#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k9a n ASP 2 N 0.00 0.27 -4.52 7.83 5.75 -1.26 -5.04 116.55 119.58 2k9a n ASP 2 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 54.79 54.36 2k9a n ASP 2 Cb 0.00 0.03 -0.08 0.00 -1.03 0.00 0.00 41.12 40.04 2k9a n ASP 2 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2k9a s ALA 3 N -0.84 3.43 0.29 2.12 0.00 -1.26 -5.06 121.76 120.44 2k9a s ALA 3 Ca 0.00 -1.24 0.03 0.00 0.00 0.00 0.00 51.96 50.75 2k9a s ALA 3 Cb 0.00 -3.08 -0.03 0.00 0.00 0.00 0.00 23.12 20.01 2k9a s ALA 3 CO 0.00 -1.47 0.45 -0.51 0.00 0.00 0.00 175.76 174.23 2k9a s LEU 4 N 2.39 4.18 -0.29 0.00 1.02 -1.26 -5.11 118.68 119.60 2k9a s LEU 4 Ca 0.17 0.24 -0.14 0.00 0.02 0.00 0.00 54.13 54.42 2k9a s LEU 4 Cb -0.16 -3.07 0.10 0.00 0.02 0.00 0.00 46.19 43.08 2k9a s LEU 4 CO 0.15 -0.18 0.68 -0.70 0.02 0.00 0.00 176.35 176.32 2k9a s GLU 5 N -4.14 0.67 -0.89 1.70 2.56 -1.26 -5.09 118.70 112.25 2k9a s GLU 5 Ca 0.37 1.31 -0.25 0.00 0.00 0.00 0.00 54.97 56.40 2k9a s GLU 5 Cb -0.09 0.39 -0.06 0.00 2.00 0.00 0.00 34.13 36.37 2k9a s GLU 5 CO 0.32 -0.17 2.00 0.20 -0.56 0.00 0.00 175.26 177.06 2k9a s GLY 6 N 2.06 0.05 0.33 -1.50 0.00 -1.26 -4.75 107.32 102.25 2k9a s GLY 6 Ca -0.09 -1.42 0.15 0.00 0.00 0.00 0.00 44.72 43.37 2k9a s GLY 6 CO -0.20 3.58 1.67 -2.09 0.00 0.00 0.00 173.10 176.06 2k9a h GLU 7 N 11.48 0.00 -5.33 2.90 4.57 -2.05 -3.42 114.58 122.72 2k9a h GLU 7 Ca 0.08 0.00 -0.60 0.00 -1.18 0.00 0.00 59.36 57.66 2k9a h GLU 7 Cb 1.01 0.00 -0.12 0.00 -0.16 0.00 0.00 28.75 29.48 2k9a h GLU 7 CO 1.18 0.49 -0.36 0.45 -1.18 0.00 0.00 179.01 179.59 2k9a s SER 8 N -6.61 6.32 -0.05 1.04 0.15 -1.26 -5.07 113.70 108.22 2k9a s SER 8 Ca -0.00 0.36 -0.02 0.00 0.70 0.00 0.00 55.95 56.99 2k9a s SER 8 Cb 0.11 -2.16 0.03 0.00 -1.71 0.00 0.00 66.02 62.30 2k9a s SER 8 CO 0.72 0.06 0.09 0.12 1.20 0.00 0.00 173.24 175.42 2k9a s PHE 9 N 0.83 -0.03 -0.44 3.44 5.36 -1.26 -5.11 117.98 120.77 2k9a s PHE 9 Ca 0.14 0.33 -0.29 0.00 -0.96 0.00 0.00 56.93 56.15 2k9a s PHE 9 Cb -0.13 -0.32 0.02 0.00 -0.34 0.00 0.00 43.02 42.25 2k9a s PHE 9 CO 0.04 -0.18 1.22 0.00 -1.46 0.00 0.00 175.22 174.84 2k9a s ALA 10 N 1.80 3.16 -0.00 11.12 0.00 -1.26 -4.94 121.76 131.65 2k9a s ALA 10 Ca -0.01 -0.32 -0.00 0.00 0.00 0.00 0.00 51.96 51.63 2k9a s ALA 10 Cb -0.12 -3.89 -0.00 0.00 0.00 0.00 0.00 23.12 19.11 2k9a s ALA 10 CO -0.04 -2.21 0.45 -0.07 0.00 0.00 0.00 175.76 173.89 2k9a h LEU 11 N 11.39 -0.01 0.00 0.00 3.38 -2.05 -3.49 115.31 124.53 2k9a h LEU 11 Ca -0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.73 2k9a h LEU 11 Cb 1.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.83 2k9a h LEU 11 CO 1.10 -0.00 0.00 -0.24 0.09 0.00 0.00 178.44 179.39 2k9a n SER 12 N -2.08 -2.76 -2.78 -0.43 2.88 -1.26 -5.12 113.62 102.07 2k9a n SER 12 Ca -0.00 0.65 -0.01 0.00 -1.33 0.00 0.00 58.87 58.18 2k9a n SER 12 Cb 0.01 2.71 -0.01 0.00 -0.75 0.00 0.00 64.21 66.17 2k9a n SER 12 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 2k9a n PHE 13 N -3.15 -3.44 -3.64 0.66 3.72 -1.26 -4.91 117.46 105.44 2k9a n PHE 13 Ca 0.00 1.60 -0.13 0.00 -0.05 0.00 0.00 57.45 58.87 2k9a n PHE 13 Cb 0.00 -3.52 -0.13 0.00 -0.94 0.00 0.00 39.48 34.89 2k9a n PHE 13 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 2k9a s SER 14 N -1.38 0.37 -0.44 4.37 1.04 -1.26 -5.06 113.70 111.34 2k9a s SER 14 Ca -0.04 0.56 0.02 0.00 0.48 0.00 0.00 55.95 56.97 2k9a s SER 14 Cb 0.00 0.75 0.14 0.00 0.10 0.00 0.00 66.02 67.01 2k9a s SER 14 CO 0.66 -0.25 0.27 -0.55 0.98 0.00 0.00 173.24 174.35 2k9a s SER 15 N 2.43 3.33 0.00 7.02 0.15 -1.26 -4.94 113.70 120.44 2k9a s SER 15 Ca 0.02 -2.70 0.19 0.00 0.70 0.00 0.00 55.95 54.15 2k9a s SER 15 Cb -0.12 -0.89 0.89 0.00 -1.71 0.00 0.00 66.02 64.19 2k9a s SER 15 CO -0.09 -0.25 1.59 0.00 1.20 0.00 0.00 173.24 175.69 2k9a n ALA 16 N 3.41 1.95 0.37 5.45 0.00 -1.26 -1.95 120.51 128.47 2k9a n ALA 16 Ca 0.13 -0.08 -0.14 0.00 0.00 0.00 0.00 53.44 53.35 2k9a n ALA 16 Cb 0.37 -1.31 -0.07 0.00 0.00 0.00 0.00 19.45 18.44 2k9a n ALA 16 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2k9a h SER 17 N 0.00 -0.79 0.00 0.00 4.64 -2.00 -3.45 113.55 111.95 2k9a h SER 17 Ca 0.00 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 2k9a h SER 17 Cb 0.24 0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 2k9a h SER 17 CO 0.00 -0.55 0.00 -0.67 -0.87 0.00 0.00 176.83 174.74 2k9a n ASP 18 N -4.59 0.00 0.25 4.97 2.03 -1.24 -4.94 116.55 113.03 2k9a n ASP 18 Ca -0.12 0.00 -0.13 0.00 0.52 0.00 0.00 54.79 55.07 2k9a n ASP 18 Cb 0.37 0.00 -0.07 0.00 -0.72 0.00 0.00 41.12 40.70 2k9a n ASP 18 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2k9a h ALA 19 N 