#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k9a h ASP 2 N 0.00 0.17 -2.89 7.83 5.19 -2.09 -3.44 116.42 121.19 2k9a h ASP 2 Ca 0.00 -0.13 -0.66 0.00 -0.62 0.00 0.00 57.03 55.62 2k9a h ASP 2 Cb 0.00 -0.05 -0.10 0.00 0.18 0.00 0.00 39.33 39.36 2k9a h ASP 2 CO 0.00 0.87 -0.51 0.00 -3.12 0.00 0.00 179.24 176.47 2k9a s ALA 3 N -3.38 3.71 -0.20 3.45 0.00 -1.26 -4.81 121.76 119.26 2k9a s ALA 3 Ca -0.02 -0.69 -0.09 0.00 0.00 0.00 0.00 51.96 51.16 2k9a s ALA 3 Cb 0.11 -1.89 0.04 0.00 0.00 0.00 0.00 23.12 21.37 2k9a s ALA 3 CO 0.80 0.53 0.18 -0.11 0.00 0.00 0.00 175.76 177.17 2k9a n LEU 4 N 2.30 -6.48 -4.13 0.00 7.94 -1.26 -5.04 117.00 110.32 2k9a n LEU 4 Ca -0.19 2.06 -0.24 0.00 -1.11 0.00 0.00 56.01 56.53 2k9a n LEU 4 Cb 0.54 -3.22 -0.15 0.00 0.53 0.00 0.00 43.42 41.12 2k9a n LEU 4 CO 0.31 -3.82 -0.49 -1.83 -1.11 0.00 0.00 177.39 170.46 2k9a s GLU 5 N -0.86 1.36 1.58 1.96 -1.05 -1.26 -4.90 118.70 115.53 2k9a s GLU 5 Ca -0.21 -0.56 0.00 0.00 -0.15 0.00 0.00 54.97 54.04 2k9a s GLU 5 Cb 0.01 -1.29 0.00 0.00 -0.44 0.00 0.00 34.13 32.42 2k9a s GLU 5 CO 0.75 0.31 0.00 0.41 0.95 0.00 0.00 175.26 177.69 2k9a n GLY 6 N 2.80 -1.33 3.81 -3.83 0.00 -1.26 -4.85 105.19 100.53 2k9a n GLY 6 Ca -0.15 -1.13 -0.29 0.00 0.00 0.00 0.00 46.02 44.44 2k9a n GLY 6 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2k9a s GLU 7 N -0.17 1.80 0.01 1.61 8.01 -1.26 -5.02 118.70 123.68 2k9a s GLU 7 Ca 0.00 0.47 -0.25 0.00 0.01 0.00 0.00 54.97 55.19 2k9a s GLU 7 Cb 0.00 -1.90 -0.05 0.00 -4.31 0.00 0.00 34.13 27.87 2k9a s GLU 7 CO 0.00 -1.78 0.77 -1.12 0.01 0.00 0.00 175.26 173.14 2k9a s SER 8 N -4.03 7.17 0.52 -0.19 0.01 -1.26 -5.05 113.70 110.86 2k9a s SER 8 Ca 0.62 1.40 -0.15 0.00 1.31 0.00 0.00 55.95 59.13 2k9a s SER 8 Cb -0.14 -2.46 -0.07 0.00 0.21 0.00 0.00 66.02 63.55 2k9a s SER 8 CO 0.53 -0.05 0.98 -0.36 0.41 0.00 0.00 173.24 174.75 2k9a s PHE 9 N 0.30 3.48 0.00 2.43 0.40 -1.26 -5.08 117.98 118.25 2k9a s PHE 9 Ca 0.40 1.41 0.03 0.00 -0.60 0.00 0.00 56.93 58.17 2k9a s PHE 9 Cb -0.20 -2.76 -0.01 0.00 0.51 0.00 0.00 43.02 40.57 2k9a s PHE 9 CO 0.22 -0.39 -0.09 0.00 0.70 0.00 0.00 175.22 175.66 2k9a s ALA 10 N -2.68 0.75 0.33 5.36 0.00 -1.26 -5.10 121.76 119.17 2k9a s ALA 10 Ca 0.58 -0.46 0.00 0.00 0.00 0.00 0.00 51.96 52.08 2k9a s ALA 10 Cb -0.10 -0.16 0.00 0.00 0.00 0.00 0.00 23.12 22.86 2k9a s ALA 10 CO 0.34 0.16 0.00 1.28 0.00 0.00 0.00 175.76 177.54 2k9a n LEU 11 N 2.62 0.00 -4.17 0.00 4.77 -1.26 -4.95 117.00 114.00 2k9a n LEU 11 Ca -0.15 1.55 -0.15 0.00 -0.03 0.00 0.00 56.01 57.23 2k9a n LEU 11 Cb 0.57 -4.35 -0.11 0.00 -2.33 0.00 0.00 43.42 37.19 2k9a n LEU 11 CO 0.24 -2.87 -0.42 -0.55 -1.33 0.00 0.00 177.39 172.46 2k9a s SER 12 N -7.17 1.44 0.00 -1.43 0.15 -1.26 -5.04 113.70 100.39 2k9a s SER 12 Ca 0.00 -0.77 0.08 0.00 0.70 0.00 0.00 55.95 55.95 2k9a s SER 12 Cb 0.00 0.00 0.06 0.00 -1.71 0.00 0.00 66.02 64.37 2k9a s SER 12 CO 0.00 -0.24 0.74 2.22 1.20 0.00 0.00 173.24 177.16 2k9a n PHE 13 N 0.69 0.00 -3.22 3.44 -1.74 -1.26 -4.94 117.46 110.43 2k9a n PHE 13 Ca -0.17 0.00 -0.43 0.00 -0.56 0.00 0.00 57.45 56.29 2k9a n PHE 