -1.45 1.17 -4.34 -0.52 0.28 -1.23 -4.96 120.64 109.59 2dla n GLU 135 Ca 0.00 -0.04 -0.25 0.00 -0.16 0.00 0.00 57.16 56.71 2dla n GLU 135 Cb 0.05 -1.16 -0.09 0.00 1.43 0.00 0.00 31.44 31.67 2dla n GLU 135 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 177.13 177.68 2dla s TYR 136 N -2.35 2.55 -0.04 -1.84 1.51 -0.97 -1.08 117.35 115.13 2dla s TYR 136 Ca -0.03 -0.26 -0.03 0.00 -1.01 0.00 0.00 57.07 55.75 2dla s TYR 136 Cb 0.03 -1.17 0.02 0.00 -0.11 0.00 0.00 41.96 40.73 2dla s TYR 136 CO 0.27 0.60 0.10 0.95 -1.11 0.00 0.00 175.55 176.36 2dla s THR 137 N -2.13 -0.02 0.15 -0.71 -4.23 0.20 -1.26 115.64 107.64 2dla s THR 137 Ca 0.28 0.08 0.11 0.00 -1.18 0.00 0.00 61.69 60.98 2dla s THR 137 Cb -0.07 -0.16 -0.04 0.00 1.34 0.00 0.00 72.50 73.57 2dla s THR 137 CO 0.17 0.03 -0.24 -0.04 -0.54 0.00 0.00 174.62 174.00 2dla s MET 138 N 0.53 1.39 0.11 3.99 -1.94 -0.72 -2.04 119.30 120.62 2dla s MET 138 Ca -0.04 -1.39 -0.30 0.00 -1.71 0.00 0.00 55.69 52.25 2dla s MET 138 Cb -0.06 -1.76 -0.06 0.00 2.01 0.00 0.00 34.83 34.96 2dla s MET 138 CO -0.02 0.40 1.12 0.15 -0.01 0.00 0.00 175.02 176.66 2dla s LYS 139 N -2.32 4.53 0.30 2.03 1.02 -1.26 0.39 119.74 124.42 2dla s LYS 139 Ca 0.16 1.70 0.01 0.00 0.02 0.00 0.00 55.97 57.85 2dla s LYS 139 Cb -0.09 -3.33 0.73 0.00 -0.52 0.00 0.00 37.83 34.62 2dla s LYS 139 CO 0.07 -0.07 1.59 0.82 -0.92 0.00 0.00 175.35 176.84 2dla h ILE 140 N 4.18 0.10 -0.41 2.17 2.04 -1.41 0.29 117.51 124.48 2dla h ILE 140 Ca -0.43 -0.02 0.09 0.00 1.00 0.00 0.00 64.86 65.50 2dla h ILE 140 Cb 1.21 0.05 -0.08 0.00 -0.74 0.00 0.00 36.82 37.26 2dla h ILE 140 CO 0.76 0.01 -0.16 0.77 0.00 0.00 0.00 178.15 179.53 2dla h SER 141 N 0.05 -0.56 -0.46 1.72 4.64 -1.91 1.39 113.55 118.43 2dla h SER 141 Ca 0.58 0.14 -0.03 0.00 -0.47 0.00 0.00 61.79 62.02 2dla h SER 141 Cb 1.19 0.32 -0.02 0.00 -0.31 0.00 0.00 62.40 63.57 2dla h SER 141 CO -0.85 -0.20 0.20 0.44 -0.87 0.00 0.00 176.83 175.56 2dla h ASP 142 N -0.08 0.65 -0.06 4.97 3.32 -1.36 -0.13 116.42 123.74 2dla h ASP 142 Ca 0.20 -0.07 -0.02 0.00 0.02 0.00 0.00 57.03 57.16 2dla h ASP 142 Cb 0.38 -0.17 -0.00 0.00 0.22 0.00 0.00 39.33 39.77 2dla h ASP 142 CO -0.46 0.59 -0.04 0.15 -1.72 0.00 0.00 179.24 177.75 2dla h PHE 143 N 0.72 0.16 -0.46 4.55 3.04 0.46 -2.93 116.94 122.48 2dla h PHE 143 Ca 0.17 -0.04 -0.06 0.00 3.98 0.00 0.00 57.97 62.02 2dla h PHE 143 Cb 0.14 -0.04 -0.02 0.00 2.56 0.00 0.00 35.95 38.59 2dla h PHE 143 CO 0.01 0.54 0.02 -0.07 -2.02 0.00 0.00 178.31 176.79 2dla h LEU 144 N -0.26 0.70 -1.45 0.59 3.38 0.19 -0.94 115.31 117.52 2dla h LEU 144 Ca 0.01 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 57.79 2dla h LEU 144 Cb 0.50 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 2dla h LEU 144 CO 0.01 0.76 -0.10 -0.78 0.09 0.00 0.00 178.44 178.42 2dla h ASP 145 N 0.70 0.23 0.16 -0.43 1.82 -1.03 -3.24 116.42 114.62 2dla h ASP 145 Ca 0.14 -0.04 -0.36 0.00 -0.39 0.00 0.00 57.03 56.38 2dla h ASP 145 Cb 0.40 -0.06 -0.03 0.00 0.68 0.00 0.00 39.33 40.32 2dla h ASP 145 CO 0.01 0.35 -2.01 0.18 -1.61 0.00 0.00 179.24 176.17 2dla n LEU 146 N -4.30 2.40 -3.73 2.28 4.77 -1.00 -4.67 117.00 112.74 2dla n LEU 146 Ca -0.01 0.20 -0.28 0.00 -0.03 0.00 0.00 56.01 55.89 2dla n LEU 146 Cb 0.24 -0.91 -0.10 0.00 -2.33 0.00 0.00 43.42 40.33 2dla n LEU 146 CO 0.37 0.80 0.04 0.52 -1.33 0.00 0.00 177.39 177.79 2dla n VAL 147 N -3.39 2.02 0.30 4.08 0.31 -0.39 -4.78 118.33 116.48 2dla n VAL 147 Ca -0.31 -5.03 0.15 0.00 -0.01 0.00 0.00 64.34 59.14 2dla n VAL 147 Cb 1.05 -2.16 0.92 0.00 -0.91 0.00 0.00 33.84 32.73 2dla n VAL 147 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 2dla h PRO 148 N 4.96 0.00 0.00 5.55 0.11 -1.83 -3.40 132.00 137.39 2dla h PRO 148 Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 2dla h PRO 148 Cb 0.72 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.83 2dla h PRO 148 CO 0.78 0.01 0.00 -3.47 -0.21 0.00 0.00 178.00 175.11 2dla n ASP 149 N -3.79 0.00 0.00 -2.05 2.03 -1.26 -4.26 116.55 107.21 2dla n ASP 149 Ca -0.03 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.28 2dla n ASP 149 Cb 0.09 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.49 2dla n ASP 149 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2dla n GLU 150 N 0.00 0.00 -1.40 -0.67 1.02 -1.26 -4.66 120.64 113.67 2dla n GLU 150 Ca 0.00 0.00 -0.44 0.00 -0.02 0.00 0.00 57.16 56.70 2dla n GLU 150 Cb 0.00 0.00 -0.01 0.00 -0.02 0.00 0.00 31.44 31.41 2dla n GLU 150 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2dla n LYS 151 N 0.00 0.28 0.00 3.49 4.76 -1.26 -4.70 118.16 120.74 2dla n LYS 151 Ca 0.00 0.10 0.00 0.00 -2.87 0.00 0.00 58.31 55.54 2dla n LYS 151 Cb 0.00 -1.22 0.00 0.00 -1.84 0.00 0.00 35.03 31.97 2dla n LYS 151 CO 0.00 0.00 0.00 1.47 -1.37 0.00 0.00 177.40 177.50 2dla n LEU 152 N 1.84 0.00 0.00 -0.35 -0.00 -1.26 -2.67 117.00 114.56 2dla n LEU 152 Ca 0.13 0.00 -0.11 0.00 -0.00 0.00 0.00 56.01 56.03 2dla n LEU 152 Cb 0.34 0.00 -0.06 0.00 -0.00 0.00 0.00 43.42 43.70 2dla n LEU 152 CO 0.56 0.00 0.90 0.00 -0.00 0.00 0.00 177.39 178.84 2dla h ALA 153 N 0.95 0.10 -0.19 1.47 0.00 -1.97 -2.97 119.26 116.67 2dla h ALA 153 Ca 0.00 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 2dla h ALA 153 Cb 0.00 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.70 2dla h ALA 153 CO 0.00 -0.39 0.12 0.27 0.00 0.00 0.00 179.25 179.24 2dla n ASN 154 N -5.02 3.01 -4.37 0.00 0.23 -1.09 -4.85 115.26 103.17 2dla n ASN 154 Ca -0.06 -2.30 -0.23 0.00 -0.53 0.00 0.00 54.58 51.47 2dla n ASN 154 Cb 0.04 -0.56 -0.10 0.00 -2.08 0.00 0.00 39.78 37.08 2dla n ASN 154 CO 0.00 0.00 0.00 -0.31 -0.93 0.00 0.00 177.26 176.02 2dla s TYR 155 N -0.73 1.89 -0.14 -2.53 1.51 -1.12 -5.14 117.35 