0.00 -0.68 -0.05 -1.67 0.00 -1.91 -1.96 119.26 113.00 2k9a h ALA 19 Ca 0.00 -0.18 -0.24 0.00 0.00 0.00 0.00 54.91 54.49 2k9a h ALA 19 Cb 0.00 0.26 0.02 0.00 0.00 0.00 0.00 17.79 18.07 2k9a h ALA 19 CO 0.00 -0.68 -0.89 1.49 0.00 0.00 0.00 179.25 179.17 2k9a h GLU 20 N -1.08 0.69 -0.44 0.00 4.57 -1.78 -2.69 114.58 113.85 2k9a h GLU 20 Ca -0.07 -0.68 0.06 0.00 -1.18 0.00 0.00 59.36 57.49 2k9a h GLU 20 Cb 0.59 0.18 -0.05 0.00 -0.16 0.00 0.00 28.75 29.30 2k9a h GLU 20 CO 0.11 1.27 0.14 0.35 -1.18 0.00 0.00 179.01 179.71 2k9a h PHE 21 N 0.37 0.24 -0.56 0.92 3.57 -1.57 -1.77 116.94 118.13 2k9a h PHE 21 Ca -0.10 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.34 2k9a h PHE 21 Cb 1.55 -0.04 -0.02 0.00 2.79 0.00 0.00 35.95 40.22 2k9a h PHE 21 CO 0.10 0.08 0.02 0.22 -2.23 0.00 0.00 178.31 176.50 2k9a h ASP 22 N 0.30 0.93 -0.19 0.41 1.82 -1.40 -2.68 116.42 115.60 2k9a h ASP 22 Ca 0.21 -0.24 0.05 0.00 -0.39 0.00 0.00 57.03 56.66 2k9a h ASP 22 Cb 0.22 -0.25 -0.05 0.00 0.68 0.00 0.00 39.33 39.93 2k9a h ASP 22 CO -0.23 0.97 -0.15 0.00 -1.61 0.00 0.00 179.24 178.23 2k9a h ALA 23 N 1.12 -0.01 -0.57 -0.78 0.00 -0.99 -1.29 119.26 116.74 2k9a h ALA 23 Ca 0.17 0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.18 2k9a h ALA 23 Cb 0.49 0.32 -0.04 0.00 0.00 0.00 0.00 17.79 18.57 2k9a h ALA 23 CO 0.02 -0.58 0.33 0.28 0.00 0.00 0.00 179.25 179.31 2k9a h VAL 24 N -0.15 1.03 -0.95 0.00 2.07 -1.27 -2.00 116.25 114.98 2k9a h VAL 24 Ca 0.11 -0.22 0.12 0.00 0.82 0.00 0.00 66.70 67.53 2k9a h VAL 24 Cb 0.32 0.33 -0.08 0.00 -1.52 0.00 0.00 31.29 30.34 2k9a h VAL 24 CO -0.28 0.12 0.58 0.58 0.02 0.00 0.00 177.57 178.59 2k9a h VAL 25 N 0.65 0.90 -0.62 2.57 2.07 -1.03 -0.86 116.25 119.93 2k9a h VAL 25 Ca 0.24 -0.32 -0.01 0.00 0.82 0.00 0.00 66.70 67.43 2k9a h VAL 25 Cb 0.06 -0.10 -0.03 0.00 -1.52 0.00 0.00 31.29 29.70 2k9a h VAL 25 CO -0.12 0.17 0.35 1.23 0.02 0.00 0.00 177.57 179.22 2k9a h GLY 26 N 0.93 0.92 1.91 2.17 0.00 -0.52 -1.95 103.07 106.52 2k9a h GLY 26 Ca 0.47 -0.41 -0.04 0.00 0.00 0.00 0.00 47.33 47.36 2k9a h GLY 26 CO -0.27 0.39 -0.13 -0.97 0.00 0.00 0.00 176.54 175.57 2k9a h TYR 27 N 0.84 0.12 -0.13 5.60 0.05 -0.87 -2.70 116.97 119.88 2k9a h TYR 27 Ca 0.22 -0.01 -0.01 0.00 0.05 0.00 0.00 58.73 58.98 2k9a h TYR 27 Cb 0.03 -0.04 -0.01 0.00 1.01 0.00 0.00 36.73 37.73 2k9a h TYR 27 CO -0.01 0.25 0.05 -0.07 -1.05 0.00 0.00 178.16 177.33 2k9a h LEU 28 N 0.11 0.18 -0.82 3.88 3.38 -0.48 -2.54 115.31 119.03 2k9a h LEU 28 Ca 0.02 -0.16 0.04 0.00 0.09 0.00 0.00 57.88 57.88 2k9a h LEU 28 Cb 0.30 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 40.95 2k9a h LEU 28 CO 0.02 0.29 0.51 -0.33 0.09 0.00 0.00 178.44 179.02 2k9a h GLU 29 N 0.06 0.95 -0.39 1.13 5.08 -1.17 -0.88 114.58 119.36 2k9a h GLU 29 Ca 0.04 -0.06 0.04 0.00 -1.00 0.00 0.00 59.36 58.39 2k9a h GLU 29 Cb 0.17 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.18 2k9a h GLU 29 CO -0.00 0.63 0.26 0.22 -1.00 0.00 0.00 179.01 179.12 2k9a h ASP 30 N 0.98 0.30 -0.14 1.42 3.58 -1.27 -1.89 116.42 119.40 2k9a h ASP 30 Ca 0.34 -0.00 -0.21 0.00 0.42 0.00 0.00 57.03 57.58 2k9a h ASP 30 Cb 0.07 -0.07 0.01 0.00 1.72 0.00 0.00 39.33 41.06 2k9a h ASP 30 CO -0.14 0.20 -0.73 0.40 -2.88 0.00 0.00 179.24 176.10 2k9a h ILE 31 N 0.35 1.29 -0.61 2.25 2.04 -0.77 -1.99 117.51 120.08 2k9a h ILE 31 Ca 0.17 -1.95 0.03 0.00 1.00 0.00 0.00 64.86 64.11 2k9a h ILE 31 Cb 0.22 2.04 -0.03 0.00 -0.74 0.00 0.00 36.82 38.31 2k9a h ILE 31 CO -0.04 0.61 0.40 0.40 0.00 0.00 0.00 178.15 179.53 2k9a h ILE 32 N 0.45 1.08 -0.37 -0.67 2.04 -0.61 -0.62 117.51 118.81 2k9a h ILE 32 Ca -0.05 -0.24 0.00 0.00 1.00 0.00 0.00 64.86 65.56 2k9a h ILE 32 Cb 1.37 0.31 0.00 0.00 -0.74 0.00 0.00 36.82 37.75 2k9a h ILE 32 CO 0.15 0.13 0.00 0.23 0.00 0.00 0.00 178.15 178.66 2k9a n MET 33 N -4.46 2.34 -2.25 2.37 2.81 -0.98 -4.76 117.12 112.19 2k9a n MET 33 Ca 0.07 -2.03 -0.42 0.00 -1.81 0.00 0.00 57.70 53.51 2k9a n MET 33 Cb 0.14 -1.49 -0.03 0.00 -0.71 0.00 0.00 33.22 31.13 2k9a n MET 33 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 2k9a s ASP 34 N -1.45 6.90 0.14 7.83 -1.08 -0.24 -4.93 116.67 123.84 2k9a s ASP 34 Ca 0.38 2.22 -0.18 0.00 -0.52 0.00 0.00 52.55 54.45 2k9a s ASP 34 Cb 0.21 -2.58 0.02 0.00 -1.46 0.00 0.00 42.92 39.12 2k9a s ASP 34 CO 0.30 -0.60 1.74 -2.24 0.52 0.00 0.00 175.17 174.89 2k9a h ASP 35 N 6.83 0.03 0.08 -0.34 2.03 -1.89 -0.65 116.42 122.51 2k9a h ASP 35 Ca -0.42 0.04 -0.01 0.00 -0.73 0.00 0.00 57.03 55.91 2k9a h ASP 35 Cb 1.21 0.05 -0.00 0.00 -0.83 0.00 0.00 39.33 39.76 2k9a h ASP 35 CO 0.85 0.05 -0.05 -0.33 -1.03 0.00 0.00 179.24 178.73 2k9a h GLU 36 N 0.18 0.00 0.03 4.15 4.39 -1.94 -2.21 114.58 