13 Cb 0.57 0.00 -0.08 0.00 1.52 0.00 0.00 39.48 41.49 2k9a n PHE 13 CO 0.00 0.00 0.00 -1.12 -0.56 0.00 0.00 176.76 175.08 2k9a s SER 14 N -0.64 6.27 0.00 5.98 0.01 -1.26 -4.76 113.70 119.30 2k9a s SER 14 Ca 0.09 -0.37 0.00 0.00 1.31 0.00 0.00 55.95 56.98 2k9a s SER 14 Cb 0.06 -2.27 0.00 0.00 0.21 0.00 0.00 66.02 64.02 2k9a s SER 14 CO 0.10 -0.63 0.00 -0.24 0.41 0.00 0.00 173.24 172.88 2k9a n SER 15 N 5.89 0.00 -0.09 2.44 2.88 -1.26 -4.63 113.62 118.85 2k9a n SER 15 Ca -0.04 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.38 2k9a n SER 15 Cb 0.48 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.90 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 0.00 0.38 -0.58 -1.46 0.00 -1.97 -1.41 119.26 114.22 2k9a h ALA 16 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2k9a h ALA 16 Cb 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2k9a h ALA 16 CO 0.00 0.23 0.00 0.45 0.00 0.00 0.00 179.25 179.93 2k9a n SER 17 N -4.48 4.06 -4.85 0.00 2.88 -1.26 -4.59 113.62 105.38 2k9a n SER 17 Ca -0.04 -2.32 -0.23 0.00 -1.33 0.00 0.00 58.87 54.95 2k9a n SER 17 Cb 0.34 -0.52 -0.03 0.00 -0.75 0.00 0.00 64.21 63.24 2k9a n SER 17 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2k9a s ASP 18 N -0.86 4.81 0.61 -3.46 2.15 -1.11 -5.00 116.67 113.81 2k9a s ASP 18 Ca 0.44 -0.94 0.33 0.00 0.43 0.00 0.00 52.55 52.81 2k9a s ASP 18 Cb 0.28 -0.31 1.92 0.00 -0.30 0.00 0.00 42.92 44.50 2k9a s ASP 18 CO 0.23 -0.74 2.22 0.00 -0.17 0.00 0.00 175.17 176.70 2k9a h ALA 19 N 1.04 1.46 -0.47 3.66 0.00 -1.91 -2.40 119.26 120.64 2k9a h ALA 19 Ca -0.40 -0.00 0.04 0.00 0.00 0.00 0.00 54.91 54.54 2k9a h ALA 19 Cb 1.27 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.02 2k9a h ALA 19 CO 0.60 -0.11 0.24 0.93 0.00 0.00 0.00 179.25 180.91 2k9a h GLU 20 N 0.00 0.45 0.29 0.00 5.08 -1.91 0.48 114.58 118.97 2k9a h GLU 20 Ca 0.02 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2k9a h GLU 20 Cb 0.18 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 2k9a h GLU 20 CO -0.00 0.30 -0.31 0.35 -1.00 0.00 0.00 179.01 178.34 2k9a h PHE 21 N 0.47 -0.84 0.00 4.33 3.04 -0.72 -0.44 116.94 122.78 2k9a h PHE 21 Ca 0.21 0.01 -0.06 0.00 3.98 0.00 0.00 57.97 62.11 2k9a h PHE 21 Cb 0.12 0.33 -0.01 0.00 2.56 0.00 0.00 35.95 38.95 2k9a h PHE 21 CO -0.10 -0.44 -0.26 0.38 -2.02 0.00 0.00 178.31 175.86 2k9a h ASP 22 N -0.64 0.00 0.01 0.41 3.04 -1.65 -1.15 116.42 116.43 2k9a h ASP 22 Ca -0.01 0.00 -0.00 0.00 -3.24 0.00 0.00 57.03 53.78 2k9a h ASP 22 Cb 0.59 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.88 2k9a h ASP 22 CO -0.08 0.26 -0.00 0.00 -2.04 0.00 0.00 179.24 177.38 2k9a h ALA 23 N 1.74 -0.01 0.25 4.15 0.00 -0.38 -2.08 119.26 122.93 2k9a h ALA 23 Ca -0.00 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 2k9a h ALA 23 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.31 2k9a h ALA 23 CO 0.03 -0.35 -0.12 0.28 0.00 0.00 0.00 179.25 179.09 2k9a h VAL 24 N -0.31 0.80 -0.97 0.00 2.07 -0.91 -2.67 116.25 114.25 2k9a h VAL 24 Ca -0.00 -0.59 0.25 0.00 0.82 0.00 0.00 66.70 67.18 2k9a h VAL 24 Cb 0.31 1.13 -0.06 0.00 -1.52 0.00 0.00 31.29 