#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 0.00 -4.75 7.83 5.75 -1.26 -4.68 116.55 119.44 2k9a n ASP 2 Ca 0.00 -0.86 -0.36 0.00 -0.01 0.00 0.00 54.79 53.56 2k9a n ASP 2 Cb 0.00 0.00 0.04 0.00 -1.03 0.00 0.00 41.12 40.13 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 0.00 2.50 0.85 2.12 0.00 -1.26 -4.98 121.76 120.99 2k9a s ALA 3 Ca 0.00 1.01 -0.11 0.00 0.00 0.00 0.00 51.96 52.86 2k9a s ALA 3 Cb 0.00 -3.46 0.10 0.00 0.00 0.00 0.00 23.12 19.77 2k9a s ALA 3 CO 0.00 -1.25 1.15 -0.51 0.00 0.00 0.00 175.76 175.15 2k9a s LEU 4 N -4.18 2.99 0.00 0.00 1.02 -1.26 -3.93 118.68 113.31 2k9a s LEU 4 Ca 0.77 2.15 0.00 0.00 0.02 0.00 0.00 54.13 57.07 2k9a s LEU 4 Cb -0.31 -4.56 0.00 0.00 0.02 0.00 0.00 46.19 41.34 2k9a s LEU 4 CO 0.34 -2.70 0.00 1.21 0.02 0.00 0.00 176.35 175.22 2k9a n GLU 5 N -3.77 0.00 -2.62 1.70 2.13 -1.26 -4.55 120.64 112.27 2k9a n GLU 5 Ca 0.12 0.00 -0.41 0.00 0.66 0.00 0.00 57.16 57.52 2k9a n GLU 5 Cb 0.52 0.00 -0.03 0.00 0.27 0.00 0.00 31.44 32.20 2k9a n GLU 5 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 2k9a s GLY 6 N 0.00 1.12 0.09 8.31 0.00 -1.26 -4.96 107.32 110.63 2k9a s GLY 6 Ca 0.00 -1.77 0.01 0.00 0.00 0.00 0.00 44.72 42.96 2k9a s GLY 6 CO 0.00 2.53 0.02 -1.84 0.00 0.00 0.00 173.10 173.81 2k9a n GLU 7 N 8.81 1.17 -2.54 2.90 0.28 -1.25 -4.32 120.64 125.69 2k9a n GLU 7 Ca 0.11 -0.76 -0.43 0.00 -0.16 0.00 0.00 57.16 55.93 2k9a n GLU 7 Cb 0.49 0.34 -0.02 0.00 1.43 0.00 0.00 31.44 33.67 2k9a n GLU 7 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 177.13 175.43 2k9a s SER 8 N -1.56 7.07 0.07 -1.84 1.04 -1.26 -4.98 113.70 112.25 2k9a s SER 8 Ca 0.03 1.62 -0.31 0.00 0.48 0.00 0.00 55.95 57.77 2k9a s SER 8 Cb 0.00 -2.55 -0.09 0.00 0.10 0.00 0.00 66.02 63.49 2k9a s SER 8 CO 0.02 -0.63 1.74 -0.36 0.98 0.00 0.00 173.24 174.99 2k9a s PHE 9 N 2.79 2.19 0.50 5.02 0.08 -1.26 -4.98 117.98 122.33 2k9a s PHE 9 Ca 0.51 0.13 -0.15 0.00 0.12 0.00 0.00 56.93 57.54 2k9a s PHE 9 Cb -0.20 -4.05 -0.07 0.00 -0.57 0.00 0.00 43.02 38.12 2k9a s PHE 9 CO 0.15 -4.33 0.95 0.00 -0.10 0.00 0.00 175.22 171.89 2k9a s ALA 10 N 2.96 3.12 -0.23 5.36 0.00 -1.26 -5.08 121.76 126.63 2k9a s ALA 10 Ca 0.77 0.10 -0.09 0.00 0.00 0.00 0.00 51.96 52.74 2k9a s ALA 10 Cb -0.41 -3.04 0.09 0.00 0.00 0.00 0.00 23.12 19.76 2k9a s ALA 10 CO 0.34 -0.23 0.52 -1.17 0.00 0.00 0.00 175.76 175.22 2k9a s LEU 11 N -4.11 -0.73 0.02 0.00 2.96 -1.26 -5.16 118.68 110.40 2k9a s LEU 11 Ca 0.57 1.21 0.01 0.00 -0.22 0.00 0.00 54.13 55.70 2k9a s LEU 11 Cb -0.10 1.75 -0.01 0.00 0.50 0.00 0.00 46.19 48.33 2k9a s LEU 11 CO 0.33 -0.22 -0.05 -0.55 -1.32 0.00 0.00 176.35 174.53 2k9a s SER 12 N 2.35 0.59 0.27 3.68 0.15 -1.26 -5.16 113.70 114.32 2k9a s SER 12 Ca -0.05 -0.35 0.10 0.00 0.70 0.00 0.00 55.95 56.34 2k9a s SER 12 Cb -0.10 0.01 -0.05 0.00 -1.71 0.00 0.00 66.02 64.16 2k9a s SER 12 CO -0.15 -0.12 -0.14 -0.36 1.20 0.00 0.00 173.24 173.66 2k9a s PHE 13 N -0.88 2.11 0.44 3.44 0.08 -1.26 -5.16 117.98 116.75 2k9a s PHE 13 Ca -0.06 -0.48 0.06 0.00 0.12 0.00 0.00 56.93 56.56 2k9a s PHE 13 Cb -0.07 -1.03 -0.05 0.00 -0.57 0.00 0.00 43.02 41.30 2k9a s PHE 13 CO -0.00 0.53 0.09 -1.54 -0.10 0.00 0.00 175.22 174.20 2k9a s SER 14 N -3.47 4.16 0.00 1.36 1.04 -1.26 -5.02 113.70 110.51 2k9a s SER 14 Ca 0.28 -1.32 0.00 0.00 0.48 0.00 0.00 55.95 55.39 2k9a s SER 14 Cb -0.01 -0.19 0.00 0.00 0.10 0.00 0.00 66.02 65.92 2k9a s SER 14 CO 0.13 -0.60 0.00 -0.24 0.98 0.00 0.00 173.24 173.50 2k9a n SER 15 N -1.17 0.00 0.32 7.02 2.88 -1.26 -4.92 113.62 116.50 2k9a n SER 15 Ca -0.06 -0.20 0.21 0.00 -1.33 0.00 0.00 58.87 57.49 2k9a n SER 15 Cb 0.66 0.00 1.09 0.00 -0.75 0.00 0.00 64.21 65.21 2k9a n SER 15 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2k9a h ALA 16 N 2.00 1.03 -0.46 -1.46 0.00 -1.98 -0.55 119.26 117.84 2k9a h ALA 16 Ca 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2k9a h ALA 16 Cb 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2k9a h ALA 16 CO 0.00 0.00 0.01 0.45 0.00 0.00 0.00 179.25 179.71 2k9a n SER 17 N -3.12 4.97 -0.53 0.00 2.88 -1.26 -4.55 113.62 112.01 2k9a n SER 17 Ca -0.02 -2.99 0.00 0.00 -1.33 0.00 0.00 58.87 54.53 2k9a n SER 17 Cb 0.12 -0.64 0.00 0.00 -0.75 0.00 0.00 64.21 62.95 2k9a n SER 17 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2k9a n ASP 18 N 0.13 0.29 0.30 -3.46 9.92 -0.26 -5.02 116.55 118.45 2k9a n ASP 18 Ca 0.26 -0.46 0.16 0.00 -0.53 0.00 0.00 54.79 54.22 2k9a n ASP 18 Cb 1.09 0.00 0.94 0.00 -0.64 0.00 0.00 41.12 42.51 2k9a n ASP 18 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2k9a h ALA 19 N 1.00 1.33 -0.17 2.24 0.00 -1.94 -2.82 119.26 