119.17 2k9a h GLU 36 Ca 0.14 0.00 -0.27 0.00 0.34 0.00 0.00 59.36 59.56 2k9a h GLU 36 Cb 0.14 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 28.81 2k9a h GLU 36 CO -0.17 0.05 -1.09 0.35 -1.16 0.00 0.00 179.01 176.99 2k9a h PHE 37 N 0.00 1.03 -0.36 4.33 3.57 -1.50 -2.27 116.94 121.74 2k9a h PHE 37 Ca -0.00 -0.58 -0.02 0.00 3.53 0.00 0.00 57.97 60.90 2k9a h PHE 37 Cb 0.11 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 38.72 2k9a h PHE 37 CO 0.00 1.42 0.17 1.96 -2.23 0.00 0.00 178.31 179.63 2k9a h GLN 38 N 0.37 0.53 -0.28 1.11 4.20 -0.58 -1.33 115.11 119.12 2k9a h GLN 38 Ca -0.14 -0.08 -0.10 0.00 0.06 0.00 0.00 58.65 58.39 2k9a h GLN 38 Cb 1.75 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 29.43 2k9a h GLN 38 CO 0.21 0.49 -0.20 1.25 -0.67 0.00 0.00 178.83 179.91 2k9a h LEU 39 N 0.45 0.67 0.21 1.46 5.85 -1.53 -2.23 115.31 120.18 2k9a h LEU 39 Ca 0.12 -0.44 -0.00 0.00 0.84 0.00 0.00 57.88 58.40 2k9a h LEU 39 Cb 0.14 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 40.97 2k9a h LEU 39 CO -0.01 0.97 -0.16 0.25 -0.34 0.00 0.00 178.44 179.14 2k9a h LEU 40 N 0.37 -0.41 0.05 2.25 5.85 -1.31 0.14 115.31 122.26 2k9a h LEU 40 Ca 0.05 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.80 2k9a h LEU 40 Cb 0.75 0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.91 2k9a h LEU 40 CO 0.05 -0.25 -0.03 -0.61 -0.34 0.00 0.00 178.44 177.27 2k9a h GLN 41 N -0.38 -0.07 -0.28 1.25 4.15 -1.30 -2.74 115.11 115.74 2k9a h GLN 41 Ca -0.01 0.00 -0.04 0.00 0.77 0.00 0.00 58.65 59.38 2k9a h GLN 41 Cb 0.33 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.02 2k9a h GLN 41 CO -0.01 0.03 0.02 -0.09 -1.93 0.00 0.00 178.83 176.85 2k9a h ARG 42 N -0.15 0.42 -0.08 1.69 2.43 -1.36 -0.25 114.38 117.08 2k9a h ARG 42 Ca -0.01 -0.07 -0.00 0.00 -0.81 0.00 0.00 59.98 59.09 2k9a h ARG 42 Cb 0.13 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 29.61 2k9a h ARG 42 CO 0.01 0.43 0.05 -0.97 -1.51 0.00 0.00 179.97 177.98 2k9a h ASN 43 N 0.41 0.10 0.25 -3.80 -0.73 -0.45 -1.93 115.58 109.43 2k9a h ASN 43 Ca 0.09 -0.08 -0.28 0.00 1.87 0.00 0.00 56.30 57.91 2k9a h ASN 43 Cb 0.24 -0.03 0.02 0.00 0.27 0.00 0.00 38.32 38.82 2k9a h ASN 43 CO 0.00 0.15 -1.18 -0.26 -0.37 0.00 0.00 177.43 175.78 2k9a h PHE 44 N 0.05 0.85 0.00 0.67 -1.00 -1.34 -3.20 116.94 112.96 2k9a h PHE 44 Ca 0.03 -0.53 -0.00 0.00 2.81 0.00 0.00 57.97 60.28 2k9a h PHE 44 Cb 0.07 -0.07 -0.00 0.00 3.61 0.00 0.00 35.95 39.56 2k9a h PHE 44 CO -0.05 1.38 -0.00 0.52 -1.61 0.00 0.00 178.31 178.54 2k9a h MET 45 N 0.24 0.00 -0.45 1.51 2.86 -1.01 -1.44 114.93 116.64 2k9a h MET 45 Ca -0.16 0.00 0.11 0.00 -2.06 0.00 0.00 59.70 57.60 2k9a h MET 45 Cb 1.85 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 33.49 2k9a h MET 45 CO 0.22 0.00 0.32 0.22 1.06 0.00 0.00 176.91 178.73 2k9a h ASP 46 N 0.00 0.08 0.06 1.22 3.58 -1.34 -1.66 116.42 118.36 2k9a h ASP 46 Ca -0.00 0.00 -0.37 0.00 0.42 0.00 0.00 57.03 57.08 2k9a h ASP 46 Cb 0.01 -0.01 -0.06 0.00 1.72 0.00 0.00 39.33 40.99 2k9a h ASP 46 CO 0.00 0.05 -2.32 0.29 -2.88 0.00 0.00 179.24 174.37 2k9a n LYS 47 N -4.43 0.68 -0.04 0.28 4.76 -0.58 -4.30 118.16 114.53 2k9a n LYS 47 Ca 0.07 0.14 -0.08 0.00 -2.87 0.00 0.00 58.31 55.57 2k9a n LYS 47 Cb 0.46 -1.57 -0.02 0.00 -1.84 0.00 0.00 35.03 32.06 2k9a n LYS 47 CO 0.00 0.00 0.00 1.88 -1.37 0.00 0.00 177.40 177.91 2k9a h TYR 48 N 0.01 -0.05 0.00 2.13 -1.99 -1.07 -0.89 116.97 115.12 2k9a h TYR 48 Ca -0.53 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.22 2k9a h TYR 48 Cb 2.02 0.05 0.00 0.00 2.00 0.00 0.00 36.73 40.80 2k9a h TYR 48 CO 0.03 -0.05 0.00 2.48 -0.00 0.00 0.00 178.16 180.61 2k9a n TYR 49 N -5.16 0.52 -0.06 4.88 4.11 -0.66 -1.71 117.16 119.07 2k9a n TYR 49 Ca -0.02 0.23 -0.15 0.00 -0.00 0.00 0.00 57.90 57.96 2k9a n TYR 49 Cb 0.12 -0.87 -0.13 0.00 -0.00 0.00 0.00 39.34 38.46 2k9a n TYR 49 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.86 176.79 2k9a h LEU 50 N 0.00 0.05 -0.59 -3.48 3.38 -1.36 -3.36 115.31 109.95 2k9a h LEU 50 Ca 0.00 -0.94 -0.15 0.00 0.09 0.00 0.00 57.88 56.88 2k9a h LEU 50 Cb 0.18 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 2k9a h LEU 50 CO 0.00 1.10 -0.50 -0.33 0.09 0.00 0.00 178.44 178.79 2k9a h GLU 51 N -0.94 0.53 -5.90 1.13 5.08 -1.24 -3.39 114.58 109.84 2k9a h GLU 51 Ca -0.05 -0.31 -0.47 0.00 -1.00 0.00 0.00 59.36 57.53 2k9a h GLU 51 Cb 1.10 0.03 -0.08 0.00 0.50 0.00 0.00 28.75 30.30 2k9a h GLU 51 CO -0.01 0.91 1.21 -0.06 -1.00 0.00 0.00 179.01 180.06 2k9a s PHE 52 N -4.06 2.22 -0.01 4.33 0.40 -0.69 -4.95 117.98 115.22 2k9a s PHE 52 Ca -0.07 -0.23 0.04 0.00 -0.60 0.00 0.00 56.93 56.07 2k9a s PHE 52 Cb 0.12 -4.40 -0.03 0.00 0.51 