31.15 2k9a h VAL 24 CO 0.00 0.12 0.66 1.62 0.02 0.00 0.00 177.57 180.00 2k9a h VAL 25 N -0.65 0.57 -0.39 2.57 3.04 -1.29 0.25 116.25 120.35 2k9a h VAL 25 Ca -0.03 -0.09 -0.10 0.00 -1.01 0.00 0.00 66.70 65.47 2k9a h VAL 25 Cb 0.46 0.30 -0.01 0.00 -2.01 0.00 0.00 31.29 30.03 2k9a h VAL 25 CO 0.06 0.05 -0.16 1.23 -1.01 0.00 0.00 177.57 177.74 2k9a h GLY 26 N 0.25 0.85 0.95 3.17 0.00 -1.19 -2.71 103.07 104.39 2k9a h GLY 26 Ca 0.50 -0.75 0.01 0.00 0.00 0.00 0.00 47.33 47.10 2k9a h GLY 26 CO -0.14 0.68 0.32 -0.97 0.00 0.00 0.00 176.54 176.42 2k9a h TYR 27 N 0.59 0.60 -0.49 5.60 0.05 -0.19 -2.54 116.97 120.58 2k9a h TYR 27 Ca 0.09 0.02 0.05 0.00 0.05 0.00 0.00 58.73 58.93 2k9a h TYR 27 Cb 0.70 -0.20 -0.04 0.00 1.01 0.00 0.00 36.73 38.20 2k9a h TYR 27 CO 0.06 0.36 0.24 -0.07 -1.05 0.00 0.00 178.16 177.70 2k9a h LEU 28 N 0.64 0.34 -0.90 3.88 4.07 -1.32 -1.98 115.31 120.04 2k9a h LEU 28 Ca 0.19 0.03 0.11 0.00 0.08 0.00 0.00 57.88 58.30 2k9a h LEU 28 Cb -0.04 -0.03 -0.08 0.00 1.08 0.00 0.00 40.66 41.59 2k9a h LEU 28 CO -0.06 0.23 0.53 -0.33 -1.08 0.00 0.00 178.44 177.73 2k9a h GLU 29 N 0.47 0.81 -0.32 1.13 5.08 -1.14 0.68 114.58 121.29 2k9a h GLU 29 Ca 0.22 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.52 2k9a h GLU 29 Cb 0.14 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.19 2k9a h GLU 29 CO -0.16 0.54 0.16 0.22 -1.00 0.00 0.00 179.01 178.76 2k9a h ASP 30 N 0.84 0.39 0.17 1.42 3.58 -1.00 -2.24 116.42 119.57 2k9a h ASP 30 Ca 0.45 -0.03 -0.27 0.00 0.42 0.00 0.00 57.03 57.61 2k9a h ASP 30 Cb 0.47 -0.10 0.02 0.00 1.72 0.00 0.00 39.33 41.44 2k9a h ASP 30 CO -0.28 0.33 -1.10 0.40 -2.88 0.00 0.00 179.24 175.71 2k9a h ILE 31 N 0.45 1.32 -0.05 2.25 2.04 -0.65 -2.89 117.51 119.97 2k9a h ILE 31 Ca 0.11 -2.42 -0.03 0.00 1.00 0.00 0.00 64.86 63.53 2k9a h ILE 31 Cb 0.04 2.53 -0.01 0.00 -0.74 0.00 0.00 36.82 38.65 2k9a h ILE 31 CO -0.02 0.74 -0.10 0.40 0.00 0.00 0.00 178.15 179.17 2k9a h ILE 32 N 0.30 1.11 -0.67 -0.67 2.04 -0.65 -1.37 117.51 117.58 2k9a h ILE 32 Ca -0.14 -0.47 0.00 0.00 1.00 0.00 0.00 64.86 65.25 2k9a h ILE 32 Cb 1.76 1.18 0.00 0.00 -0.74 0.00 0.00 36.82 39.02 2k9a h ILE 32 CO 0.21 0.14 0.00 0.23 0.00 0.00 0.00 178.15 178.73 2k9a n MET 33 N -4.38 3.38 -2.85 2.37 2.81 -0.89 -4.73 117.12 112.84 2k9a n MET 33 Ca -0.02 -2.76 -0.40 0.00 -1.81 0.00 0.00 57.70 52.71 2k9a n MET 33 Cb 0.20 -1.79 -0.06 0.00 -0.71 0.00 0.00 33.22 30.86 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 -0.92 7.52 0.16 7.83 2.15 -0.52 -4.97 116.67 127.92 2k9a s ASP 34 Ca 0.50 1.79 -0.15 0.00 0.43 0.00 0.00 52.55 55.12 2k9a s ASP 34 Cb 0.30 -2.56 0.09 0.00 -0.30 0.00 0.00 42.92 40.46 2k9a s ASP 34 CO 0.27 0.16 1.74 0.44 -0.17 0.00 0.00 175.17 177.61 2k9a h ASP 35 N 4.37 0.10 0.00 -0.34 5.19 -1.91 -0.62 116.42 123.21 2k9a h ASP 35 Ca -0.46 0.05 -0.00 0.00 -0.62 0.00 0.00 57.03 56.01 2k9a h ASP 35 Cb 1.20 0.05 -0.00 0.00 0.18 0.00 0.00 39.33 40.76 2k9a h ASP 35 CO 0.68 0.09 -0.00 -0.08 -3.12 0.00 0.00 179.24 176.81 2k9a h GLU 36 N 0.27 0.00 0.10 3.56 4.81 -1.93 -1.75 114.58 119.63 2k9a h GLU 36 Ca 0.18 0.00 -0.27 0.00 -0.13 0.00 0.00 59.36 59.14 2k9a h GLU 36 Cb 0.19 0.00 0.02 0.00 0.63 0.00 0.00 28.75 29.58 2k9a h GLU 36 CO -0.21 0.00 -1.17 0.35 -0.73 0.00 0.00 179.01 177.25 2k9a h PHE 37 N 0.00 0.75 -0.55 0.92 3.57 -1.40 -2.54 116.94 117.70 2k9a h PHE 37 Ca -0.00 -0.48 -0.04 0.00 3.53 0.00 0.00 57.97 60.98 2k9a h PHE 37 Cb 0.00 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.66 2k9a h PHE 37 CO 0.00 1.33 0.17 1.96 -2.23 0.00 0.00 178.31 179.54 2k9a h GLN 38 N 0.20 0.85 -0.14 1.11 1.08 -0.41 -0.33 115.11 117.47 2k9a h GLN 38 Ca -0.15 -0.18 -0.05 0.00 -1.45 0.00 0.00 58.65 56.82 2k9a h GLN 38 Cb 1.85 -0.12 -0.00 0.00 -0.05 0.00 0.00 27.48 29.15 2k9a h GLN 38 CO 0.21 0.78 -0.12 1.25 -0.95 0.00 0.00 178.83 179.99 2k9a h LEU 39 N 0.76 0.35 -0.02 1.46 6.46 -1.52 -2.23 115.31 120.57 2k9a h LEU 39 Ca 0.18 -0.47 -0.00 0.00 -0.12 0.00 0.00 57.88 57.47 2k9a h LEU 39 Cb 0.28 -0.10 -0.00 0.00 -0.73 0.00 0.00 40.66 40.11 2k9a h LEU 39 CO -0.01 0.75 0.01 0.25 -0.62 0.00 0.00 178.44 178.83 2k9a h LEU 40 N -0.03 0.03 -0.22 2.25 6.46 -1.40 0.12 115.31 122.52 2k9a h LEU 40 Ca 0.02 -0.09 0.01 0.00 -0.12 0.00 0.00 57.88 57.71 2k9a h LEU 40 Cb 0.64 -0.01 -0.01 0.00 -0.73 0.00 0.00 40.66 40.55 2k9a h LEU 40 CO 0.03 0.11 0.13 -0.61 -0.62 0.00 0.00 178.44 177.48 2k9a h GLN 41 N -0.05 0.26 -0.11 1.25 4.15 -1.12 -2.53 115.11 116.96 2k9a h GLN 41 Ca 0.01 -0.02 -0.11 0.00 0.77 0.00 0.00 58.65 59.30 2k9a h GLN 41 Cb 0.09 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 27.70 2k9a h GLN 41 CO -0.00 0.17 -0.42 -0.09 -1.93 0.00 0.00 178.83 176.57 2k9a h ARG 42 N 0.27 0.24 -0.15 1.69 2.43 -1.34 -1.25 114.38 116.28 2k9a h ARG 42 Ca 0.09 -0.12 -0.00 0.00 -0.81 0.00 0.00 59.98 59.14 2k9a h ARG 42 Cb -0.01 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 2k9a h ARG 42 CO -0.04 0.62 0.09 -0.97 -1.51 0.00 0.00 179.97 178.16 2k9a h ASN 43 N 0.20 0.19 0.10 -3.80 -0.73 -0.41 -1.50 115.58 109.63 2k9a h ASN 43 Ca 0.02 -0.07 -0.24 0.00 1.87 0.00 0.00 56.30 57.88 2k9a h ASN 43 Cb 0.83 -0.05 0.02 0.00 0.27 0.00 0.00 38.32 39.39 2k9a h ASN 43 CO 0.06 0.20 -0.98 -0.26 -0.37 0.00 0.00 177.43 176.08 2k9a h PHE 44 N 0.16 0.79 -0.02 0.67 -1.00 -1.45 -3.25 116.94 112.84 2k9a h PHE 44 Ca 0.05 -0.50 0.01 0.00 2.81 0.00 0.00 57.97 60.33 2k9a h PHE 44 Cb 0.05 -0.06 -0.00 0.00 3.61 0.00 0.00 35.95 39.55 2k9a h PHE 44 CO -0.05 1.36 0.02 0.00 -1.61 0.00 0.00 178.31 178.03 2k9a h MET 45 N -0.00 0.00 -0.12 1.51 -0.00 -1.23 -0.85 114.93 114.23 2k9a h MET 45 Ca -0.15 0.00 -0.01 0.00 -0.00 0.00 0.00 59.70 59.54 2k9a h MET 45 Cb 1.71 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 33.30 2k9a h MET 45 CO 0.19 0.00 0.02 0.22 -0.00 0.00 0.00 176.91 177.34 2k9a h ASP 46 N 0.00 0.15 0.12 -0.10 1.82 -1.30 -1.47 116.42 115.64 2k9a h ASP 46 Ca 0.01 -0.01 -0.37 0.00 -0.39 0.00 0.00 57.03 56.27 2k9a h ASP 46 Cb 0.04 -0.04 -0.02 0.00 0.68 0.00 0.00 39.33 39.99 2k9a h ASP 46 CO -0.00 0.17 -2.04 0.29 -1.61 0.00 0.00 179.24 176.05 2k9a n LYS 47 N -4.46 0.75 0.24 0.28 4.76 -0.39 -4.12 118.16 115.22 2k9a n LYS 47 Ca -0.01 0.25 -0.15 0.00 -2.87 0.00 0.00 58.31 55.53 2k9a n LYS 