118.90 2k9a h ALA 19 Ca 0.00 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 54.92 2k9a h ALA 19 Cb 0.00 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2k9a h ALA 19 CO 0.00 0.03 -0.05 1.49 0.00 0.00 0.00 179.25 180.72 2k9a h GLU 20 N 0.00 -0.02 -0.93 0.00 4.81 -1.91 -1.07 114.58 115.46 2k9a h GLU 20 Ca -0.00 0.00 0.08 0.00 -0.13 0.00 0.00 59.36 59.31 2k9a h GLU 20 Cb 0.10 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.41 2k9a h GLU 20 CO 0.00 -0.01 0.60 0.35 -0.73 0.00 0.00 179.01 179.22 2k9a h PHE 21 N -0.02 1.06 -0.59 0.92 3.04 -1.16 -1.03 116.94 119.15 2k9a h PHE 21 Ca 0.09 0.03 -0.05 0.00 3.98 0.00 0.00 57.97 62.01 2k9a h PHE 21 Cb 0.15 -0.34 -0.03 0.00 2.56 0.00 0.00 35.95 38.29 2k9a h PHE 21 CO -0.21 0.52 0.16 0.22 -2.02 0.00 0.00 178.31 176.99 2k9a h ASP 22 N 1.01 0.85 -0.40 0.41 3.58 -1.39 -2.58 116.42 117.90 2k9a h ASP 22 Ca 0.41 -0.15 -0.00 0.00 0.42 0.00 0.00 57.03 57.71 2k9a h ASP 22 Cb 0.28 -0.22 -0.02 0.00 1.72 0.00 0.00 39.33 41.09 2k9a h ASP 22 CO -0.17 0.82 0.24 0.00 -2.88 0.00 0.00 179.24 177.25 2k9a h ALA 23 N 1.30 0.50 -0.87 -0.78 0.00 0.02 -2.28 119.26 117.16 2k9a h ALA 23 Ca 0.19 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2k9a h ALA 23 Cb 0.29 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.88 2k9a h ALA 23 CO -0.00 -0.01 0.55 0.28 0.00 0.00 0.00 179.25 180.07 2k9a h VAL 24 N 0.52 1.23 -0.73 0.00 2.07 -1.25 -2.39 116.25 115.71 2k9a h VAL 24 Ca 0.14 -0.48 0.03 0.00 0.82 0.00 0.00 66.70 67.22 2k9a h VAL 24 Cb -0.00 -0.02 -0.05 0.00 -1.52 0.00 0.00 31.29 29.70 2k9a h VAL 24 CO -0.03 0.24 0.46 0.58 0.02 0.00 0.00 177.57 178.84 2k9a h VAL 25 N 1.19 1.10 -0.89 2.57 2.07 -1.08 -1.93 116.25 119.28 2k9a h VAL 25 Ca 0.32 -0.31 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 2k9a h VAL 25 Cb -0.09 0.12 -0.04 0.00 -1.52 0.00 0.00 31.29 29.76 2k9a h VAL 25 CO -0.06 0.16 0.54 1.23 0.02 0.00 0.00 177.57 179.46 2k9a h GLY 26 N 0.90 1.29 1.52 2.17 0.00 -0.93 -2.01 103.07 106.02 2k9a h GLY 26 Ca 0.29 -0.54 -0.05 0.00 0.00 0.00 0.00 47.33 47.04 2k9a h GLY 26 CO -0.11 0.52 0.03 -0.97 0.00 0.00 0.00 176.54 176.01 2k9a h TYR 27 N 1.23 0.62 -0.27 5.60 0.05 -1.05 -2.72 116.97 120.43 2k9a h TYR 27 Ca 0.32 -0.06 -0.04 0.00 0.05 0.00 0.00 58.73 59.00 2k9a h TYR 27 Cb -0.05 -0.18 -0.01 0.00 1.01 0.00 0.00 36.73 37.50 2k9a h TYR 27 CO 0.00 0.58 0.02 -0.07 -1.05 0.00 0.00 178.16 177.64 2k9a h LEU 28 N 0.57 0.44 -0.68 3.88 3.38 -0.69 -2.84 115.31 119.39 2k9a h LEU 28 Ca 0.12 -0.29 0.07 0.00 0.09 0.00 0.00 57.88 57.88 2k9a h LEU 28 Cb 0.33 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 40.90 2k9a h LEU 28 CO 0.01 0.62 0.36 -0.33 0.09 0.00 0.00 178.44 179.19 2k9a h GLU 29 N 0.25 0.64 -0.44 1.13 5.08 -1.15 -0.34 114.58 119.75 2k9a h GLU 29 Ca 0.08 -0.04 0.02 0.00 -1.00 0.00 0.00 59.36 58.42 2k9a h GLU 29 Cb 0.38 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 2k9a h GLU 29 CO 0.01 0.42 0.29 0.22 -1.00 0.00 0.00 179.01 178.95 2k9a h ASP 30 N 0.66 0.43 0.39 1.42 3.58 -1.37 -1.31 116.42 120.22 2k9a h ASP 30 Ca 0.31 -0.01 -0.17 0.00 0.42 0.00 0.00 57.03 57.58 2k9a h ASP 30 Cb 0.24 -0.10 -0.01 0.00 1.72 0.00 0.00 39.33 41.18 2k9a h ASP 30 CO -0.21 0.30 -0.72 0.40 -2.88 0.00 0.00 179.24 176.13 2k9a h ILE 31 N 0.50 1.41 -0.77 2.25 2.04 -0.87 -2.40 117.51 119.68 2k9a h ILE 31 Ca 0.17 -2.21 -0.02 0.00 1.00 0.00 0.00 64.86 63.80 2k9a h ILE 31 Cb 0.07 2.17 -0.04 0.00 -0.74 0.00 0.00 36.82 38.28 2k9a h ILE 31 CO -0.04 0.65 0.39 0.40 0.00 0.00 0.00 178.15 179.55 2k9a h ILE 32 N 0.19 1.24 -0.51 -0.67 2.04 -0.08 -1.93 117.51 117.79 2k9a h ILE 32 Ca -0.02 -0.64 0.00 0.00 1.00 0.00 0.00 64.86 65.19 2k9a h ILE 32 Cb 1.28 0.25 0.00 0.00 -0.74 0.00 0.00 36.82 37.61 2k9a h ILE 32 CO 0.11 0.28 0.00 0.23 0.00 0.00 0.00 178.15 178.77 2k9a n MET 33 N -4.40 2.61 -2.40 2.37 2.81 -1.02 -4.69 117.12 112.39 2k9a n MET 33 Ca 0.07 -2.02 -0.41 0.00 -1.81 0.00 0.00 57.70 53.53 2k9a n MET 33 Cb 0.12 -1.56 -0.04 0.00 -0.71 0.00 0.00 33.22 31.03 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 -0.90 7.13 0.16 7.83 -1.08 -0.73 -4.95 116.67 124.14 2k9a s ASP 34 Ca 0.37 2.23 -0.15 0.00 -0.52 0.00 0.00 52.55 54.48 2k9a s ASP 34 Cb 0.21 -2.61 0.08 0.00 -1.46 0.00 0.00 42.92 39.15 2k9a s ASP 34 CO 0.22 -0.32 1.77 -2.24 0.52 0.00 0.00 175.17 175.12 2k9a h ASP 35 N 4.99 0.26 0.19 -0.34 2.03 -1.90 -1.13 116.42 120.52 2k9a h ASP 35 Ca -0.45 0.03 -0.02 0.00 -0.73 0.00 0.00 57.03 55.86 2k9a h ASP 35 Cb 1.21 -0.02 -0.00 0.00 -0.83 0.00 0.00 39.33 39.69 2k9a h ASP 35 CO 0.73 0.19 -0.11 -0.33 -1.03 0.00 0.00 179.24 178.69 2k9a h GLU 36 N 0.39 0.00 0.05 4.15 4.39 -1.93 -2.25 114.58 119.38 2k9a h GLU 36 Ca 0.18 0.00 -0.24 0.00 0.34 0.00 0.00 59.36 59.64 2k9a h GLU 36 Cb 0.11 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 28.78 2k9a h GLU 36 CO -0.14 0.11 -0.97 0.35 -1.16 0.00 0.00 179.01 177.20 2k9a h PHE 37 N 0.00 0.87 -0.36 4.33 3.57 -1.52 -2.43 116.94 121.41 2k9a h PHE 37 Ca -0.00 -0.51 -0.04 0.00 3.53 0.00 0.00 57.97 60.95 2k9a h PHE 37 Cb 0.23 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.87 2k9a h PHE 37 CO 0.00 1.35 0.07 1.96 -2.23 0.00 0.00 178.31 179.46 2k9a h GLN 38 N 0.15 0.59 -0.37 1.11 4.20 -0.90 0.17 115.11 120.06 2k9a h GLN 38 Ca -0.14 -0.15 -0.07 0.00 0.06 0.00 0.00 58.65 58.35 2k9a h GLN 38 Cb 1.66 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 29.35 2k9a h GLN 38 CO 0.19 0.65 -0.05 1.25 -0.67 0.00 0.00 178.83 180.20 2k9a h LEU 39 N 0.44 0.69 -0.64 1.46 6.46 -1.52 -2.61 115.31 119.59 2k9a h LEU 39 Ca 0.11 -0.34 -0.11 0.00 -0.12 0.00 0.00 57.88 57.42 2k9a h LEU 39 Cb 0.34 -0.19 -0.02 0.00 -0.73 0.00 0.00 40.66 40.06 2k9a h LEU 39 CO 0.00 0.87 -0.14 0.25 -0.62 0.00 0.00 178.44 178.81 2k9a h LEU 40 N 0.50 0.93 0.09 2.25 6.46 -1.38 -1.23 115.31 122.93 2k9a h LEU 40 Ca 0.10 -0.31 -0.00 0.00 -0.12 0.00 0.00 57.88 57.55 2k9a h LEU 40 Cb 0.55 -0.25 0.00 0.00 -0.73 0.00 0.00 40.66 40.23 2k9a h LEU 40 CO 0.03 1.06 -0.04 -0.61 -0.62 0.00 0.00 178.44 178.25 2k9a h GLN 41 N 0.82 -0.12 -0.12 1.25 4.15 -0.91 -2.49 115.11 117.70 2k9a h GLN 41 Ca 0.13 0.01 -0.10 0.00 0.77 0.00 0.00 58.65 59.45 2k9a h GLN 41 Cb 0.67 0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.38 2k9a h GLN 41 CO 0.05 0.03 -0.39 -0.09 -1.93 0.00 0.00 178.83 176.50 2k9a h ARG 42 N -0.25 0.25 -0.19 1.69 2.43 -1.47 -1.01 114.38 115.84 2k9a h ARG 42 Ca -0.01 -0.11 -0.00 0.00 -0.81 0.00 0.00 59.98 59.04 2k9a h ARG 42 Cb 0.21 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.74 2k9a h ARG 42 CO 0.02 0.61 0.11 -0.97 -1.51 0.00 0.00 179.97 178.22 2k9a h ASN 43 N 0.21 0.23 0.06 -3.80 -1.24 -1.07 -0.97 115.58 109.00 2k9a h ASN 43 Ca 0.02 -0.07 -0.10 0.00 0.71 0.00 0.00 56.30 56.85 2k9a h ASN 43 Cb 0.79 -0.06 0.01 0.00 0.73 0.00 0.00 38.32 39.79 2k9a h ASN 43 CO 0.06 0.24 -0.45 -0.26 -1.29 0.00 0.00 177.43 175.73 2k9a h PHE 44 N 0.20 0.34 -0.09 0.67 -1.00 -1.42 -3.27 116.94 112.36 2k9a h PHE 44 Ca 0.07 -0.23 0.03 0.00 2.81 0.00 0.00 57.97 60.65 2k9a h PHE 44 Cb 0.06 -0.02 -0.00 0.00 3.61 0.00 0.00 35.95 39.59 2k9a h PHE 44 CO -0.04 1.13 0.12 0.52 -1.61 0.00 0.00 178.31 178.43 2k9a h MET 45 N -0.55 0.00 -0.09 1.51 2.86 -1.22 -0.44 114.93 116.99 2k9a h MET 45 Ca -0.07 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.55 2k9a h MET 45 Cb 1.30 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.95 2k9a h MET 45 CO 0.08 0.00 -0.04 0.22 1.06 0.00 0.00 176.91 178.23 2k9a h ASP 46 N 0.00 0.12 0.11 1.22 3.58 -1.22 -2.22 116.42 118.01 2k9a h ASP 46 Ca 0.04 -0.01 -0.37 0.00 0.42 0.00 0.00 57.03 57.12 2k9a h ASP 46 Cb 0.28 -0.03 -0.04 0.00 1.72 0.00 0.00 39.33 41.25 2k9a h ASP 46 CO -0.00 0.18 -2.17 0.29 -2.88 0.00 0.00 179.24 174.66 2k9a n LYS 47 N -4.41 0.70 0.08 0.28 4.76 -0.25 -4.19 118.16 115.13 2k9a n LYS 47 Ca -0.01 0.20 -0.12 0.00 -2.87 0.00 0.00 58.31 55.51 2k9a n LYS 47 Cb 0.17 -1.63 -0.05 0.00 -1.84 0.00 0.00 35.03 31.67 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 0.03 -0.36 0.00 2.13 -1.99 -1.24 -1.48 116.97 114.06 2k9a h TYR 48 Ca -0.47 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.26 2k9a h TYR 48 Cb 2.01 0.15 0.00 0.00 2.00 0.00 0.00 36.73 40.89 2k9a h TYR 48 CO 0.04 -0.21 0.00 2.48 -0.00 0.00 0.00 178.16 180.47 2k9a n TYR 49 N -5.27 0.79 0.08 4.88 4.11 -0.85 -1.31 117.16 119.60 2k9a n TYR 49 Ca -0.06 0.37 -0.22 0.00 -0.00 0.00 0.00 57.90 57.99 2k9a n TYR 49 Cb 0.19 -1.10 -0.15 0.00 -0.00 0.00 0.00 39.34 38.28 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 0.60 -0.04 -3.48 3.38 -1.45 -3.35 115.31 110.97 2k9a h LEU 50 Ca 0.00 -0.93 -0.24 0.00 0.09 0.00 0.00 57.88 56.80 2k9a h LEU 50 Cb 0.14 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.69 2k9a h LEU 50 CO 0.00 1.57 -1.08 -0.33 0.09 0.00 0.00 178.44 178.69 2k9a h GLU 51 N -0.15 0.30 -5.87 1.13 5.08 -1.00 -3.40 114.58 110.67 2k9a h GLU 51 Ca -0.22 -0.41 -0.46 0.00 -1.00 0.00 0.00 59.36 57.27 2k9a h GLU 51 Cb 1.88 0.14 -0.07 0.00 0.50 0.00 0.00 28.75 31.19 2k9a h GLU 51 CO 0.19 1.14 1.22 -0.06 -1.00 0.00 0.00 179.01 180.49 2k9a s PHE 52 N -2.95 2.21 0.07 4.33 0.40 -0.43 -4.96 117.98 116.66 2k9a s PHE 52 Ca -0.04 -0.21 0.01 0.00 -0.60 0.00 0.00 56.93 56.09 2k9a s PHE 52 Cb 0.08 -4.38 -0.04 0.00 0.51 0.00 0.00 43.02 39.19 2k9a s PHE 52 CO 0.87 -1.79 0.18 -1.21 0.70 0.00 0.00 175.22 173.97 2k9a s GLU 53 N 5.85 3.29 -0.79 0.44 2.02 -1.26 -4.86 118.70 123.39 2k9a s GLU 53 Ca 0.58 -0.52 -0.25 0.00 0.02 0.00 0.00 54.97 54.80 2k9a s GLU 53 Cb -0.02 -2.95 -0.01 0.00 0.10 0.00 0.00 34.13 31.25 2k9a s GLU 53 CO -0.03 0.59 1.69 0.34 0.02 0.00 0.00 175.26 177.88 2k9a s ASP 54 N -2.51 5.63 0.09 -0.19 2.15 -1.26 -4.93 116.67 115.65 2k9a s ASP 54 Ca 0.33 -0.41 -0.01 0.00 0.43 0.00 0.00 52.55 52.90 2k9a s ASP 54 Cb -0.13 -2.55 -0.04 0.00 -0.30 0.00 0.00 42.92 39.90 2k9a s ASP 54 CO 0.26 -2.22 0.00 0.42 -0.17 0.00 0.00 175.17 173.47 2k9a s THR 55 N 7.95 0.26 -2.65 1.71 -4.23 -1.26 -5.04 115.64 112.38 2k9a s THR 55 Ca 0.58 -1.87 0.24 0.00 -1.18 0.00 0.00 61.69 59.46 2k9a s THR 55 Cb -0.08 -1.77 0.37 0.00 1.34 0.00 0.00 72.50 72.36 2k9a s THR 55 CO 0.09 -0.75 1.46 -1.84 -0.54 0.00 0.00 174.62 173.03 2k9a n GLU 56 N -0.01 2.11 -3.26 3.99 0.28 -1.26 -4.93 120.64 117.56 2k9a n GLU 56 Ca -0.10 -1.64 -0.30 0.00 -0.16 0.00 0.00 57.16 54.96 2k9a n GLU 56 Cb 0.62 -1.47 -0.04 0.00 1.43 0.00 0.00 31.44 31.99 2k9a n GLU 56 CO 0.00 0.00 0.00 -1.21 -0.16 0.00 0.00 177.13 175.76 2k9a s GLU 57 N -1.86 3.71 -0.42 3.44 2.02 -1.26 -5.06 118.70 119.28 2k9a s GLU 57 Ca 0.34 0.18 -0.14 0.00 0.02 0.00 0.00 54.97 55.37 2k9a s GLU 57 Cb 0.20 -2.59 0.04 0.00 0.10 0.00 0.00 34.13 31.88 2k9a s GLU 57 CO 0.31 0.19 0.30 1.21 0.02 0.00 0.00 175.26 177.29 2k9a s ASN 58 N -2.93 6.00 -0.08 -0.19 2.47 -1.26 -5.07 114.94 113.89 2k9a s ASN 58 Ca 0.46 -1.09 -0.17 0.00 0.42 0.00 0.00 52.86 52.49 2k9a s ASN 58 Cb -0.11 -2.12 -0.05 0.00 -1.45 0.00 0.00 41.25 37.52 2k9a s ASN 58 CO 0.28 -0.50 0.44 -0.54 -3.72 0.00 0.00 177.10 173.06 2k9a s LYS 59 N 1.62 4.21 0.00 0.43 1.02 -1.26 -4.96 119.74 120.80 2k9a s LYS 59 Ca 0.04 0.42 0.22 0.00 0.02 0.00 0.00 55.97 56.67 2k9a s LYS 59 Cb -0.21 -3.36 1.00 0.00 -0.52 0.00 0.00 37.83 34.74 2k9a s LYS 59 CO 0.08 0.34 1.72 1.28 -0.92 0.00 0.00 175.35 177.85 2k9a n LEU 60 N 3.03 0.00 0.23 3.17 4.77 -1.26 -2.85 117.00 124.08 2k9a n LEU 60 Ca -0.10 0.45 0.15 0.00 -0.03 0.00 0.00 56.01 56.48 2k9a n LEU 60 Cb 0.52 -0.45 0.56 0.00 -2.33 0.00 0.00 43.42 41.72 2k9a n LEU 60 CO 0.41 -0.11 0.93 -0.29 -1.33 0.00 0.00 177.39 177.01 2k9a h ILE 61 N 0.00 0.00 0.00 -0.08 6.09 -2.03 -2.69 117.51 118.81 2k9a h ILE 61 Ca 0.00 -0.50 0.00 0.00 -1.37 0.00 0.00 64.86 62.99 2k9a h ILE 61 Cb 0.34 1.44 0.00 0.00 0.47 0.00 0.00 36.82 39.07 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 0.11 2.19 0.05 -1.96 -2.88 116.97 114.49 2k9a h TYR 62 Ca 0.00 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.77 2k9a h TYR 62 Cb 0.55 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.29 2k9a h TYR 62 CO 0.00 0.00 -0.05 1.15 -1.05 0.00 0.00 178.16 178.21 2k9a h THR 63 N 0.00 1.09 -0.53 -2.88 2.02 -1.70 -2.34 112.91 108.57 2k9a h THR 63 Ca 0.00 -1.20 -0.09 0.00 0.77 0.00 0.00 66.41 65.88 2k9a h THR 63 Cb 0.56 1.80 -0.02 0.00 -1.74 0.00 0.00 68.15 68.76 2k9a h THR 63 CO 0.00 0.27 -0.02 1.55 0.37 0.00 0.00 175.52 177.69 2k9a h PRO 64 N -0.75 0.95 -0.98 6.66 0.13 -1.72 -2.65 132.00 133.65 2k9a h PRO 64 Ca -0.01 -0.31 0.01 0.00 -0.87 0.00 0.00 66.00 64.81 2k9a h PRO 64 Cb 0.55 -0.08 -0.05 0.00 0.13 0.00 0.00 31.00 31.56 2k9a h PRO 64 CO 0.02 0.98 0.64 0.82 -0.23 0.00 0.00 178.00 180.23 2k9a h ILE 65 N 0.83 1.26 -0.26 -3.56 2.04 -1.61 -1.47 117.51 114.73 2k9a h ILE 65 Ca 0.15 -0.48 -0.01 0.00 1.00 0.00 0.00 64.86 65.52 2k9a h ILE 65 Cb 0.56 -0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 36.45 2k9a h ILE 65 CO 0.03 0.25 0.12 0.15 0.00 0.00 0.00 178.15 178.70 2k9a h PHE 66 N 1.33 0.38 0.00 1.37 3.57 -1.26 -2.14 116.94 120.19 2k9a h PHE 66 Ca 0.36 -0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.82 2k9a h PHE 66 Cb -0.14 -0.12 -0.00 0.00 2.79 0.00 0.00 35.95 38.48 2k9a h PHE 66 CO 0.00 0.37 -0.09 -0.91 -2.23 0.00 0.00 178.31 175.45 2k9a h ASN 67 N 0.28 0.00 -0.01 0.41 2.35 -1.10 -2.20 115.58 115.30 2k9a h ASN 67 Ca 0.09 0.00 -0.22 0.00 -0.55 0.00 0.00 56.30 55.62 2k9a h ASN 67 Cb 0.14 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.51 2k9a h ASN 67 CO -0.01 0.09 -0.81 -0.08 -1.65 0.00 0.00 177.43 174.97 2k9a h GLU 68 N 0.00 0.68 -0.26 0.81 4.57 -0.65 -1.90 114.58 117.82 2k9a h GLU 68 Ca -0.00 -0.58 -0.15 0.00 -1.18 0.00 0.00 59.36 57.45 2k9a h GLU 68 Cb 0.27 0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 28.98 2k9a h GLU 68 CO 0.01 1.19 -0.43 -0.92 -1.18 0.00 0.00 179.01 177.68 2k9a h TYR 69 N 0.45 0.79 0.00 0.92 3.20 -0.88 0.19 116.97 121.63 2k9a h TYR 69 Ca -0.06 -0.24 -0.13 0.00 3.14 0.00 0.00 58.73 61.44 2k9a h TYR 69 Cb 