0.00 0.00 43.02 39.21 2k9a s PHE 52 CO 0.83 -1.82 -0.12 -2.00 0.70 0.00 0.00 175.22 172.81 2k9a s GLU 53 N 5.83 2.45 -0.47 0.44 2.12 -1.26 -4.82 118.70 122.99 2k9a s GLU 53 Ca 0.57 -0.75 -0.27 0.00 0.36 0.00 0.00 54.97 54.88 2k9a s GLU 53 Cb -0.03 -2.40 -0.05 0.00 0.26 0.00 0.00 34.13 31.92 2k9a s GLU 53 CO -0.04 0.60 2.19 0.16 -0.54 0.00 0.00 175.26 177.63 2k9a s ASP 54 N -1.12 4.93 0.17 -1.70 -4.77 -1.26 -4.90 116.67 108.02 2k9a s ASP 54 Ca 0.14 1.03 0.04 0.00 -3.30 0.00 0.00 52.55 50.46 2k9a s ASP 54 Cb -0.11 -2.51 -0.01 0.00 -1.09 0.00 0.00 42.92 39.20 2k9a s ASP 54 CO 0.04 -2.52 0.14 0.35 0.70 0.00 0.00 175.17 173.88 2k9a n THR 55 N 7.71 0.00 -0.19 2.11 -2.24 -1.26 -5.06 114.28 115.34 2k9a n THR 55 Ca 0.30 -1.24 0.00 0.00 -2.27 0.00 0.00 64.05 60.84 2k9a n THR 55 Cb 0.52 0.61 0.00 0.00 -2.10 0.00 0.00 70.33 69.36 2k9a n THR 55 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2k9a n GLU 56 N -0.34 2.40 -3.86 -0.78 -0.00 -1.26 -5.01 120.64 111.79 2k9a n GLU 56 Ca 0.03 -1.30 -0.36 0.00 -0.00 0.00 0.00 57.16 55.54 2k9a n GLU 56 Cb 0.31 -0.90 -0.12 0.00 -0.00 0.00 0.00 31.44 30.73 2k9a n GLU 56 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.13 175.13 2k9a s GLU 57 N -0.80 3.72 -0.04 3.44 2.12 -1.26 -5.08 118.70 120.80 2k9a s GLU 57 Ca 0.00 -0.45 -0.30 0.00 0.36 0.00 0.00 54.97 54.58 2k9a s GLU 57 Cb 0.00 -3.27 -0.02 0.00 0.26 0.00 0.00 34.13 31.10 2k9a s GLU 57 CO 0.00 -0.06 1.01 -0.80 -0.54 0.00 0.00 175.26 174.87 2k9a s ASN 58 N 1.26 7.30 0.11 -1.70 -0.87 -1.26 -5.05 114.94 114.74 2k9a s ASN 58 Ca 0.05 1.62 0.10 0.00 -1.57 0.00 0.00 52.86 53.06 2k9a s ASN 58 Cb -0.15 -2.56 -0.04 0.00 -0.02 0.00 0.00 41.25 38.48 2k9a s ASN 58 CO 0.03 -0.36 -0.26 -0.54 -2.57 0.00 0.00 177.10 173.41 2k9a s LYS 59 N 1.48 1.52 0.00 -0.60 1.02 -1.26 -5.02 119.74 116.89 2k9a s LYS 59 Ca 0.51 -1.28 0.29 0.00 0.02 0.00 0.00 55.97 55.51 2k9a s LYS 59 Cb -0.20 -1.94 1.29 0.00 -0.52 0.00 0.00 37.83 36.45 2k9a s LYS 59 CO 0.24 0.47 1.94 1.28 -0.92 0.00 0.00 175.35 178.35 2k9a n LEU 60 N 1.06 0.03 0.19 3.17 4.77 -1.26 -3.48 117.00 121.47 2k9a n LEU 60 Ca -0.18 0.42 0.14 0.00 -0.03 0.00 0.00 56.01 56.36 2k9a n LEU 60 Cb 0.53 -0.43 0.63 0.00 -2.33 0.00 0.00 43.42 41.82 2k9a n LEU 60 CO 0.24 0.01 0.91 -0.29 -1.33 0.00 0.00 177.39 176.92 2k9a h ILE 61 N 0.01 0.00 0.00 -0.08 6.09 -2.02 -2.19 117.51 119.33 2k9a h ILE 61 Ca 0.00 -0.18 0.00 0.00 -1.37 0.00 0.00 64.86 63.31 2k9a h ILE 61 Cb 0.44 0.90 0.00 0.00 0.47 0.00 0.00 36.82 38.63 2k9a h ILE 61 CO 0.00 0.00 0.00 1.88 -3.07 0.00 0.00 178.15 176.96 2k9a h TYR 62 N 0.00 0.00 0.04 2.19 0.05 -2.00 -2.87 116.97 114.39 2k9a h TYR 62 Ca 0.00 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.78 2k9a h TYR 62 Cb 0.23 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.97 2k9a h TYR 62 CO 0.00 0.00 -0.02 1.15 -1.05 0.00 0.00 178.16 178.24 2k9a h THR 63 N 0.00 1.21 -0.88 -2.88 2.02 -1.67 -2.67 112.91 108.04 2k9a h THR 63 Ca 0.00 -1.68 -0.01 0.00 0.77 0.00 0.00 66.41 65.49 2k9a h THR 63 Cb 0.53 2.19 -0.04 0.00 -1.74 0.00 0.00 68.15 69.09 2k9a h THR 63 CO 0.00 0.37 0.52 -0.65 0.37 0.00 0.00 175.52 176.13 2k9a h PRO 64 N -0.91 1.21 -0.01 6.66 0.11 -1.71 -2.23 132.00 135.12 2k9a h PRO 64 Ca -0.01 -0.12 -0.00 0.00 0.11 0.00 0.00 66.00 65.98 2k9a h PRO 64 Cb 0.66 -0.25 -0.00 0.00 0.11 0.00 0.00 31.00 31.52 2k9a h PRO 64 CO 0.01 0.86 0.01 0.82 -0.21 0.00 0.00 178.00 179.49 2k9a h ILE 65 N 1.22 1.10 -0.96 4.15 2.04 -1.63 -2.40 117.51 121.02 2k9a h ILE 65 Ca 0.31 -0.29 0.09 0.00 1.00 0.00 0.00 64.86 65.98 2k9a h ILE 65 Cb -0.02 1.27 -0.08 0.00 -0.74 0.00 0.00 36.82 37.25 2k9a h ILE 65 CO -0.06 0.08 0.60 0.15 0.00 0.00 0.00 178.15 178.92 2k9a h PHE 66 N -0.10 1.11 -0.56 1.37 3.57 -1.31 -0.82 116.94 120.21 2k9a h PHE 66 Ca 0.00 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.50 2k9a h PHE 66 Cb 0.12 -0.35 -0.03 0.00 2.79 0.00 0.00 35.95 38.48 2k9a h PHE 66 CO -0.04 0.50 0.22 -0.91 -2.23 0.00 0.00 178.31 175.85 2k9a h ASN 67 N 1.02 0.74 -0.40 0.41 -0.26 -1.18 -2.06 115.58 113.85 2k9a h ASN 67 Ca 0.45 -0.09 -0.05 0.00 -0.56 0.00 0.00 56.30 56.04 2k9a h ASN 67 Cb 0.33 -0.19 -0.02 0.00 -1.06 0.00 0.00 38.32 37.38 2k9a h ASN 67 CO -0.22 0.67 0.08 -0.08 -1.06 0.00 0.00 177.43 176.81 2k9a h GLU 68 N 0.80 0.74 -0.38 0.81 4.57 -0.65 -0.66 114.58 119.80 2k9a h GLU 68 Ca 0.19 -0.16 -0.15 0.00 -1.18 0.00 0.00 59.36 58.06 2k9a h GLU 68 Cb 0.17 -0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 28.64 2k9a h GLU 68 CO -0.02 0.70 -0.35 -0.92 -1.18 0.00 0.00 179.01 177.24 2k9a h TYR 69 N 0.71 1.04 0.00 0.92 3.20 -0.95 -0.21 116.97 121.68 2k9a h TYR 69 Ca 0.15 -0.30 -0.14 0.00 3.14 0.00 0.00 58.73 61.59 