47 Cb 0.13 -1.69 -0.08 0.00 -1.84 0.00 0.00 35.03 31.55 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 0.06 -0.73 0.00 2.13 -1.99 -1.17 -1.90 116.97 113.37 2k9a h TYR 48 Ca -0.44 -0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.29 2k9a h TYR 48 Cb 2.02 0.27 0.00 0.00 2.00 0.00 0.00 36.73 41.02 2k9a h TYR 48 CO 0.07 -0.42 0.13 0.10 -0.00 0.00 0.00 178.16 178.04 2k9a h TYR 49 N -0.66 0.00 0.00 4.88 -0.00 -1.48 -0.86 116.97 118.85 2k9a h TYR 49 Ca -0.04 0.00 -0.00 0.00 -0.00 0.00 0.00 58.73 58.69 2k9a h TYR 49 Cb 0.56 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.29 2k9a h TYR 49 CO -0.12 0.00 -0.01 -0.07 -0.00 0.00 0.00 178.16 177.96 2k9a h LEU 50 N 0.00 0.01 -0.76 0.10 3.38 -1.51 -3.33 115.31 113.20 2k9a h LEU 50 Ca 0.00 -0.85 -0.13 0.00 0.09 0.00 0.00 57.88 56.99 2k9a h LEU 50 Cb 0.26 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 2k9a h LEU 50 CO 0.00 0.86 -0.46 -0.33 0.09 0.00 0.00 178.44 178.60 2k9a h GLU 51 N -0.84 0.37 -5.97 1.13 5.08 -1.03 -3.38 114.58 109.93 2k9a h GLU 51 Ca -0.00 -0.20 -0.56 0.00 -1.00 0.00 0.00 59.36 57.60 2k9a h GLU 51 Cb 0.86 0.01 -0.09 0.00 0.50 0.00 0.00 28.75 30.03 2k9a h GLU 51 CO 0.00 0.76 1.50 -0.06 -1.00 0.00 0.00 179.01 180.21 2k9a s PHE 52 N -4.08 2.44 0.15 4.33 0.40 -0.40 -4.96 117.98 115.85 2k9a s PHE 52 Ca -0.06 -0.71 0.04 0.00 -0.60 0.00 0.00 56.93 55.61 2k9a s PHE 52 Cb 0.13 -4.58 -0.04 0.00 0.51 0.00 0.00 43.02 39.04 2k9a s PHE 52 CO 0.80 -1.85 0.17 -1.83 0.70 0.00 0.00 175.22 173.21 2k9a s GLU 53 N 5.21 3.05 -0.70 0.44 -1.05 -1.26 -4.85 118.70 119.55 2k9a s GLU 53 Ca 0.52 -0.77 -0.27 0.00 -0.15 0.00 0.00 54.97 54.31 2k9a s GLU 53 Cb -0.00 -2.75 0.01 0.00 -0.44 0.00 0.00 34.13 30.95 2k9a s GLU 53 CO -0.04 0.51 1.56 0.34 0.95 0.00 0.00 175.26 178.58 2k9a s ASP 54 N -3.05 5.74 0.12 0.83 2.15 -1.26 -4.95 116.67 116.26 2k9a s ASP 54 Ca 0.32 -0.14 -0.03 0.00 0.43 0.00 0.00 52.55 53.13 2k9a s ASP 54 Cb -0.11 -2.55 -0.03 0.00 -0.30 0.00 0.00 42.92 39.94 2k9a s ASP 54 CO 0.25 -2.10 0.09 0.42 -0.17 0.00 0.00 175.17 173.66 2k9a s THR 55 N 7.34 0.12 -2.60 1.71 -4.23 -1.26 -5.04 115.64 111.67 2k9a s THR 55 Ca 0.51 -1.76 0.25 0.00 -1.18 0.00 0.00 61.69 59.51 2k9a s THR 55 Cb -0.10 -1.89 0.43 0.00 1.34 0.00 0.00 72.50 72.28 2k9a s THR 55 CO 0.16 -0.52 1.56 -1.84 -0.54 0.00 0.00 174.62 173.44 2k9a n GLU 56 N -0.08 1.92 -5.17 3.99 0.28 -1.26 -4.86 120.64 115.45 2k9a n GLU 56 Ca -0.08 -1.34 -0.32 0.00 -0.16 0.00 0.00 57.16 55.26 2k9a n GLU 56 Cb 0.63 -1.46 -0.16 0.00 1.43 0.00 0.00 31.44 31.88 2k9a n GLU 56 CO 0.00 0.00 0.00 -2.00 -0.16 0.00 0.00 177.13 174.97 2k9a s GLU 57 N -1.93 2.70 0.11 3.44 2.12 -1.26 -5.13 118.70 118.74 2k9a s GLU 57 Ca 0.35 -0.86 0.03 0.00 0.36 0.00 0.00 54.97 54.85 2k9a s GLU 57 Cb 0.20 -2.25 -0.04 0.00 0.26 0.00 0.00 34.13 32.30 2k9a s GLU 57 CO 0.31 0.36 0.11 -0.80 -0.54 0.00 0.00 175.26 174.71 2k9a s ASN 58 N -0.10 5.61 0.41 -1.70 0.01 -1.26 -5.11 114.94 112.80 2k9a s ASN 58 Ca -0.05 -0.02 0.07 0.00 -0.71 0.00 0.00 52.86 52.15 2k9a s ASN 58 Cb -0.14 -1.52 -0.07 0.00 0.41 0.00 0.00 41.25 39.93 2k9a s ASN 58 CO 0.04 0.14 