1.43 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 39.52 2k9a h TYR 69 CO 0.08 0.97 -0.61 0.82 -1.64 0.00 0.00 178.16 177.78 2k9a h ILE 70 N 0.53 1.31 0.00 1.81 1.08 -1.44 -0.77 117.51 120.03 2k9a h ILE 70 Ca 0.04 -2.19 -0.27 0.00 -0.39 0.00 0.00 64.86 62.06 2k9a h ILE 70 Cb 0.97 2.22 -0.05 0.00 -3.07 0.00 0.00 36.82 36.89 2k9a h ILE 70 CO 0.09 0.60 -1.66 -1.20 -0.69 0.00 0.00 178.15 175.28 2k9a n SER 71 N -3.62 0.84 -0.06 1.72 7.64 -0.72 -3.53 113.62 115.90 2k9a n SER 71 Ca -0.01 0.39 -0.04 0.00 1.01 0.00 0.00 58.87 60.23 2k9a n SER 71 Cb 0.65 0.02 -0.01 0.00 -1.01 0.00 0.00 64.21 63.86 2k9a n SER 71 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 2k9a n LEU 72 N -3.00 1.52 0.15 -3.43 -0.00 0.64 -4.09 117.00 108.80 2k9a n LEU 72 Ca -0.16 0.58 -0.10 0.00 -0.00 0.00 0.00 56.01 56.34 2k9a n LEU 72 Cb 1.01 -0.82 -0.05 0.00 -0.00 0.00 0.00 43.42 43.56 2k9a n LEU 72 CO 0.44 -0.48 0.30 0.58 -0.00 0.00 0.00 177.39 178.23 2k9a h VAL 73 N -0.84 0.28 -0.68 1.96 2.07 -1.32 -1.78 116.25 115.94 2k9a h VAL 73 Ca 0.00 -0.73 0.12 0.00 0.82 0.00 0.00 66.70 66.91 2k9a h VAL 73 Cb 0.42 0.46 -0.09 0.00 -1.52 0.00 0.00 31.29 30.57 2k9a h VAL 73 CO 0.00 0.07 0.23 -0.08 0.02 0.00 0.00 177.57 177.81 2k9a h GLU 74 N -1.04 0.37 -0.04 1.57 4.81 -1.59 0.95 114.58 119.60 2k9a h GLU 74 Ca -0.05 -0.02 -0.09 0.00 -0.13 0.00 0.00 59.36 59.07 2k9a h GLU 74 Cb 0.47 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.75 2k9a h GLU 74 CO 0.08 0.25 -0.39 0.87 -0.73 0.00 0.00 179.01 179.09 2k9a h LYS 75 N 0.38 0.09 -0.39 1.92 1.79 -1.65 -2.79 116.57 115.92 2k9a h LYS 75 Ca 0.36 -0.04 0.04 0.00 -2.18 0.00 0.00 60.65 58.83 2k9a h LYS 75 Cb 0.52 -0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.13 2k9a h LYS 75 CO -0.38 0.46 0.17 -0.92 -1.08 0.00 0.00 179.45 177.70 2k9a h TYR 76 N 0.08 0.31 -0.22 -1.35 3.20 0.11 0.27 116.97 119.36 2k9a h TYR 76 Ca 0.01 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.85 2k9a h TYR 76 Cb 0.72 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.90 2k9a h TYR 76 CO 0.00 0.15 -0.03 0.82 -1.64 0.00 0.00 178.16 177.46 2k9a h ILE 77 N 0.35 1.27 -0.12 1.81 2.04 -1.34 -2.49 117.51 119.03 2k9a h ILE 77 Ca 0.17 -0.99 0.03 0.00 1.00 0.00 0.00 64.86 65.07 2k9a h ILE 77 Cb 0.11 1.47 -0.03 0.00 -0.74 0.00 0.00 36.82 37.63 2k9a h ILE 77 CO -0.14 0.30 -0.07 -0.08 0.00 0.00 0.00 178.15 178.16 2k9a h GLU 78 N 0.16 -0.07 -0.80 2.37 4.81 -1.22 -2.39 114.58 117.44 2k9a h GLU 78 Ca 0.06 0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.31 2k9a h GLU 78 Cb 0.47 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.82 2k9a h GLU 78 CO 0.02 -0.04 0.53 0.93 -0.73 0.00 0.00 179.01 179.71 2k9a h GLU 79 N -0.07 1.03 -0.87 1.92 5.08 -0.97 -0.68 114.58 120.02 2k9a h GLU 79 Ca 0.07 -0.06 0.05 0.00 -1.00 0.00 0.00 59.36 58.42 2k9a h GLU 79 Cb 0.17 -0.23 -0.05 0.00 0.50 0.00 0.00 28.75 29.14 2k9a h GLU 79 CO -0.16 0.68 0.57 1.96 -1.00 0.00 0.00 179.01 181.06 2k9a h GLN 80 N 1.06 1.01 0.04 2.33 1.08 -1.07 -1.70 115.11 117.88 2k9a h GLN 80 Ca 0.30 -0.06 -0.23 0.00 -1.45 0.00 0.00 58.65 57.21 2k9a h GLN 80 Cb -0.09 -0.23 -0.00 0.00 -0.05 0.00 0.00 27.48 27.10 2k9a h GLN 80 CO -0.07 0.67 -1.02 -0.07 -0.95 0.00 0.00 178.83 177.38 2k9a h LEU 81 N 1.04 0.39 -1.81 1.46 3.38 -0.94 -3.19 115.31 115.64 2k9a h LEU 81 Ca 0.36 -0.35 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 2k9a h LEU 81 Cb 0.10 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 2k9a h LEU 81 CO -0.12 1.19 -0.11 -0.07 0.09 0.00 0.00 178.44 179.42 2k9a h LEU 82 N 0.13 0.00 -2.11 1.67 3.38 -0.41 -0.91 115.31 117.06 2k9a h LEU 82 Ca -0.08 0.00 0.09 0.00 0.09 0.00 0.00 57.88 57.97 2k9a h LEU 82 Cb 1.70 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.43 2k9a h LEU 82 CO 0.17 0.11 0.29 1.56 0.09 0.00 0.00 178.44 180.66 2k9a h GLN 83 N 0.00 0.00 0.00 1.13 4.20 -1.32 -2.67 115.11 116.45 2k9a h GLN 83 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2k9a h GLN 83 Cb 0.40 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.18 2k9a h GLN 83 CO 0.01 0.00 -0.04 2.89 -0.67 0.00 0.00 178.83 181.02 2k9a n ARG 84 N -3.90 5.19 -3.57 1.46 1.85 -1.02 -4.92 116.66 111.74 2k9a n ARG 84 Ca 0.04 0.00 -0.29 0.00 -1.00 0.00 0.00 57.85 56.61 2k9a n ARG 84 Cb 0.45 -0.42 -0.12 0.00 -1.05 0.00 0.00 32.46 31.32 2k9a n ARG 84 CO 0.00 0.00 0.00 0.42 -0.01 0.00 0.00 177.63 178.04 2k9a s ILE 85 N -0.82 0.84 -1.81 8.89 1.01 -0.38 -4.96 121.20 123.96 2k9a s ILE 85 Ca 0.00 -2.37 0.20 0.00 0.00 0.00 0.00 60.65 58.48 2k9a s ILE 85 Cb 0.00 -1.59 0.50 0.00 0.01 0.00 0.00 42.46 41.38 2k9a s ILE 85 CO 0.00 -1.00 1.60 -0.81 0.00 0.00 