111.09 2dla s TYR 155 Ca 0.11 -1.05 -0.14 0.00 -1.01 0.00 0.00 57.07 54.98 2dla s TYR 155 Cb 0.09 -1.24 -0.05 0.00 -0.11 0.00 0.00 41.96 40.66 2dla s TYR 155 CO 0.02 -0.08 0.30 -0.47 -1.11 0.00 0.00 175.55 174.21 2dla s TYR 156 N -3.29 3.50 0.30 2.71 5.04 -1.26 -4.99 117.35 119.38 2dla s TYR 156 Ca 0.32 0.65 0.10 0.00 -2.44 0.00 0.00 57.07 55.70 2dla s TYR 156 Cb 0.07 -2.32 -0.05 0.00 0.35 0.00 0.00 41.96 40.01 2dla s TYR 156 CO 0.15 0.32 -0.09 0.42 -1.34 0.00 0.00 175.55 175.00 2dla s ILE 157 N 0.19 2.64 0.00 3.14 1.01 -1.26 -1.03 121.20 125.89 2dla s ILE 157 Ca 0.18 -2.17 0.00 0.00 0.00 0.00 0.00 60.65 58.65 2dla s ILE 157 Cb -0.13 -2.59 0.00 0.00 0.01 0.00 0.00 42.46 39.75 2dla s ILE 157 CO 0.05 -0.31 0.00 0.00 0.00 0.00 0.00 174.94 174.68 2dla n TYR 158 N -0.79 0.00 -3.60 3.97 9.36 -1.06 -5.00 117.16 120.04 2dla n TYR 158 Ca -0.05 0.00 -0.20 0.00 3.32 0.00 0.00 57.90 60.96 2dla n TYR 158 Cb 0.61 0.00 0.05 0.00 -0.63 0.00 0.00 39.34 39.37 2dla n TYR 158 CO 0.00 0.00 0.00 0.39 0.22 0.00 0.00 176.86 177.47 2dla n GLU 159 N 0.00 -4.85 -1.13 2.98 1.02 -1.26 -2.67 120.64 114.73 2dla n GLU 159 Ca 0.00 0.68 -0.05 0.00 -0.02 0.00 0.00 57.16 57.77 2dla n GLU 159 Cb 0.00 -5.31 -0.02 0.00 -0.02 0.00 0.00 31.44 26.09 2dla n GLU 159 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2dla n GLY 160 N -1.45 0.60 3.27 0.62 0.00 -1.26 -5.00 105.19 101.97 2dla n GLY 160 Ca -0.27 -0.13 -0.29 0.00 0.00 0.00 0.00 46.02 45.33 2dla n GLY 160 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dla s ARG 161 N -1.93 1.78 -0.14 1.61 0.52 -1.09 -1.04 118.95 118.67 2dla s ARG 161 Ca 0.00 -0.90 -0.10 0.00 -0.52 0.00 0.00 55.73 54.21 2dla s ARG 161 Cb 0.00 -1.79 -0.05 0.00 0.52 0.00 0.00 34.95 33.63 2dla s ARG 161 CO 0.00 0.48 0.21 0.08 0.02 0.00 0.00 175.30 176.09 2dla s VAL 162 N -0.63 5.37 -0.21 3.52 1.01 0.16 -2.56 120.40 127.06 2dla s VAL 162 Ca 0.09 0.37 -0.08 0.00 0.00 0.00 0.00 61.98 62.35 2dla s VAL 162 Cb -0.09 -3.51 -0.04 0.00 0.00 0.00 0.00 36.38 32.73 2dla s VAL 162 CO 0.00 0.51 0.09 -0.31 0.00 0.00 0.00 175.10 175.40 2dla s TYR 163 N -0.32 3.25 0.04 5.22 1.51 -0.20 -1.76 117.35 125.09 2dla s TYR 163 Ca 0.15 0.05 -0.08 0.00 -1.01 0.00 0.00 57.07 56.18 2dla s TYR 163 Cb -0.13 -2.16 -0.00 0.00 -0.11 0.00 0.00 41.96 39.57 2dla s TYR 163 CO 0.04 0.06 0.16 -0.48 -1.11 0.00 0.00 175.55 174.22 2dla s LEU 164 N 0.73 1.53 0.58 -1.29 2.34 -0.39 -3.98 118.68 118.20 2dla s LEU 164 Ca 0.05 -0.44 -0.14 0.00 0.06 0.00 0.00 54.13 53.65 2dla s LEU 164 Cb -0.13 0.83 -0.05 0.00 -0.56 0.00 0.00 46.19 46.28 2dla s LEU 164 CO 0.02 -0.55 1.02 -0.54 -1.06 0.00 0.00 176.35 175.24 2dla s LYS 165 N -2.64 3.58 0.14 1.48 -0.14 -1.26 -2.29 119.74 118.61 2dla s LYS 165 Ca -0.05 0.97 -0.28 0.00 -1.36 0.00 0.00 55.97 55.26 2dla s LYS 165 Cb -0.01 -2.08 -0.03 0.00 -1.68 0.00 0.00 37.83 34.04 2dla s LYS 