0.06 -0.54 -1.51 0.00 0.00 177.10 175.29 2k9a s LYS 59 N -2.65 2.04 0.07 -0.60 1.02 -1.26 -5.03 119.74 113.33 2k9a s LYS 59 Ca 0.30 -2.04 0.28 0.00 0.02 0.00 0.00 55.97 54.53 2k9a s LYS 59 Cb -0.12 -1.73 1.07 0.00 -0.52 0.00 0.00 37.83 36.53 2k9a s LYS 59 CO 0.23 -0.08 1.86 1.28 -0.92 0.00 0.00 175.35 177.73 2k9a n LEU 60 N -1.05 0.30 0.20 3.17 7.99 -1.26 -3.36 117.00 122.99 2k9a n LEU 60 Ca -0.04 0.52 0.14 0.00 -0.01 0.00 0.00 56.01 56.62 2k9a n LEU 60 Cb 0.66 -0.43 0.60 0.00 -0.11 0.00 0.00 43.42 44.14 2k9a n LEU 60 CO 0.48 -0.06 0.92 -0.29 -1.51 0.00 0.00 177.39 176.93 2k9a h ILE 61 N 0.00 0.00 0.00 -0.08 6.09 -2.02 -2.63 117.51 118.87 2k9a h ILE 61 Ca 0.00 -0.33 -0.02 0.00 -1.37 0.00 0.00 64.86 63.14 2k9a h ILE 61 Cb 0.59 1.17 -0.00 0.00 0.47 0.00 0.00 36.82 39.04 2k9a h ILE 61 CO 0.00 0.00 -0.08 1.88 -3.07 0.00 0.00 178.15 176.88 2k9a h TYR 62 N 0.00 0.00 0.07 2.19 -1.99 -1.99 -2.86 116.97 112.39 2k9a h TYR 62 Ca 0.00 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.73 2k9a h TYR 62 Cb 0.40 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.13 2k9a h TYR 62 CO 0.00 0.08 -0.03 1.15 -0.00 0.00 0.00 178.16 179.36 2k9a h THR 63 N 0.00 1.18 -0.56 -2.88 2.02 -1.72 -2.53 112.91 108.42 2k9a h THR 63 Ca -0.00 -1.49 -0.01 0.00 0.77 0.00 0.00 66.41 65.68 2k9a h THR 63 Cb 0.63 2.06 -0.03 0.00 -1.74 0.00 0.00 68.15 69.07 2k9a h THR 63 CO 0.01 0.34 0.29 -0.65 0.37 0.00 0.00 175.52 175.88 2k9a h PRO 64 N -0.84 0.79 -0.50 6.66 0.11 -1.71 -1.93 132.00 134.59 2k9a h PRO 64 Ca -0.01 -0.10 0.01 0.00 0.11 0.00 0.00 66.00 66.01 2k9a h PRO 64 Cb 0.62 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 31.55 2k9a h PRO 64 CO 0.02 0.62 0.32 0.82 -0.21 0.00 0.00 178.00 179.57 2k9a h ILE 65 N 0.76 1.10 -0.89 4.15 2.04 -1.63 -1.73 117.51 121.31 2k9a h ILE 65 Ca 0.20 -0.22 -0.00 0.00 1.00 0.00 0.00 64.86 65.83 2k9a h ILE 65 Cb 0.07 0.40 -0.04 0.00 -0.74 0.00 0.00 36.82 36.51 2k9a h ILE 65 CO -0.03 0.12 0.55 0.15 0.00 0.00 0.00 178.15 178.94 2k9a h PHE 66 N 0.64 1.16 0.00 1.37 3.57 -1.23 -1.43 116.94 121.01 2k9a h PHE 66 Ca 0.19 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.65 2k9a h PHE 66 Cb -0.04 -0.38 -0.01 0.00 2.79 0.00 0.00 35.95 38.31 2k9a h PHE 66 CO -0.05 0.76 -0.19 -0.91 -2.23 0.00 0.00 178.31 175.69 2k9a h ASN 67 N 1.22 0.00 -0.03 0.41 2.35 -0.85 -2.10 115.58 116.59 2k9a h ASN 67 Ca 0.32 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 55.89 2k9a h ASN 67 Cb -0.08 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.29 2k9a h ASN 67 CO -0.06 0.19 -0.63 -0.08 -1.65 0.00 0.00 177.43 175.19 2k9a h GLU 68 N 0.00 0.65 -0.32 0.81 4.81 -0.39 -0.95 114.58 119.18 2k9a h GLU 68 Ca -0.00 -0.45 -0.16 0.00 -0.13 0.00 0.00 59.36 58.61 2k9a h GLU 68 Cb 0.41 0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.86 2k9a h GLU 68 CO 0.02 1.07 -0.44 -0.92 -0.73 0.00 0.00 179.01 178.02 2k9a h TYR 69 N 0.47 1.02 0.00 0.92 3.20 -0.99 0.06 116.97 121.65 2k9a h TYR 69 Ca -0.01 -0.32 -0.13 0.00 3.14 0.00 0.00 58.73 61.40 2k9a h TYR 69 Cb 1.21 -0.21 -0.02 0.00 1.54 0.00 0.00 36.73 39.26 2k9a h TYR 69 CO 0.06 1.13 -0.63 0.82 -1.64 0.00 0.00 178.16 177.89 2k9a h ILE 70 N 0.67 1.37 0.12 1.81 1.08 -1.38 -0.79 117.51 120.39 2k9a h ILE 70 Ca 0.04 -2.22 -0.31 0.00 -0.39 0.00 0.00 64.86 61.99 2k9a h ILE 70 Cb 1.02 2.22 -0.01 0.00 -3.07 0.00 0.00 36.82 36.99 2k9a h ILE 70 CO 0.10 0.62 -1.52 -1.28 -0.69 0.00 0.00 178.15 175.38 2k9a h SER 71 N 0.00 0.40 0.00 1.72 0.87 -1.08 -3.27 113.55 112.19 2k9a h SER 71 Ca -0.01 -0.54 0.00 0.00 -1.23 0.00 0.00 61.79 60.01 2k9a h SER 71 Cb 1.17 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 63.00 2k9a h SER 71 CO 0.08 1.45 -0.37 0.25 -0.53 0.00 0.00 176.83 177.71 2k9a h LEU 72 N 0.07 0.00 0.69 2.23 5.85 -1.02 -3.35 115.31 119.78 2k9a h LEU 72 Ca -0.24 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.45 2k9a h LEU 72 Cb 2.02 0.00 0.01 0.00 0.37 0.00 0.00 40.66 43.05 2k9a h LEU 72 CO 0.16 0.59 -0.33 0.58 -0.34 0.00 0.00 178.44 179.10 2k9a h VAL 73 N -0.81 0.08 -0.66 1.05 2.07 -1.32 0.71 116.25 117.37 2k9a h VAL 73 Ca 0.00 -0.30 0.12 0.00 0.82 0.00 0.00 66.70 67.34 2k9a h VAL 73 Cb 0.37 0.10 -0.09 0.00 -1.52 0.00 0.00 31.29 30.16 2k9a h VAL 73 CO 0.00 0.01 0.20 -0.08 0.02 0.00 0.00 177.57 177.72 2k9a h GLU 74 N -1.21 0.33 0.00 1.57 4.81 -1.57 0.14 114.58 118.66 2k9a h GLU 74 Ca -0.09 -0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.05 2k9a h GLU 74 Cb 0.73 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.02 2k9a h GLU 74 CO 0.16 0.22 -0.33 0.87 -0.73 0.00 0.00 179.01 179.20 2k9a h LYS 75 N 0.34 0.00 -0.34 1.92 1.57 -1.60 -2.82 116.57 115.63 2k9a h LYS 75 Ca 0.35 0.00 0.01 0.00 -1.87 0.00 0.00 60.65 59.14 2k9a h LYS 75 Cb 0.51 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.80 2k9a h LYS 75 CO -0.39 0.33 0.21 -0.92 -0.57 0.00 0.00 179.45 178.10 2k9a h TYR 76 N 0.00 0.39 -0.11 -1.35 3.20 0.18 -0.01 116.97 119.27 2k9a h TYR 76 Ca -0.00 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.82 2k9a h TYR 76 Cb 0.86 -0.13 -0.00 0.00 1.54 0.00 0.00 36.73 39.00 2k9a h TYR 76 CO 0.00 0.24 -0.15 0.82 -1.64 0.00 0.00 178.16 177.42 2k9a h ILE 77 N 0.43 1.38 -0.11 1.81 2.04 -1.42 -2.75 117.51 118.89 2k9a h ILE 77 Ca 0.13 -1.38 0.03 0.00 1.00 0.00 0.00 64.86 64.64 2k9a h ILE 77 Cb -0.02 2.04 -0.03 0.00 -0.74 0.00 0.00 36.82 38.07 2k9a h ILE 77 CO -0.05 0.40 -0.08 -0.08 0.00 0.00 0.00 178.15 178.33 2k9a h GLU 78 N -0.13 -0.09 -0.12 2.37 4.81 -1.38 -1.50 114.58 118.53 2k9a h GLU 78 Ca 0.01 0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.25 2k9a h GLU 78 Cb 0.71 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.10 2k9a h GLU 78 CO 0.04 -0.06 0.06 0.93 -0.73 0.00 0.00 179.01 179.25 2k9a h GLU 79 N -0.09 0.13 -0.39 1.92 4.39 -1.07 -0.07 114.58 119.39 2k9a h GLU 79 Ca 0.07 -0.01 0.05 0.00 0.34 0.00 0.00 59.36 59.81 2k9a h GLU 79 Cb 0.20 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 28.80 2k9a h GLU 79 CO -0.17 0.09 0.26 1.96 -1.16 0.00 0.00 179.01 179.99 2k9a h GLN 80 N 0.13 0.33 0.05 2.33 1.08 -1.29 -1.36 115.11 116.38 2k9a h GLN 80 Ca 0.05 -0.02 -0.24 0.00 -1.45 0.00 0.00 58.65 56.99 2k9a h GLN 80 Cb 0.00 -0.07 -0.00 0.00 -0.05 0.00 0.00 27.48 27.36 2k9a h GLN 