0.00 174.94 174.73 2k9a n PRO 86 N 3.50 0.52 -0.30 2.79 -0.04 -1.23 -2.28 135.00 137.96 2k9a n PRO 86 Ca 0.14 0.03 0.07 0.00 -0.04 0.00 0.00 63.50 63.71 2k9a n PRO 86 Cb 0.38 -1.50 0.20 0.00 -0.04 0.00 0.00 33.50 32.54 2k9a n PRO 86 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2k9a n GLU 87 N -1.09 2.86 -3.19 0.54 1.02 -1.26 -5.01 120.64 114.51 2k9a n GLU 87 Ca 0.13 -2.43 -0.34 0.00 -0.02 0.00 0.00 57.16 54.50 2k9a n GLU 87 Cb 0.10 -1.55 -0.06 0.00 -0.02 0.00 0.00 31.44 29.91 2k9a n GLU 87 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 2k9a s PHE 88 N -1.94 3.53 -0.26 -0.32 5.36 -0.97 -5.07 117.98 118.31 2k9a s PHE 88 Ca 0.32 1.22 -0.00 0.00 -0.96 0.00 0.00 56.93 57.51 2k9a s PHE 88 Cb 0.23 -2.51 0.08 0.00 -0.34 0.00 0.00 43.02 40.48 2k9a s PHE 88 CO 0.11 0.27 0.04 1.21 -1.46 0.00 0.00 175.22 175.39 2k9a s ASN 89 N -1.93 3.78 0.49 6.13 3.04 -1.26 -4.99 114.94 120.21 2k9a s ASN 89 Ca 0.46 -1.36 0.18 0.00 0.04 0.00 0.00 52.86 52.18 2k9a s ASN 89 Cb -0.14 -0.95 1.23 0.00 -1.54 0.00 0.00 41.25 39.86 2k9a s ASN 89 CO 0.20 -0.34 2.08 -0.03 -3.04 0.00 0.00 177.10 175.97 2k9a h MET 90 N 8.05 0.00 0.58 0.43 1.85 -1.97 -1.22 114.93 122.64 2k9a h MET 90 Ca -0.15 0.00 -0.03 0.00 -0.61 0.00 0.00 59.70 58.92 2k9a h MET 90 Cb 1.06 0.00 0.01 0.00 0.43 0.00 0.00 31.60 33.09 2k9a h MET 90 CO 0.43 0.10 -0.28 0.00 -0.40 0.00 0.00 176.91 176.76 2k9a h ALA 91 N 1.90 -0.78 0.00 0.39 0.00 -2.00 -1.78 119.26 117.00 2k9a h ALA 91 Ca -0.00 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 2k9a h ALA 91 Cb 0.19 0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2k9a h ALA 91 CO 0.01 -0.78 -0.18 0.00 0.00 0.00 0.00 179.25 178.31 2k9a h ALA 92 N -0.91 1.27 -0.05 0.00 0.00 -1.97 -2.67 119.26 114.92 2k9a h ALA 92 Ca -0.08 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 2k9a h ALA 92 Cb 0.65 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 2k9a h ALA 92 CO 0.13 0.22 -0.09 0.35 0.00 0.00 0.00 179.25 179.86 2k9a h PHE 93 N 0.00 0.19 -0.75 0.00 3.57 -1.18 -2.56 116.94 116.21 2k9a h PHE 93 Ca -0.00 -0.07 -0.05 0.00 3.53 0.00 0.00 57.97 61.39 2k9a h PHE 93 Cb 0.45 -0.04 -0.03 0.00 2.79 0.00 0.00 35.95 39.12 2k9a h PHE 93 CO 0.00 0.66 0.28 1.79 -2.23 0.00 0.00 178.31 178.82 2k9a h THR 94 N -0.33 1.25 -0.71 4.41 1.35 -1.19 0.74 112.91 118.43 2k9a h THR 94 Ca 0.00 -0.81 -0.04 0.00 -0.55 0.00 0.00 66.41 65.01 2k9a h THR 94 Cb 0.65 0.37 -0.03 0.00 -1.73 0.00 0.00 68.15 67.41 2k9a h THR 94 CO 0.02 0.33 0.29 0.71 -0.25 0.00 0.00 175.52 176.62 2k9a h THR 95 N 1.09 1.25 0.00 6.82 1.35 -1.51 -2.53 112.91 119.38 2k9a h THR 95 Ca 0.25 -0.76 -0.16 0.00 -0.55 0.00 0.00 66.41 65.19 2k9a h THR 95 Cb 0.23 0.41 -0.02 0.00 -1.73 0.00 0.00 68.15 67.04 2k9a h THR 95 CO -0.02 0.31 -0.75 0.74 -0.25 0.00 0.00 175.52 175.55 2k9a h THR 96 N 1.02 1.43 -0.44 6.82 2.02 -1.20 -3.31 112.91 119.24 2k9a h THR 96 Ca 0.24 -2.68 -0.06 0.00 0.77 0.00 0.00 66.41 64.68 2k9a h THR 96 Cb 0.20 2.49 -0.02 0.00 -1.74 0.00 0.00 68.15 69.08 2k9a h THR 96 CO -0.02 0.74 0.04 0.25 0.37 0.00 0.00 175.52 176.90 2k9a h LEU 97 N 0.00 0.73 -1.74 2.58 6.46 -0.54 -1.42 115.31 121.37 2k9a h LEU 97 Ca -0.01 -0.28 0.23 0.00 -0.12 0.00 0.00 57.88 57.70 2k9a h LEU 97 Cb 1.43 -0.19 -0.05 0.00 -0.73 0.00 0.00 40.66 41.11 2k9a h LEU 97 CO 0.10 0.83 0.61 0.06 -0.62 0.00 0.00 178.44 179.42 2k9a h GLN 98 N 0.60 0.20 0.17 1.25 3.07 -1.55 0.18 115.11 119.04 2k9a h GLN 98 Ca 0.13 -0.01 -0.35 0.00 0.09 0.00 0.00 58.65 58.51 2k9a h GLN 98 Cb 0.43 -0.04 0.00 0.00 0.08 0.00 0.00 27.48 27.95 2k9a h GLN 98 CO 0.01 0.13 -1.78 0.45 0.09 0.00 0.00 178.83 177.73 2k9a h HIS 99 N 0.20 0.67 0.00 0.06 3.86 -1.67 -3.29 115.15 114.98 2k9a h HIS 99 Ca 0.45 -0.49 0.00 0.00 -1.16 0.00 0.00 60.37 59.17 2k9a h HIS 99 Cb 1.43 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 29.87 2k9a h HIS 99 CO -0.00 1.70 0.00 1.58 0.86 0.00 0.00 177.93 182.07 2k9a n HIS 100 N -3.59 0.00 0.24 2.45 -0.00 -0.09 -2.63 115.22 111.60 2k9a n HIS 100 Ca -0.26 0.00 0.15 0.00 0.46 0.00 0.00 57.72 58.07 2k9a n HIS 100 Cb 1.06 -0.27 0.81 0.00 -0.12 0.00 0.00 29.99 31.47 2k9a n HIS 100 CO 0.00 0.00 0.00 -0.22 0.46 0.00 0.00 176.34 176.58 2k9a h LYS 101 N 0.00 0.00 -0.38 1.57 3.64 -0.82 -1.90 116.57 118.69 2k9a h LYS 101 Ca 0.00 0.00 0.11 0.00 -1.27 0.00 0.00 60.65 59.49 2k9a h LYS 101 Cb 0.10 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 2k9a h LYS 101 CO 0.00 0.00 0.36 0.38 -2.27 0.00 0.00 179.45 177.92 2k9a h ASP 102 N 0.00 0.00 0.00 4.20 2.03 -1.78 -2.94 116.42 117.93 2k9a h ASP 102 Ca 0.00 0.00 -0.04 0.00 -0.73 0.00 0.00 57.03 56.26 2k9a h ASP 102 Cb 0.09 