165 CO -0.04 -0.58 1.58 -0.09 -0.76 0.00 0.00 175.35 175.45 2dla h ARG 166 N 0.31 -0.38 -1.52 1.68 2.43 -1.98 0.77 114.38 115.68 2dla h ARG 166 Ca -0.46 0.03 0.48 0.00 -0.81 0.00 0.00 59.98 59.21 2dla h ARG 166 Cb 1.20 0.09 -0.11 0.00 -0.42 0.00 0.00 29.97 30.73 2dla h ARG 166 CO 0.60 -0.26 1.03 0.93 -1.51 0.00 0.00 179.97 180.77 2dla h GLU 167 N -0.40 0.04 -0.01 0.20 3.07 -1.99 0.49 114.58 115.99 2dla h GLU 167 Ca 0.11 -0.00 -0.07 0.00 -0.50 0.00 0.00 59.36 58.90 2dla h GLU 167 Cb 0.60 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.51 2dla h GLU 167 CO -0.49 0.03 -0.25 -0.44 -1.40 0.00 0.00 179.01 176.45 2dla h ASP 168 N 0.04 0.24 -0.35 1.42 3.32 -1.24 -3.02 116.42 116.84 2dla h ASP 168 Ca 0.84 -0.75 0.10 0.00 0.02 0.00 0.00 57.03 57.25 2dla h ASP 168 Cb 2.95 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 42.42 2dla h ASP 168 CO -0.27 0.96 0.29 0.25 -1.72 0.00 0.00 179.24 178.75 2dla h LEU 169 N -0.46 0.00 0.05 1.55 5.85 0.65 -0.40 115.31 122.55 2dla h LEU 169 Ca -0.03 0.00 -0.25 0.00 0.84 0.00 0.00 57.88 58.44 2dla h LEU 169 Cb 0.99 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.99 2dla h LEU 169 CO 0.05 0.00 -1.24 0.40 -0.34 0.00 0.00 178.44 177.31 2dla h ILE 170 N 0.00 1.45 -0.08 4.05 2.04 -1.36 -0.55 117.51 123.06 2dla h ILE 170 Ca 0.17 -3.14 -0.03 0.00 1.00 0.00 0.00 64.86 62.86 2dla h ILE 170 Cb 0.74 2.79 -0.00 0.00 -0.74 0.00 0.00 36.82 39.61 2dla h ILE 170 CO -0.00 0.86 -0.06 0.03 0.00 0.00 0.00 178.15 178.98 2dla h ARG 171 N 0.03 0.18 0.60 2.37 3.08 -1.07 -1.94 114.38 117.63 2dla h ARG 171 Ca -0.11 -0.09 -0.03 0.00 0.07 0.00 0.00 59.98 59.82 2dla h ARG 171 Cb 1.89 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.94 2dla h ARG 171 CO 0.14 0.59 -0.36 0.82 -1.07 0.00 0.00 179.97 180.09 2dla h ILE 172 N -0.22 0.00 -1.52 2.04 2.04 -1.21 -2.62 117.51 116.02 2dla h ILE 172 Ca 0.02 0.00 0.45 0.00 1.00 0.00 0.00 64.86 66.32 2dla h ILE 172 Cb 0.54 0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 36.55 2dla h ILE 172 CO 0.02 0.00 1.07 -0.25 0.00 0.00 0.00 178.15 178.99 2dla h TRP 173 N -0.90 0.11 -0.83 1.37 7.01 -1.13 0.79 115.95 122.37 2dla h TRP 173 Ca -0.08 0.00 0.05 0.00 2.11 0.00 0.00 58.89 60.97 2dla h TRP 173 Cb 0.72 -0.03 -0.05 0.00 -2.10 0.00 0.00 29.16 27.70 2dla h TRP 173 CO -0.04 -0.03 0.52 0.77 -2.79 0.00 0.00 178.44 176.87 2dla h SER 174 N 0.03 0.84 -0.66 2.65 0.02 -0.95 0.12 113.55 115.61 2dla h SER 174 Ca 0.75 0.01 -0.08 0.00 -0.84 0.00 0.00 61.79 61.63 2dla h SER 174 Cb 2.88 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 65.22 2dla h SER 174 CO -0.08 0.56 0.10 0.11 -1.14 0.00 0.00 176.83 176.37 2dla h LYS 175 N 0.98 1.11 -0.68 3.45 1.79 -0.90 -1.04 116.57 121.28 2dla h LYS 175 Ca 0.35 -0.30 -0.08 0.00 -2.18 0.00 0.00 60.65 58.44 2dla h LYS 175 Cb 0.09 -0.13 -0.03 0.00 -1.58 0.00 0.00 32.23 30.59 