2k9a h TYR 69 Cb 0.32 -0.22 -0.02 0.00 1.54 0.00 0.00 36.73 38.35 2k9a h TYR 69 CO 0.02 1.10 -0.65 0.82 -1.64 0.00 0.00 178.16 177.80 2k9a h ILE 70 N 0.72 1.41 0.03 1.81 1.08 -1.09 0.14 117.51 121.60 2k9a h ILE 70 Ca 0.07 -2.27 -0.26 0.00 -0.39 0.00 0.00 64.86 62.01 2k9a h ILE 70 Cb 0.93 2.24 -0.03 0.00 -3.07 0.00 0.00 36.82 36.89 2k9a h ILE 70 CO 0.09 0.64 -1.33 -1.28 -0.69 0.00 0.00 178.15 175.58 2k9a h SER 71 N 0.00 0.09 0.00 1.72 0.87 -1.03 -2.97 113.55 112.22 2k9a h SER 71 Ca -0.01 -0.12 0.00 0.00 -1.23 0.00 0.00 61.79 60.44 2k9a h SER 71 Cb 1.19 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 63.12 2k9a h SER 71 CO 0.08 1.10 -0.41 -0.11 -0.53 0.00 0.00 176.83 176.96 2k9a n LEU 72 N -3.28 1.40 0.14 2.23 -0.00 -0.10 -4.19 117.00 113.20 2k9a n LEU 72 Ca -0.09 0.54 -0.07 0.00 -0.00 0.00 0.00 56.01 56.40 2k9a n LEU 72 Cb 1.00 -0.78 -0.03 0.00 -0.00 0.00 0.00 43.42 43.60 2k9a n LEU 72 CO 0.47 -0.48 0.20 0.58 -0.00 0.00 0.00 177.39 178.16 2k9a h VAL 73 N -0.77 0.00 -1.00 1.96 2.07 -1.17 -2.58 116.25 114.76 2k9a h VAL 73 Ca 0.00 -0.55 0.18 0.00 0.82 0.00 0.00 66.70 67.15 2k9a h VAL 73 Cb 0.41 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 30.08 2k9a h VAL 73 CO 0.00 0.00 0.62 -0.08 0.02 0.00 0.00 177.57 178.13 2k9a h GLU 74 N -0.98 0.77 -0.53 1.57 4.81 -1.54 -0.23 114.58 118.45 2k9a h GLU 74 Ca -0.04 -0.05 -0.10 0.00 -0.13 0.00 0.00 59.36 59.04 2k9a h GLU 74 Cb 0.33 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.52 2k9a h GLU 74 CO 0.07 0.51 -0.06 0.87 -0.73 0.00 0.00 179.01 179.67 2k9a h LYS 75 N 0.79 0.97 -0.65 1.92 1.79 -1.62 -2.82 116.57 116.95 2k9a h LYS 75 Ca 0.56 -0.34 0.09 0.00 -2.18 0.00 0.00 60.65 58.78 2k9a h LYS 75 Cb 0.83 -0.07 -0.07 0.00 -1.58 0.00 0.00 32.23 31.34 2k9a h LYS 75 CO -0.35 1.01 0.29 -0.92 -1.08 0.00 0.00 179.45 178.40 2k9a h TYR 76 N 0.84 0.51 0.51 -1.35 5.03 -0.62 0.58 116.97 122.48 2k9a h TYR 76 Ca 0.14 0.03 -0.03 0.00 2.58 0.00 0.00 58.73 61.46 2k9a h TYR 76 Cb 0.61 -0.13 0.01 0.00 1.55 0.00 0.00 36.73 38.76 2k9a h TYR 76 CO 0.04 0.17 -0.25 0.82 -1.32 0.00 0.00 178.16 177.63 2k9a h ILE 77 N 0.51 0.49 0.09 1.81 2.04 -1.32 -2.40 117.51 118.73 2k9a h ILE 77 Ca 0.32 -0.07 -0.00 0.00 1.00 0.00 0.00 64.86 66.11 2k9a h ILE 77 Cb 0.35 0.53 0.00 0.00 -0.74 0.00 0.00 36.82 36.96 2k9a h ILE 77 CO -0.27 0.01 -0.04 -0.08 0.00 0.00 0.00 178.15 177.77 2k9a h GLU 78 N -0.73 -0.12 0.24 2.37 4.81 -1.24 -2.12 114.58 117.80 2k9a h GLU 78 Ca -0.07 0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.18 2k9a h GLU 78 Cb 0.55 0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.91 2k9a h GLU 78 CO 0.12 -0.08 -0.45 0.93 -0.73 0.00 0.00 179.01 178.80 2k9a h GLU 79 N -0.12 -0.73 0.00 1.92 4.39 -0.91 0.11 114.58 119.23 2k9a h GLU 79 Ca -0.01 0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.72 2k9a h GLU 79 Cb 0.09 0.17 -0.00 0.00 -0.10 0.00 0.00 28.75 28.91 2k9a h GLU 79 CO 0.02 -0.49 -0.07 -0.56 -1.16 0.00 0.00 179.01 176.75 2k9a h GLN 80 N -0.76 0.00 0.11 2.33 -0.00 -1.45 -2.13 115.11 113.21 2k9a h GLN 80 Ca -0.01 0.00 -0.30 0.00 -0.00 0.00 0.00 58.65 58.35 2k9a h GLN 80 Cb 0.74 0.00 0.03 0.00 -0.00 0.00 0.00 27.48 28.24 2k9a h GLN 80 CO -0.18 0.07 -1.24 -0.07 -0.00 0.00 0.00 178.83 177.41 2k9a h LEU 81 N 0.00 0.86 -1.41 0.06 3.38 -0.71 -3.25 115.31 114.24 2k9a h LEU 81 Ca -0.00 -0.79 -0.03 0.00 0.09 0.00 0.00 57.88 57.15 2k9a h LEU 81 Cb 0.14 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 2k9a h LEU 81 CO 0.01 1.59 -0.15 -0.07 0.09 0.00 0.00 178.44 179.91 2k9a h LEU 82 N 0.27 0.00 -1.95 1.67 -0.00 -0.28 -2.16 115.31 112.86 2k9a h LEU 82 Ca -0.18 0.00 0.06 0.00 -0.00 0.00 0.00 57.88 57.75 2k9a h LEU 82 Cb 1.91 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 42.56 2k9a h LEU 82 CO 0.24 0.15 0.40 1.56 -0.00 0.00 0.00 178.44 180.79 2k9a h GLN 83 N 0.00 0.00 0.00 1.13 4.20 -1.43 -1.72 115.11 117.29 2k9a h GLN 83 Ca -0.00 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 2k9a h GLN 83 Cb 0.59 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.37 2k9a h GLN 83 CO 0.02 0.00 -1.12 0.54 -0.67 0.00 0.00 178.83 177.60 2k9a n ARG 84 N -3.27 1.62 -3.74 1.46 1.74 -1.05 -4.87 116.66 108.55 2k9a n ARG 84 Ca 0.02 -0.01 -0.28 0.00 -0.77 0.00 0.00 57.85 56.81 2k9a n ARG 84 Cb 0.51 -1.05 -0.12 0.00 -1.02 0.00 0.00 32.46 30.78 2k9a n ARG 84 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2k9a s ILE 85 N -2.11 2.06 -1.17 0.55 1.01 -0.67 -4.93 121.20 115.93 2k9a s ILE 85 Ca -0.01 -3.69 0.13 0.00 0.00 0.00 0.00 60.65 57.09 2k9a s ILE 85 Cb 0.01 -2.37 0.16 0.00 0.01 0.00 0.00 42.46 40.27 2k9a s ILE 85 CO 0.09 -1.06 1.39 -2.65 0.00 0.00 0.00 174.94 172.71 2k9a n PRO 86 N 