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.58 2k9a h ASP 102 CO 0.00 0.00 -1.16 1.21 -1.03 0.00 0.00 179.24 178.26 2k9a n GLU 103 N -3.93 3.37 -1.96 4.15 2.13 -0.74 -5.04 120.64 118.61 2k9a n GLU 103 Ca 0.06 0.00 -0.38 0.00 0.66 0.00 0.00 57.16 57.50 2k9a n GLU 103 Cb 0.53 -1.06 0.02 0.00 0.27 0.00 0.00 31.44 31.20 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 -2.06 2.46 -0.35 6.31 1.01 -1.02 -4.89 120.40 121.86 2k9a s VAL 104 Ca -0.01 0.36 -0.28 0.00 0.00 0.00 0.00 61.98 62.05 2k9a s VAL 104 Cb 0.01 -3.18 -0.03 0.00 0.00 0.00 0.00 36.38 33.17 2k9a s VAL 104 CO 0.09 0.00 2.02 0.00 0.00 0.00 0.00 175.10 177.21 2k9a s ALA 105 N -1.37 2.56 0.51 5.51 0.00 -1.26 -4.83 121.76 122.88 2k9a s ALA 105 Ca 0.67 0.27 0.15 0.00 0.00 0.00 0.00 51.96 53.05 2k9a s ALA 105 Cb -0.36 -4.12 1.22 0.00 0.00 0.00 0.00 23.12 19.86 2k9a s ALA 105 CO 0.44 -3.10 2.14 0.78 0.00 0.00 0.00 175.76 176.02 2k9a h GLY 106 N 15.27 0.07 0.78 0.00 0.00 -1.90 -2.59 103.07 114.72 2k9a h GLY 106 Ca -0.34 -0.03 0.02 0.00 0.00 0.00 0.00 47.33 46.99 2k9a h GLY 106 CO 1.05 0.03 0.01 -1.80 0.00 0.00 0.00 176.54 175.83 2k9a h ASP 107 N 0.07 -0.03 0.00 0.19 1.82 -2.00 0.22 116.42 116.69 2k9a h ASP 107 Ca 0.02 0.03 -0.00 0.00 -0.39 0.00 0.00 57.03 56.69 2k9a h ASP 107 Cb 0.00 0.05 0.00 0.00 0.68 0.00 0.00 39.33 40.06 2k9a h ASP 107 CO -0.00 0.01 -0.00 0.40 -1.61 0.00 0.00 179.24 178.03 2k9a h ILE 108 N 0.07 1.40 -0.02 2.25 2.04 -1.90 -3.10 117.51 118.26 2k9a h ILE 108 Ca 0.07 -1.17 0.00 0.00 1.00 0.00 0.00 64.86 64.76 2k9a h ILE 108 Cb 0.08 2.20 -0.00 0.00 -0.74 0.00 0.00 36.82 38.36 2k9a h ILE 108 CO -0.12 0.30 0.01 0.15 0.00 0.00 0.00 178.15 178.50 2k9a h PHE 109 N -0.50 0.00 -1.01 1.37 3.57 -1.42 -2.61 116.94 116.34 2k9a h PHE 109 Ca -0.00 0.00 0.27 0.00 3.53 0.00 0.00 57.97 61.77 2k9a h PHE 109 Cb 0.50 0.00 -0.13 0.00 2.79 0.00 0.00 35.95 39.11 2k9a h PHE 109 CO 0.10 0.00 0.60 0.22 -2.23 0.00 0.00 178.31 177.00 2k9a h ASP 110 N 0.00 0.62 -0.10 0.41 3.58 -0.47 0.41 116.42 120.87 2k9a h ASP 110 Ca 0.01 0.14 -0.20 0.00 0.42 0.00 0.00 57.03 57.40 2k9a h ASP 110 Cb 0.04 0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.14 2k9a h ASP 110 CO -0.00 0.05 -0.67 0.00 -2.88 0.00 0.00 179.24 175.74 2k9a h MET 111 N 0.51 0.72 0.00 0.28 -0.00 -1.62 -2.97 114.93 111.84 2k9a h MET 111 Ca 0.66 -0.53 -0.02 0.00 -0.00 0.00 0.00 59.70 59.81 2k9a h MET 111 Cb 1.36 0.09 -0.00 0.00 -0.00 0.00 0.00 31.60 33.05 2k9a h MET 111 CO -0.48 1.15 -0.08 -0.07 -0.00 0.00 0.00 176.91 177.43 2k9a h LEU 112 N 0.52 0.00 -1.86 -0.10 3.38 -0.41 -2.77 115.31 114.07 2k9a h LEU 112 Ca -0.02 0.00 0.20 0.00 0.09 0.00 0.00 57.88 58.15 2k9a h LEU 112 Cb 1.27 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.00 2k9a h LEU 112 CO 0.14 0.08 0.65 -0.07 0.09 0.00 0.00 178.44 179.33 2k9a h LEU 113 N 0.00 0.00 0.00 1.67 3.38 -0.68 -0.12 115.31 119.57 2k9a h LEU 113 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2k9a h LEU 113 Cb 0.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.09 2k9a h LEU 113 CO 0.01 0.00 0.06 0.35 0.09 0.00 0.00 178.44 178.95 2k9a n THR 114 N -3.81 0.69 -0.03 0.22 -2.24 -1.05 -0.65 114.28 107.41 2k9a n THR 114 Ca 0.14 0.23 -0.02 0.00 -2.27 0.00 0.00 64.05 62.13 2k9a n THR 114 Cb 0.90 -1.23 0.24 0.00 -2.10 0.00 0.00 70.33 68.14 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 0.64 0.00 4.78 0.04 -1.29 -3.38 116.94 117.73 2k9a h PHE 115 Ca 0.00 -0.08 0.00 0.00 2.80 0.00 0.00 57.97 60.69 2k9a h PHE 115 Cb 0.11 -0.18 0.00 0.00 2.20 0.00 0.00 35.95 38.09 2k9a h PHE 115 CO 0.00 0.63 0.00 0.25 -0.60 0.00 0.00 178.31 178.59 2k9a n THR 116 N -4.24 0.00 -3.03 -1.55 -2.24 -0.72 -5.00 114.28 97.50 2k9a n THR 116 Ca 0.02 0.00 -0.44 0.00 -2.27 0.00 0.00 64.05 61.35 2k9a n THR 116 Cb 0.28 0.96 -0.01 0.00 -2.10 0.00 0.00 70.33 69.46 2k9a n THR 116 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2k9a s ASP 117 N 0.00 6.90 0.42 3.42 1.01 0.18 -4.84 116.67 123.75 2k9a s ASP 117 Ca 0.00 -2.68 0.10 0.00 0.71 0.00 0.00 52.55 50.67 2k9a s ASP 117 Cb 0.00 -2.36 0.92 0.00 1.01 0.00 0.00 42.92 42.49 2k9a s ASP 117 CO 0.00 -0.79 2.02 0.15 0.21 0.00 0.00 175.17 176.76 2k9a h PHE 118 N 7.79 0.51 -0.97 4.23 3.57 -1.87 -1.50 116.94 128.70 2k9a h PHE 118 Ca 0.22 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.78 2k9a h PHE 118 Cb 0.95 -0.17 -0.06 0.00 2.79 0.00 0.00 35.95 39.46 2k9a h PHE 118 CO 1.08 0.28 0.63 1.25 -2.23 0.00 0.00 178.31 179.32 2k9a h LEU 119 N 0.52 1.03 -0.45 0.59 5.85 -1.97 -1.08 115.31 119.79 2k9a h LEU 119 Ca 0.21 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.82 2k9a h LEU 119 Cb 0.20 