2dla h LYS 175 CO -0.14 1.02 0.12 0.00 -1.08 0.00 0.00 179.45 179.37 2dla h ALA 176 N 1.06 0.93 0.83 3.86 0.00 -1.42 -2.60 119.26 121.92 2dla h ALA 176 Ca 0.20 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 2dla h ALA 176 Cb 0.46 -0.26 0.01 0.00 0.00 0.00 0.00 17.79 18.00 2dla h ALA 176 CO 0.02 0.67 -0.40 0.35 0.00 0.00 0.00 179.25 179.88 2dla h PHE 177 N 1.04 -1.03 -0.77 0.00 3.57 -0.34 -2.18 116.94 117.23 2dla h PHE 177 Ca 0.21 -0.02 0.18 0.00 3.53 0.00 0.00 57.97 61.87 2dla h PHE 177 Cb 0.43 0.34 -0.05 0.00 2.79 0.00 0.00 35.95 39.46 2dla h PHE 177 CO 0.03 -0.64 0.53 0.93 -2.23 0.00 0.00 178.31 176.93 2dla h GLU 178 N -1.13 0.23 0.21 1.11 5.08 -1.20 -0.96 114.58 117.92 2dla h GLU 178 Ca -0.11 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.22 2dla h GLU 178 Cb 0.86 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.06 2dla h GLU 178 CO 0.19 0.15 -0.10 0.00 -1.00 0.00 0.00 179.01 178.25 2dla h ARG 179 N 0.24 -0.27 -0.98 2.33 3.08 -1.27 -3.01 114.38 114.50 2dla h ARG 179 Ca 0.38 0.02 0.10 0.00 0.07 0.00 0.00 59.98 60.55 2dla h ARG 179 Cb 1.13 0.06 -0.08 0.00 0.08 0.00 0.00 29.97 31.16 2dla h ARG 179 CO -0.09 0.09 0.61 -0.91 -1.07 0.00 0.00 179.97 178.61 2dla h ASN 180 N -0.70 0.92 -0.78 7.04 2.35 -0.66 0.89 115.58 124.64 2dla h ASN 180 Ca -0.03 0.04 0.15 0.00 -0.55 0.00 0.00 56.30 55.91 2dla h ASN 180 Cb 0.49 -0.15 -0.10 0.00 0.05 0.00 0.00 38.32 38.61 2dla h ASN 180 CO 0.05 0.52 0.33 0.58 -1.65 0.00 0.00 177.43 177.25 2dla h VAL 181 N 1.01 0.66 0.68 2.81 2.07 -1.19 0.87 116.25 123.16 2dla h VAL 181 Ca 0.47 -0.16 -0.03 0.00 0.82 0.00 0.00 66.70 67.79 2dla h VAL 181 Cb 0.39 0.15 0.01 0.00 -1.52 0.00 0.00 31.29 30.32 2dla h VAL 181 CO -0.24 0.09 -0.33 -0.08 0.02 0.00 0.00 177.57 177.03 2dla h GLU 182 N 0.47 -0.88 -0.73 1.57 4.81 -0.77 -0.43 114.58 118.62 2dla h GLU 182 Ca 0.43 0.06 0.16 0.00 -0.13 0.00 0.00 59.36 59.88 2dla h GLU 182 Cb 0.66 0.20 -0.11 0.00 0.63 0.00 0.00 28.75 30.13 2dla h GLU 182 CO -0.40 -0.56 0.19 -0.09 -0.73 0.00 0.00 179.01 177.42 2dla h ARG 183 N -1.14 0.28 -0.51 1.92 2.43 -0.33 0.21 114.38 117.23 2dla h ARG 183 Ca -0.09 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.05 2dla h ARG 183 Cb 0.73 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.20 2dla h ARG 183 CO 0.15 0.18 0.29 0.78 -1.51 0.00 0.00 179.97 179.87 2dla h GLY 184 N 0.29 0.76 1.64 2.80 0.00 0.83 -1.76 103.07 107.62 2dla h GLY 184 Ca 0.41 -0.33 -0.04 0.00 0.00 0.00 0.00 47.33 47.36 2dla h GLY 184 CO -0.49 0.32 -0.01 -2.08 0.00 0.00 0.00 176.54 174.28 2dla h VAL 185 N 0.69 1.18 0.62 4.60 2.07 0.72 -1.80 116.25 124.33 2dla h VAL 185 Ca 0.18 -0.73 -0.03 0.00 0.82 0.00 0.00 66.70 66.94 2dla h VAL 185 Cb 0.02 0.97 0.01 0.00 -1.52 0.00 0.00 31.29 30.77 2dla h VAL 185 CO -0.03 0.25 -0.30 0.78 0.02 0.00 0.00 177.57 178.29 2dla h ASN 186 N 0.44 -0.71 -0.82 