2.34 0.08 -0.33 2.79 -0.02 -1.04 -1.75 135.00 137.07 2k9a n PRO 86 Ca 0.22 0.23 0.11 0.00 -2.02 0.00 0.00 63.50 62.04 2k9a n PRO 86 Cb 0.39 -1.50 0.30 0.00 -0.02 0.00 0.00 33.50 32.66 2k9a n PRO 86 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2k9a n GLU 87 N -1.41 2.70 -2.11 -0.52 4.71 -1.26 -4.98 120.64 117.76 2k9a n GLU 87 Ca 0.04 -2.56 -0.37 0.00 -0.01 0.00 0.00 57.16 54.26 2k9a n GLU 87 Cb 0.13 -1.54 0.01 0.00 -1.01 0.00 0.00 31.44 29.04 2k9a n GLU 87 CO 0.00 0.00 0.00 0.12 0.09 0.00 0.00 177.13 177.34 2k9a s PHE 88 N -1.06 2.63 -0.33 -0.32 5.36 -0.71 -5.02 117.98 118.52 2k9a s PHE 88 Ca 0.46 1.50 -0.01 0.00 -0.96 0.00 0.00 56.93 57.92 2k9a s PHE 88 Cb 0.24 -3.47 0.11 0.00 -0.34 0.00 0.00 43.02 39.56 2k9a s PHE 88 CO 0.32 -1.94 0.15 1.21 -1.46 0.00 0.00 175.22 173.49 2k9a s ASN 89 N -1.39 3.69 0.53 6.13 3.04 -1.26 -4.99 114.94 120.69 2k9a s ASN 89 Ca 0.69 -1.80 0.21 0.00 0.04 0.00 0.00 52.86 52.00 2k9a s ASN 89 Cb -0.31 -0.70 1.36 0.00 -1.54 0.00 0.00 41.25 40.07 2k9a s ASN 89 CO 0.36 -0.38 2.10 0.24 -3.04 0.00 0.00 177.10 176.37 2k9a h MET 90 N 7.78 0.00 0.62 0.43 2.86 -1.98 0.33 114.93 124.98 2k9a h MET 90 Ca -0.10 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.51 2k9a h MET 90 Cb 0.99 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.66 2k9a h MET 90 CO 0.43 0.00 -0.30 0.00 1.06 0.00 0.00 176.91 178.10 2k9a h ALA 91 N 1.89 -0.84 0.00 6.32 0.00 -2.00 -1.67 119.26 122.96 2k9a h ALA 91 Ca 0.09 -0.21 -0.11 0.00 0.00 0.00 0.00 54.91 54.69 2k9a h ALA 91 Cb 0.38 0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 2k9a h ALA 91 CO -0.00 -0.86 -0.51 0.00 0.00 0.00 0.00 179.25 177.88 2k9a h ALA 92 N -0.85 1.11 -0.28 0.00 0.00 -1.94 -2.82 119.26 114.48 2k9a h ALA 92 Ca -0.09 -0.46 -0.05 0.00 0.00 0.00 0.00 54.91 54.31 2k9a h ALA 92 Cb 0.69 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 2k9a h ALA 92 CO 0.14 0.64 -0.01 0.35 0.00 0.00 0.00 179.25 180.36 2k9a h PHE 93 N 0.00 0.55 0.01 0.00 3.57 -0.93 -2.04 116.94 118.10 2k9a h PHE 93 Ca -0.01 -0.10 -0.00 0.00 3.53 0.00 0.00 57.97 61.39 2k9a h PHE 93 Cb 0.93 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 39.53 2k9a h PHE 93 CO 0.00 0.66 -0.01 1.79 -2.23 0.00 0.00 178.31 178.52 2k9a h THR 94 N 0.28 1.21 -0.94 4.41 1.35 -1.27 0.14 112.91 118.09 2k9a h THR 94 Ca 0.08 -0.69 0.09 0.00 -0.55 0.00 0.00 66.41 65.34 2k9a h THR 94 Cb 0.45 1.68 -0.07 0.00 -1.73 0.00 0.00 68.15 68.47 2k9a h THR 94 CO 0.02 0.18 0.59 0.74 -0.25 0.00 0.00 175.52 176.79 2k9a h THR 95 N -0.31 0.99 0.00 6.82 2.02 -1.53 -0.92 112.91 119.97 2k9a h THR 95 Ca -0.00 -0.34 -0.17 0.00 0.77 0.00 0.00 66.41 66.67 2k9a h THR 95 Cb 0.30 -0.10 -0.02 0.00 -1.74 0.00 0.00 68.15 66.59 2k9a h THR 95 CO 0.00 0.18 -0.79 0.74 0.37 0.00 0.00 175.52 176.03 2k9a h THR 96 N 1.00 1.53 -0.29 3.16 2.02 -1.29 -3.27 112.91 115.77 2k9a h THR 96 Ca 0.44 -2.75 -0.04 0.00 0.77 0.00 0.00 66.41 64.83 2k9a h THR 96 Cb 0.31 2.50 -0.01 0.00 -1.74 0.00 0.00 68.15 69.21 2k9a h THR 96 CO -0.22 0.78 0.04 0.25 0.37 0.00 0.00 175.52 176.74 2k9a h LEU 97 N 0.00 0.47 -1.34 2.58 6.46 0.56 -0.47 115.31 123.57 2k9a h LEU 97 Ca -0.01 -0.27 0.17 0.00 -0.12 0.00 0.00 57.88 57.65 2k9a h LEU 97 Cb 1.43 -0.13 -0.07 0.00 -0.73 0.00 0.00 40.66 41.17 2k9a h LEU 97 CO 0.10 0.62 0.58 1.56 -0.62 0.00 0.00 178.44 180.68 2k9a h GLN 98 N 0.31 0.58 0.08 1.25 4.20 -1.31 0.48 115.11 120.71 2k9a h GLN 98 Ca 0.09 -0.04 -0.19 0.00 0.06 0.00 0.00 58.65 58.57 2k9a h GLN 98 Cb 0.35 -0.13 0.02 0.00 0.30 0.00 0.00 27.48 28.02 2k9a h GLN 98 CO 0.01 0.39 -0.80 1.25 -0.67 0.00 0.00 178.83 179.00 2k9a h HIS 99 N 0.60 0.64 0.00 2.96 2.76 -1.59 -3.18 115.15 117.35 2k9a h HIS 99 Ca 0.46 -0.41 0.00 0.00 -2.20 0.00 0.00 60.37 58.22 2k9a h HIS 99 Cb 0.88 -0.05 0.00 0.00 1.55 0.00 0.00 27.41 29.79 2k9a h HIS 99 CO -0.00 1.27 0.00 0.72 -1.30 0.00 0.00 177.93 178.62 2k9a n HIS 100 N -4.11 0.00 0.24 5.26 8.25 -0.21 -2.65 115.22 122.01 2k9a n HIS 100 Ca -0.12 0.00 0.10 0.00 -0.26 0.00 0.00 57.72 57.44 2k9a n HIS 100 Cb 0.79 -0.33 0.51 0.00 1.12 0.00 0.00 29.99 32.08 2k9a n HIS 100 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 2k9a n LYS 101 N -1.33 0.15 0.19 -0.41 4.81 0.16 -1.62 118.16 120.11 2k9a n LYS 101 Ca 0.07 0.54 0.14 0.00 -0.87 0.00 0.00 58.31 58.19 2k9a n LYS 101 Cb 0.15 -1.89 0.66 0.00 0.02 0.00 0.00 35.03 33.97 2k9a n LYS 101 CO 0.00 0.00 0.00 0.22 1.17 0.00 0.00 177.40 178.79 2k9a h ASP 102 N 0.00 0.00 0.00 3.14 1.82 -1.73 -3.25 116.42 116.40 2k9a h ASP 102 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 2k9a h ASP 102 Cb 0.13 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.14 2k9a h ASP 102 CO 0.00 0.00 -0.76 1.21 -1.61 0.00 0.00 179.24 178.08 2k9a n GLU 103 N -2.48 0.92 -1.88 0.28 2.13 -0.64 -5.07 120.64 113.91 2k9a n GLU 103 Ca -0.00 0.00 -0.37 0.00 0.66 0.00 0.00 57.16 57.45 2k9a n GLU 103 Cb 0.14 -0.88 0.04 0.00 0.27 0.00 0.00 31.44 31.01 2k9a n GLU 103 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 2k9a s VAL 104 N -1.76 2.31 -0.33 6.31 1.01 -0.69 -4.85 120.40 122.40 2k9a s VAL 104 Ca 0.00 0.21 -0.29 0.00 0.00 0.00 0.00 61.98 61.90 2k9a s VAL 104 Cb 0.00 -3.10 -0.07 0.00 0.00 0.00 0.00 36.38 33.21 2k9a s VAL 104 CO 0.00 -0.02 2.29 0.00 0.00 0.00 0.00 175.10 177.36 2k9a n ALA 105 N -1.30 1.38 0.20 5.51 0.00 -1.26 -4.81 120.51 120.22 2k9a n ALA 105 Ca 0.12 -0.40 0.05 0.00 0.00 0.00 0.00 53.44 53.21 2k9a n ALA 105 Cb 0.47 -2.92 0.49 0.00 0.00 0.00 0.00 19.45 17.49 2k9a n ALA 105 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2k9a h GLY 106 N 15.76 0.07 1.08 0.00 0.00 -1.88 -2.59 103.07 115.50 2k9a h GLY 106 Ca -0.33 -0.04 -0.02 0.00 0.00 0.00 0.00 47.33 46.94 2k9a h GLY 106 CO 1.03 0.03 0.45 -1.80 0.00 0.00 0.00 176.54 176.26 2k9a h ASP 107 N 0.06 1.08 -0.00 0.19 3.58 -1.99 0.99 116.42 120.33 2k9a h ASP 107 Ca 0.01 -0.10 -0.00 0.00 0.42 0.00 0.00 57.03 57.35 2k9a h ASP 107 Cb 0.28 -0.28 0.00 0.00 1.72 0.00 0.00 39.33 41.06 2k9a h ASP 107 CO 0.02 0.88 -0.02 0.40 -2.88 0.00 0.00 179.24 177.64 2k9a h ILE 108 N 1.20 1.56 0.00 2.25 1.08 -1.86 -3.26 117.51 118.48 2k9a h ILE 108 Ca 0.30 -1.67 -0.05 0.00 -0.39 0.00 0.00 64.86 63.06 2k9a h ILE 108 Cb 0.05 2.68 -0.01 0.00 -3.07 0.00 0.00 36.82 36.48 2k9a h ILE 108 CO -0.05 0.44 -0.22 0.15 -0.69 0.00 0.00 178.15 177.78 2k9a h PHE 109 N -0.68 0.00 -1.03 1.37 3.57 -1.46 -2.73 116.94 115.97 2k9a h PHE 109 Ca -0.00 0.00 0.30 0.00 3.53 0.00 0.00 57.97 61.80 2k9a h PHE 109 Cb 0.72 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 39.42 2k9a h PHE 109 CO 0.17 0.22 0.83 0.22 -2.23 0.00 0.00 178.31 177.52 2k9a h ASP 110 N 0.00 0.00 0.08 0.41 3.58 -0.84 0.52 116.42 120.18 2k9a h ASP 110 Ca -0.00 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.44 2k9a h ASP 110 Cb 0.43 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.48 2k9a h ASP 110 CO 0.03 0.00 -0.04 -0.03 -2.88 0.00 0.00 179.24 176.32 2k9a h MET 111 N 0.00 -0.10 0.00 0.28 4.05 -1.65 -3.17 114.93 114.34 2k9a h MET 111 Ca 0.49 0.01 -0.02 0.00 -0.28 0.00 0.00 59.70 59.90 2k9a h MET 111 Cb 2.14 0.02 -0.00 0.00 -0.80 0.00 0.00 31.60 32.96 2k9a h MET 111 CO -0.01 0.42 -0.09 -0.07 0.23 0.00 0.00 176.91 177.39 2k9a h LEU 112 N -0.72 0.00 -1.89 3.39 3.38 -0.66 -2.81 115.31 116.00 2k9a h LEU 112 Ca -0.01 0.00 0.20 0.00 0.09 0.00 0.00 57.88 58.16 2k9a h LEU 112 Cb 0.57 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.29 2k9a h LEU 112 CO 0.02 0.09 0.62 0.25 0.09 0.00 0.00 178.44 179.51 2k9a h LEU 113 N 0.00 0.00 0.00 1.67 5.85 -0.12 0.11 115.31 122.82 2k9a h LEU 113 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2k9a h LEU 113 Cb 0.38 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.41 2k9a h LEU 113 CO 0.01 0.00 0.01 0.35 -0.34 0.00 0.00 178.44 178.47 2k9a n THR 114 N -3.87 0.63 0.26 1.05 -2.24 -1.06 -1.79 114.28 107.26 2k9a n THR 114 Ca 0.14 0.17 0.13 0.00 -2.27 0.00 0.00 64.05 62.22 2k9a n THR 114 Cb 0.87 -1.17 0.73 0.00 -2.10 0.00 0.00 70.33 68.66 2k9a n THR 114 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 2k9a h PHE 115 N 0.00 0.00 0.00 4.78 0.04 -1.05 -3.36 116.94 117.35 2k9a h PHE 115 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 2k9a h PHE 115 Cb 0.03 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.18 2k9a h PHE 115 CO 0.00 0.11 0.00 -2.37 -0.60 0.00 0.00 178.31 175.45 2k9a n THR 116 N -3.66 0.00 -2.41 -1.55 5.66 -0.84 -4.96 114.28 106.52 2k9a n THR 116 Ca -0.02 0.00 -0.43 0.00 -3.05 0.00 0.00 64.05 60.55 2k9a n THR 116 Cb 0.23 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.01 2k9a n THR 116 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 2k9a n ASP 117 N -0.33 4.73 0.23 1.09 -0.08 -0.74 -4.75 116.55 116.70 2k9a n ASP 117 Ca 0.00 -2.91 0.13 0.00 -1.51 0.00 0.00 54.79 50.50 2k9a n ASP 117 Cb 0.00 -1.71 0.76 0.00 2.34 0.00 0.00 41.12 42.52 2k9a n ASP 117 CO 0.00 0.00 0.00 0.15 0.12 0.00 0.00 177.20 177.47 2k9a h PHE 118 N 7.12 0.00 -0.67 -0.67 3.57 -1.87 -1.53 116.94 122.89 2k9a h PHE 118 Ca 0.46 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.94 2k9a h PHE 118 Cb 0.81 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.52 2k9a h PHE 118 CO 1.40 0.00 0.32 -0.07 -2.23 0.00 0.00 178.31 177.73 2k9a h LEU 119 N 0.00 0.87 -0.57 0.59 -0.00 -1.97 -1.98 115.31 112.24 2k9a h LEU 119 Ca 0.04 -0.13 -0.11 0.00 -0.00 0.00 0.00 57.88 57.68 2k9a h LEU 119 Cb 0.20 -0.22 -0.02 0.00 -0.00 0.00 0.00 40.66 40.62 2k9a h LEU 119 CO -0.00 0.76 -0.53 0.00 -0.00 0.00 0.00 178.44 178.67 2k9a h ALA 120 N 1.15 0.83 0.32 1.53 0.00 -1.70 -2.74 119.26 118.65 2k9a h ALA 120 Ca 0.23 -0.48 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 2k9a h ALA 120 Cb 0.12 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2k9a h ALA 120 CO -0.03 0.66 -0.16 0.35 0.00 0.00 0.00 179.25 180.08 2k9a h PHE 121 N 0.00 -0.40 0.14 0.00 3.57 -0.92 -0.12 116.94 119.21 2k9a h PHE 121 Ca -0.01 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.48 2k9a h PHE 121 Cb 1.16 0.13 0.00 0.00 2.79 0.00 0.00 35.95 40.03 2k9a h PHE 121 CO 0.00 -0.12 -0.07 -0.22 -2.23 0.00 0.00 178.31 175.67 2k9a h LYS 122 N -0.64 -0.19 -0.21 1.11 3.64 -1.43 -2.30 116.57 116.55 2k9a h LYS 122 Ca -0.04 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.41 2k9a h LYS 122 Cb 0.46 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.31 2k9a h LYS 122 CO 0.07 -0.07 0.16 0.93 -2.27 0.00 0.00 179.45 178.27 2k9a h GLU 123 N -0.25 0.00 -0.19 1.90 4.39 -1.52 -1.68 114.58 117.23 2k9a h GLU 123 Ca -0.02 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.67 2k9a h GLU 123 Cb 0.20 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.84 2k9a h GLU 123 CO 0.03 0.00 0.06 1.98 -1.16 0.00 0.00 179.01 179.93 2k9a h MET 124 N 0.00 0.29 -0.53 2.33 4.05 -0.44 -1.77 114.93 118.86 2k9a h MET 124 Ca 0.10 -0.06 -0.03 0.00 -0.28 0.00 0.00 59.70 59.43 2k9a h MET 124 Cb 0.42 -0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 31.16 2k9a h MET 124 CO -0.00 0.38 0.20 0.74 0.23 0.00 0.00 176.91 178.46 2k9a h PHE 125 N 0.14 0.81 -0.06 1.39 0.04 -1.07 -1.42 116.94 116.77 2k9a h PHE 125 Ca 0.06 -0.07 -0.01 0.00 2.80 0.00 0.00 57.97 60.76 2k9a h PHE 125 Cb 0.21 -0.24 -0.00 0.00 2.20 0.00 0.00 35.95 38.11 2k9a h PHE 125 CO -0.00 0.67 -0.01 -0.07 -0.60 0.00 0.00 178.31 178.30 2k9a h LEU 126 N 0.72 0.07 -0.01 1.54 4.07 -1.32 -0.41 115.31 119.98 2k9a h LEU 126 Ca 0.18 -0.00 -0.05 0.00 0.08 0.00 0.00 57.88 58.08 2k9a h LEU 126 Cb 0.21 -0.02 0.00 0.00 1.08 0.00 0.00 40.66 41.94 2k9a h LEU 126 CO -0.01 0.10 -0.20 -0.78 -1.08 0.00 0.00 178.44 176.47 2k9a h ASP 127 N 0.08 0.18 -0.32 -0.43 1.82 -0.83 -2.43 116.42 114.49 2k9a h ASP 127 Ca 0.02 -0.76 -0.01 0.00 -0.39 0.00 0.00 57.03 55.89 2k9a h ASP 127 Cb 0.08 -0.06 -0.02 0.00 0.68 0.00 0.00 39.33 40.02 2k9a h ASP 127 CO 0.00 0.92 0.18 0.22 -1.61 0.00 0.00 179.24 178.96 2k9a h TYR 128 N -0.54 0.44 -0.26 0.28 3.20 -0.95 -2.28 116.97 116.88 2k9a h TYR 128 Ca -0.02 0.00 -0.11 0.00 3.14 0.00 0.00 58.73 61.74 2k9a h TYR 128 Cb 0.95 -0.15 -0.00 0.00 1.54 0.00 0.00 36.73 39.07 2k9a h TYR 128 CO 0.18 0.32 -0.27 -0.09 -1.64 0.00 0.00 178.16 176.66 2k9a h ARG 129 N 0.47 0.63 -0.37 1.82 2.43 -1.11 -2.95 114.38 115.30 2k9a h ARG 129 Ca 0.12 -0.34 0.02 0.00 -0.81 0.00 0.00 59.98 58.97 2k9a h ARG 129 Cb 0.02 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.56 2k9a h ARG 129 CO -0.02 0.94 0.24 0.00 -1.51 0.00 0.00 179.97 179.63 2k9a h ALA 130 N 0.68 1.82 -0.17 2.80 0.00 -0.91 -1.02 119.26 122.46 2k9a h ALA 130 Ca 0.04 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.82 2k9a h ALA 130 Cb 0.84 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 2k9a h ALA 130 CO 0.07 0.15 -0.37 1.49 0.00 0.00 0.00 179.25 180.59 2k9a h GLU 131 N 0.43 0.37 0.00 0.00 4.81 -1.32 -2.60 114.58 116.27 2k9a h GLU 131 Ca 0.14 -0.17 -0.05 0.00 -0.13 0.00 0.00 59.36 59.15 2k9a h GLU 131 Cb 0.05 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 2k9a h GLU 131 CO -0.03 0.69 -0.25 0.87 -0.73 0.00 0.00 179.01 179.55 2k9a h LYS 132 N 0.31 0.00 -0.00 1.92 1.79 -1.03 -2.23 116.57 117.33 2k9a h LYS 132 Ca 0.03 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.50 2k9a h LYS 132 Cb 0.79 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.44 2k9a h LYS 132 CO 0.06 0.25 -0.34 0.39 -1.08 0.00 0.00 179.45 178.74 2k9a n GLU 133 N -3.62 0.52 0.00 3.15 1.02 -1.01 -4.99 120.64 115.70 2k9a n GLU 133 Ca -0.01 -0.29 0.00 0.00 -0.02 0.00 0.00 57.16 56.84 2k9a n GLU 133 Cb 0.39 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.31 2k9a n GLU 133 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2k9a n GLY 134 N 1.40 0.89 3.75 0.62 0.00 -0.84 -5.04 105.19 105.97 2k9a n GLY 134 Ca 0.10 -0.90 -0.41 0.00 0.00 0.00 0.00 46.02 44.80 2k9a n GLY 134 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k9a s ARG 135 N -0.81 4.16 0.00 1.61 0.52 -1.25 -4.86 118.95 118.32 2k9a s ARG 135 Ca 0.00 2.51 0.00 0.00 -0.52 0.00 0.00 55.73 57.72 2k9a s ARG 135 Cb 0.00 -3.05 0.00 0.00 0.52 0.00 0.00 34.95 32.42 2k9a s ARG 135 CO 0.00 -0.58 0.00 0.41 0.02 0.00 0.00 175.30 175.15