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 2k9a h LEU 119 CO -0.06 0.68 -0.55 0.00 -0.34 0.00 0.00 178.44 178.18 2k9a h ALA 120 N 1.42 0.78 0.35 1.25 0.00 -1.67 -2.65 119.26 118.74 2k9a h ALA 120 Ca 0.40 -0.50 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 2k9a h ALA 120 Cb 0.08 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2k9a h ALA 120 CO -0.15 0.69 -0.17 0.35 0.00 0.00 0.00 179.25 179.97 2k9a h PHE 121 N 0.00 -0.44 -0.45 0.00 3.57 -0.63 -0.58 116.94 118.41 2k9a h PHE 121 Ca -0.01 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.42 2k9a h PHE 121 Cb 1.23 0.15 -0.02 0.00 2.79 0.00 0.00 35.95 40.10 2k9a h PHE 121 CO 0.00 -0.14 0.04 -0.22 -2.23 0.00 0.00 178.31 175.76 2k9a h LYS 122 N -0.73 0.78 -0.00 1.11 3.64 -1.43 -2.74 116.57 117.19 2k9a h LYS 122 Ca -0.05 -0.23 -0.04 0.00 -1.27 0.00 0.00 60.65 59.06 2k9a h LYS 122 Cb 0.50 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.23 2k9a h LYS 122 CO 0.08 0.82 -0.20 1.49 -2.27 0.00 0.00 179.45 179.37 2k9a h GLU 123 N 0.63 0.01 -0.10 1.90 4.57 -1.50 -1.32 114.58 118.77 2k9a h GLU 123 Ca 0.13 -0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 58.28 2k9a h GLU 123 Cb 0.44 -0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.03 2k9a h GLU 123 CO 0.02 0.21 -0.07 1.98 -1.18 0.00 0.00 179.01 179.96 2k9a h MET 124 N 0.01 0.22 -0.34 1.92 4.05 -0.81 -2.46 114.93 117.51 2k9a h MET 124 Ca -0.00 -0.11 -0.17 0.00 -0.28 0.00 0.00 59.70 59.14 2k9a h MET 124 Cb 0.36 -0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 31.16 2k9a h MET 124 CO 0.03 0.62 -0.45 0.74 0.23 0.00 0.00 176.91 178.07 2k9a h PHE 125 N -0.17 1.12 -0.99 1.39 0.04 -1.34 -2.62 116.94 114.36 2k9a h PHE 125 Ca 0.02 -0.36 0.01 0.00 2.80 0.00 0.00 57.97 60.44 2k9a h PHE 125 Cb 0.56 -0.22 -0.05 0.00 2.20 0.00 0.00 35.95 38.44 2k9a h PHE 125 CO 0.08 1.19 0.66 -0.07 -0.60 0.00 0.00 178.31 179.57 2k9a h LEU 126 N 0.72 1.14 -0.49 1.54 4.07 -1.29 -2.01 115.31 118.99 2k9a h LEU 126 Ca 0.04 -0.03 -0.09 0.00 0.08 0.00 0.00 57.88 57.88 2k9a h LEU 126 Cb 1.05 -0.28 -0.02 0.00 1.08 0.00 0.00 40.66 42.49 2k9a h LEU 126 CO 0.11 0.82 -0.06 -0.78 -1.08 0.00 0.00 178.44 177.45 2k9a h ASP 127 N 1.35 0.90 -0.64 -0.43 3.58 -1.38 -2.36 116.42 117.44 2k9a h ASP 127 Ca 0.37 -0.34 0.03 0.00 0.42 0.00 0.00 57.03 57.51 2k9a h ASP 127 Cb -0.15 -0.24 -0.04 0.00 1.72 0.00 0.00 39.33 40.62 2k9a h ASP 127 CO -0.08 1.02 0.42 0.22 -2.88 0.00 0.00 179.24 177.94 2k9a h TYR 128 N 0.75 0.72 -0.18 0.28 3.20 -1.04 -1.57 116.97 119.14 2k9a h TYR 128 Ca 0.13 0.02 -0.16 0.00 3.14 0.00 0.00 58.73 61.86 2k9a h TYR 128 Cb 0.60 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.62 2k9a h TYR 128 CO 0.04 0.42 -0.56 -0.09 -1.64 0.00 0.00 178.16 176.34 2k9a h ARG 129 N 0.75 0.55 -0.65 1.82 2.43 -1.11 -3.15 114.38 115.02 2k9a h ARG 129 Ca 0.26 -0.35 -0.03 0.00 -0.81 0.00 0.00 59.98 59.04 2k9a h ARG 129 Cb 0.09 0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.65 2k9a h ARG 129 CO -0.07 0.96 0.28 0.00 -1.51 0.00 0.00 179.97 179.63 2k9a h ALA 130 N 0.97 1.28 0.00 2.80 0.00 -0.77 -1.96 119.26 121.58 2k9a h ALA 130 Ca 0.01 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 2k9a h ALA 130 Cb 1.10 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 2k9a h ALA 130 CO 0.10 0.55 -0.12 0.93 0.00 0.00 0.00 179.25 180.71 2k9a h GLU 131 N 0.93 0.00 0.00 0.00 5.08 -1.41 -1.46 114.58 117.72 2k9a h GLU 131 Ca 0.22 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 2k9a h GLU 131 Cb 0.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.39 2k9a h GLU 131 CO -0.02 0.12 0.00 1.63 -1.00 0.00 0.00 179.01 179.73 2k9a n LYS 132 N -3.70 0.19 0.00 2.33 4.76 -0.74 -2.02 118.16 118.98 2k9a n LYS 132 Ca -0.02 0.39 0.07 0.00 -2.87 0.00 0.00 58.31 55.89 2k9a n LYS 132 Cb 0.23 -1.85 -0.03 0.00 -1.84 0.00 0.00 35.03 31.55 2k9a n LYS 132 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 2k9a n GLU 133 N -2.20 1.95 -0.10 1.97 1.02 -0.57 -4.55 120.64 118.16 2k9a n GLU 133 Ca 0.02 -0.53 -0.19 0.00 -0.02 0.00 0.00 57.16 56.45 2k9a n GLU 133 Cb 0.25 -1.21 -0.12 0.00 -0.02 0.00 0.00 31.44 30.33 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 1.16 -0.41 3.35 0.62 0.00 -0.94 -4.96 105.19 104.01 2k9a n GLY 134 Ca 0.05 -0.20 -0.04 0.00 0.00 0.00 0.00 46.02 45.83 2k9a n GLY 134 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2k9a s ARG 135 N -2.53 0.45 0.00 1.61 3.52 -0.86 -5.11 118.95 116.03 2k9a s ARG 135 Ca -0.32 1.13 0.00 0.00 -0.13 0.00 0.00 55.73 56.40 2k9a s ARG 135 Cb 0.08 0.46 0.00 0.00 -1.56 0.00 0.00 34.95 33.94 2k9a s ARG 135 CO 0.64 -0.33 0.00 0.41 -0.81 0.00 0.00 175.30 175.21