0.57 2.35 -0.47 0.40 115.58 117.35 2dla h ASN 186 Ca 0.10 -0.02 0.15 0.00 -0.55 0.00 0.00 56.30 55.97 2dla h ASN 186 Cb 0.30 0.18 -0.10 0.00 0.05 0.00 0.00 38.32 38.76 2dla h ASN 186 CO 0.01 -0.37 0.39 0.24 -1.65 0.00 0.00 177.43 176.04 2dla h MET 187 N -1.05 0.53 -0.26 0.81 2.86 -1.27 -0.79 114.93 115.77 2dla h MET 187 Ca -0.09 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.51 2dla h MET 187 Cb 0.69 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 32.22 2dla h MET 187 CO 0.14 0.35 0.10 1.25 1.06 0.00 0.00 176.91 179.82 2dla h LEU 188 N 0.55 0.35 -1.41 1.22 5.85 -1.24 -2.98 115.31 117.65 2dla h LEU 188 Ca 0.45 -0.16 0.45 0.00 0.84 0.00 0.00 57.88 59.46 2dla h LEU 188 Cb 0.67 -0.09 -0.13 0.00 0.37 0.00 0.00 40.66 41.48 2dla h LEU 188 CO -0.39 0.42 0.87 0.22 -0.34 0.00 0.00 178.44 179.22 2dla h TYR 189 N 0.27 0.51 -0.09 1.25 3.20 0.63 0.09 116.97 122.82 2dla h TYR 189 Ca 0.09 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.93 2dla h TYR 189 Cb 0.17 -0.12 -0.03 0.00 1.54 0.00 0.00 36.73 38.29 2dla h TYR 189 CO -0.01 -0.22 0.06 0.39 -1.64 0.00 0.00 178.16 176.74 2dla n GLU 190 N -4.69 1.12 0.00 1.82 1.02 -1.13 -2.59 120.64 116.19 2dla n GLU 190 Ca 0.38 -0.28 0.00 0.00 -0.02 0.00 0.00 57.16 57.24 2dla n GLU 190 Cb 1.47 -1.11 0.00 0.00 -0.02 0.00 0.00 31.44 31.78 2dla n GLU 190 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 2dla n ILE 191 N 0.52 0.00 -0.03 -3.67 5.41 0.02 -5.01 119.36 116.59 2dla n ILE 191 Ca 0.05 0.00 -0.01 0.00 1.00 0.00 0.00 62.75 63.80 2dla n ILE 191 Cb 0.59 0.17 -0.01 0.00 -0.71 0.00 0.00 39.64 39.68 2dla n ILE 191 CO 0.00 0.00 0.00 0.03 0.00 0.00 0.00 176.55 176.58 2dla h ARG 192 N 0.00 -0.00 -0.99 0.38 3.08 -1.50 -2.69 114.38 112.65 2dla h ARG 192 Ca 0.00 0.00 0.29 0.00 0.07 0.00 0.00 59.98 60.34 2dla h ARG 192 Cb 0.79 0.00 -0.18 0.00 0.08 0.00 0.00 29.97 30.65 2dla h ARG 192 CO 0.00 -0.00 0.09 -0.44 -1.07 0.00 0.00 179.97 178.55 2dla h ASP 193 N -0.00 -0.38 -0.20 7.04 3.32 -1.94 0.20 116.42 124.46 2dla h ASP 193 Ca 0.01 0.28 -0.06 0.00 0.02 0.00 0.00 57.03 57.28 2dla h ASP 193 Cb 0.03 0.46 -0.03 0.00 0.22 0.00 0.00 39.33 40.01 2dla h ASP 193 CO -0.07 -0.37 0.07 -1.84 -1.72 0.00 0.00 179.24 175.31 2dla n GLU 194 N -5.46 1.77 -4.11 3.56 0.28 -1.02 -4.86 120.64 110.80 2dla n GLU 194 Ca 0.25 -0.84 -0.34 0.00 -0.16 0.00 0.00 57.16 56.08 2dla n GLU 194 Cb 0.83 -1.55 -0.07 0.00 1.43 0.00 0.00 31.44 32.08 2dla n GLU 194 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 2dla s LEU 195 N -0.80 3.93 0.70 -1.84 1.02 0.71 -5.07 118.68 117.33 2dla s LEU 195 Ca 0.15 0.20 -0.16 0.00 0.02 0.00 0.00 54.13 54.34 2dla s LEU 195 Cb 0.12 -2.17 -0.01 0.00 0.02 0.00 0.00 46.19 44.14 2dla s LEU 195 CO 0.04 0.31 0.84 -2.65 0.02 0.00 0.00 176.35 174.91 2dla n PRO 196 N 1.47 0.49 0.30 1.29 -0.02 -1.26 -4.86 135.00 132.41 2dla n PRO 196 Ca -0.15 0.22 0.19 0.00 -2.02 0.00 0.00 63.50 61.73 2dla n PRO 196 Cb 0.53 -2.09 0.99 0.00 -0.02 0.00 0.00 33.50 32.91 2dla n PRO 196 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2dla h GLU 197 N -0.19 0.00 -0.74 -0.52 4.81 -1.98 -2.83 114.58 113.13 2dla h GLU 197 Ca -0.47 0.00 0.15 0.00 -0.13 0.00 0.00 59.36 58.91 2dla h GLU 197 Cb 1.34 0.00 -0.14 0.00 0.63 0.00 0.00 28.75 30.58 2dla h GLU 197 CO 0.46 0.00 -0.20 0.35 -0.73 0.00 0.00 179.01 178.89 2dla h PHE 198 N 0.00 -0.43 -0.36 0.92 3.57 -1.99 -0.80 116.94 117.85 2dla h PHE 198 Ca 0.02 0.07 -0.02 0.00 3.53 0.00 0.00 57.97 61.57 2dla h PHE 198 Cb 0.33 0.30 -0.02 0.00 2.79 0.00 0.00 35.95 39.36 2dla h PHE 198 CO 0.00 -0.32 0.16 1.88 -2.23 0.00 0.00 178.31 177.80 2dla h TYR 199 N -0.01 0.53 -0.94 0.41 0.05 -1.86 -0.98 116.97 114.17 2dla h TYR 199 Ca 0.35 -0.03 0.00 0.00 0.05 0.00 0.00 58.73 59.10 2dla h TYR 199 Cb 0.54 -0.16 -0.05 0.00 1.01 0.00 0.00 36.73 38.08 2dla h TYR 199 CO -0.60 0.47 0.60 0.00 -1.05 0.00 0.00 178.16 177.57 2dla h ARG 200 N 0.44 1.26 -0.54 4.88 3.08 -1.54 -0.18 114.38 121.78 2dla h ARG 200 Ca 0.12 -0.10 -0.02 0.00 0.07 0.00 0.00 59.98 60.06 2dla h ARG 200 Cb 0.15 -0.27 -0.03 0.00 0.08 0.00 0.00 29.97 29.90 2dla h ARG 200 CO -0.01 0.86 0.27 0.87 -1.07 0.00 0.00 179.97 180.88 2dla h LYS 201 N 1.29 0.75 -0.37 0.04 1.57 -0.67 -1.71 116.57 117.47 2dla h LYS 201 Ca 0.34 -0.09 -0.10 0.00 -1.87 0.00 0.00 60.65 58.93 2dla h LYS 201 Cb -0.10 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.05 2dla h LYS 201 CO -0.07 0.58 -0.17 0.28 -0.57 0.00 0.00 179.45 179.51 2dla h VAL 202 N 0.76 1.28 -0.14 0.50 2.07 0.03 -2.60 116.25 118.16 2dla h VAL 202 Ca 0.19 -1.29 0.02 0.00 0.82 0.00 0.00 66.70 66.45 2dla h VAL 202 Cb 0.07 1.32 -0.02 0.00 -1.52 0.00 0.00 31.29 31.14 2dla h VAL 202 CO -0.03 0.43 -0.00 0.25 0.02 0.00 0.00 177.57 178.24 2dla h LEU 203 N 0.57 -0.06 -1.53 2.57 5.85 -0.49 -0.35 115.31 121.87 2dla h LEU 203 Ca 0.08 0.03 0.17 0.00 0.84 0.00 0.00 57.88 59.01 2dla h LEU 203 Cb 0.71 0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.74 2dla h LEU 203 CO 0.05 -0.01 0.55 1.23 -0.34 0.00 0.00 178.44 179.93 2dla h GLY 204 N 0.04 0.82 1.86 3.75 0.00 -1.24 0.37 103.07 108.67 2dla h GLY 204 Ca 0.06 -0.19 -0.19 0.00 0.00 0.00 0.00 47.33 47.01 2dla h GLY 204 CO -0.11 0.03 -0.85 0.83 0.00 0.00 0.00 176.54 176.44 2dla h GLU 205 N 0.43 0.13 -0.30 4.80 4.39 -0.83 -0.09 114.58 123.11 2dla h GLU 205 Ca 0.42 -0.14 -0.13 0.00 0.34 0.00 0.00 59.36 59.86 2dla h GLU 205 Cb 0.99 0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 29.68 2dla h GLU 205 CO -0.15 0.90 -0.31 0.82 -1.16 0.00 0.00 179.01 179.11 2dla h ILE 206 N 0.07 1.30 -0.18 3.13 2.04 0.58 -1.56 117.51 122.89 2dla h ILE 206 Ca -0.03 -1.48 -0.01 0.00 1.00 0.00 0.00 64.86 64.34 2dla h ILE 206 Cb 1.47 1.56 -0.01 0.00 -0.74 0.00 0.00 36.82 39.11 2dla h ILE 206 CO 0.12 0.48 0.08 1.56 0.00 0.00 0.00 178.15 180.39 2dla h GLN 207 N 0.49 0.27 -0.58 2.37 4.20 -0.97 0.48 115.11 121.37 2dla h GLN 207 Ca 0.05 -0.05 0.12 0.00 0.06 0.00 0.00 58.65 58.83 2dla h GLN 207 Cb 0.88 -0.04 -0.10 0.00 0.30 0.00 0.00 27.48 28.52 2dla h GLN 207 CO 0.08 0.33 -0.06 0.00 -0.67 0.00 0.00 178.83 178.51 2dla h ALA 208 N 0.92 0.49 -0.35 3.87 0.00 -0.87 0.42 119.26 123.74 2dla h ALA 208 Ca 0.06 0.20 -0.10 0.00 0.00 0.00 0.00 54.91 55.07 2dla h ALA 208 Cb 0.16 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2dla h ALA 208 CO -0.01 -0.41 -0.16 0.35 0.00 0.00 0.00 179.25 179.02 2dla h PHE 209 N 0.07 0.84 -0.27 0.00 3.57 -0.97 -2.51 116.94 117.66 2dla h PHE 209 Ca 0.29 -0.21 0.04 0.00 3.53 0.00 0.00 57.97 61.62 2dla h PHE 209 Cb 0.46 -0.19 -0.06 0.00 2.79 0.00 0.00 35.95 38.94 2dla h PHE 209 CO -0.40 0.92 -0.45 0.00 -2.23 0.00 0.00 178.31 176.15 2dla h ALA 210 N 0.79 -0.72 -0.10 2.41 0.00 0.20 -1.49 119.26 120.35 2dla h ALA 210 Ca 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2dla h ALA 210 Cb 0.70 1.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.50 2dla h ALA 210 CO 0.05 -0.92 0.06 1.05 0.00 0.00 0.00 179.25 179.48 2dla h GLU 211 N -0.36 0.12 -1.34 0.00 4.11 -1.17 -1.20 114.58 114.73 2dla h GLU 211 Ca 0.05 -0.01 0.41 0.00 0.07 0.00 0.00 59.36 59.88 2dla h GLU 211 Cb 0.50 -0.03 -0.11 0.00 0.50 0.00 0.00 28.75 29.62 2dla h GLU 211 CO -0.45 0.08 0.89 0.93 0.07 0.00 0.00 179.01 180.53 2dla h GLU 212 N 0.12 0.12 0.00 1.06 5.08 -0.93 1.91 114.58 121.94 2dla h GLU 212 Ca 0.04 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 2dla h GLU 212 Cb -0.01 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.21 2dla h GLU 212 CO -0.01 0.08 -0.36 0.93 -1.00 0.00 0.00 179.01 178.64 2dla h GLU 213 N 0.12 0.00 -0.90 2.33 4.39 -0.66 -3.08 114.58 116.79 2dla h GLU 213 Ca 0.77 0.00 0.14 0.00 0.34 0.00 0.00 59.36 60.60 2dla h GLU 213 Cb 2.50 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 31.08 2dla h GLU 213 CO -0.30 0.09 0.58 0.74 -1.16 0.00 0.00 179.01 178.95 2dla h PHE 214 N -1.00 0.86 -0.02 4.33 -1.00 -0.61 -2.34 116.94 117.17 2dla h PHE 214 Ca -0.02 0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.79 2dla h PHE 214 Cb 0.39 -0.27 -0.00 0.00 3.61 0.00 0.00 35.95 39.68 2dla h PHE 214 CO -0.11 0.32 -0.01 0.78 -1.61 0.00 0.00 178.31 177.69 2dla h GLY 215 N 0.73 0.01 0.29 -1.45 0.00 0.28 -3.10 103.07 99.84 2dla h GLY 215 Ca 0.45 0.01 0.14 0.00 0.00 0.00 0.00 47.33 47.93 2dla h GLY 215 CO -0.21 -0.01 0.46 0.07 0.00 0.00 0.00 176.54 176.85 2dla h ARG 216 N -0.01 0.66 -0.00 4.80 0.11 -1.32 -3.50 114.38 115.12 2dla h ARG 216 Ca 0.01 -0.04 0.00 0.00 0.10 0.00 0.00 59.98 60.05 2dla h ARG 216 Cb 0.02 -0.15 0.00 0.00 1.11 0.00 0.00 29.97 30.95 2dla h ARG 216 CO -0.02 0.44 0.00 1.63 0.10 0.00 0.00 179.97 182.12