80 CO -0.03 0.22 -1.03 -0.07 -0.95 0.00 0.00 178.83 176.96 2k9a h LEU 81 N 0.34 0.41 -1.63 1.46 3.38 -0.69 -3.19 115.31 115.39 2k9a h LEU 81 Ca 0.17 -0.37 -0.04 0.00 0.09 0.00 0.00 57.88 57.73 2k9a h LEU 81 Cb 0.24 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 2k9a h LEU 81 CO -0.04 1.21 -0.17 -0.07 0.09 0.00 0.00 178.44 179.46 2k9a h LEU 82 N 0.14 0.00 -2.22 1.67 3.38 0.06 -0.89 115.31 117.46 2k9a h LEU 82 Ca -0.09 0.00 0.04 0.00 0.09 0.00 0.00 57.88 57.93 2k9a h LEU 82 Cb 1.71 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.45 2k9a h LEU 82 CO 0.17 0.17 0.26 1.56 0.09 0.00 0.00 178.44 180.69 2k9a h GLN 83 N 0.00 0.00 0.00 1.13 1.08 -1.37 -2.69 115.11 113.26 2k9a h GLN 83 Ca -0.00 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.18 2k9a h GLN 83 Cb 0.48 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.91 2k9a h GLN 83 CO 0.02 0.00 -1.07 0.54 -0.95 0.00 0.00 178.83 177.37 2k9a n ARG 84 N -3.42 2.88 -3.75 1.46 1.74 -0.98 -4.91 116.66 109.67 2k9a n ARG 84 Ca 0.01 -0.00 -0.29 0.00 -0.77 0.00 0.00 57.85 56.80 2k9a n ARG 84 Cb 0.36 -1.03 -0.13 0.00 -1.02 0.00 0.00 32.46 30.65 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 -2.04 1.72 -1.36 0.55 1.01 -0.37 -4.95 121.20 115.75 2k9a s ILE 85 Ca -0.01 -2.94 0.14 0.00 0.00 0.00 0.00 60.65 57.85 2k9a s ILE 85 Cb 0.00 -2.18 0.23 0.00 0.01 0.00 0.00 42.46 40.52 2k9a s ILE 85 CO 0.05 -0.93 1.39 -0.81 0.00 0.00 0.00 174.94 174.64 2k9a n PRO 86 N 3.19 0.17 -0.28 2.79 -0.04 -1.15 -1.92 135.00 137.75 2k9a n PRO 86 Ca 0.11 0.17 0.08 0.00 -0.04 0.00 0.00 63.50 63.82 2k9a n PRO 86 Cb 0.35 -1.50 0.19 0.00 -0.04 0.00 0.00 33.50 32.51 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 -1.32 2.61 -2.47 0.54 -0.58 -1.26 -5.03 120.64 113.12 2k9a n GLU 87 Ca 0.06 -2.52 -0.36 0.00 -0.42 0.00 0.00 57.16 53.92 2k9a n GLU 87 Cb 0.12 -1.60 -0.03 0.00 -0.57 0.00 0.00 31.44 29.37 2k9a n GLU 87 CO 0.00 0.00 0.00 0.12 -0.48 0.00 0.00 177.13 176.77 2k9a s PHE 88 N -2.32 3.05 -0.51 -0.32 5.36 -0.81 -5.02 117.98 117.40 2k9a s PHE 88 Ca 0.33 1.59 0.01 0.00 -0.96 0.00 0.00 56.93 57.90 2k9a s PHE 88 Cb 0.26 -3.16 0.13 0.00 -0.34 0.00 0.00 43.02 39.91 2k9a s PHE 88 CO 0.08 -0.93 0.28 0.54 -1.46 0.00 0.00 175.22 173.73 2k9a s ASN 89 N -1.71 4.81 0.38 6.13 4.22 -1.26 -4.95 114.94 122.57 2k9a s ASN 89 Ca 0.64 -2.71 0.10 0.00 -2.14 0.00 0.00 52.86 48.75 2k9a s ASN 89 Cb -0.21 -1.73 0.77 0.00 1.28 0.00 0.00 41.25 41.35 2k9a s ASN 89 CO 0.26 -0.34 1.89 -0.03 -2.04 0.00 0.00 177.10 176.84 2k9a h MET 90 N 7.04 0.19 -0.13 3.55 4.05 -1.97 -1.00 114.93 126.67 2k9a h MET 90 Ca -0.06 -0.05 -0.13 0.00 -0.28 0.00 0.00 59.70 59.18 2k9a h MET 90 Cb 0.95 -0.02 0.00 0.00 -0.80 0.00 0.00 31.60 31.73 2k9a h MET 90 CO 0.67 0.38 -0.43 0.00 0.23 0.00 0.00 176.91 177.77 2k9a h ALA 91 N 1.63 0.23 -0.08 0.39 0.00 -2.00 -2.56 119.26 116.87 2k9a h ALA 91 Ca 0.03 -0.47 -0.16 0.00 0.00 0.00 0.00 54.91 54.31 2k9a h ALA 91 Cb 0.44 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2k9a h ALA 91 CO 0.03 0.35 -0.65 0.00 0.00 0.00 0.00 179.25 178.98 2k9a h ALA 92 N 0.52 0.74 -0.31 0.00 0.00 -1.95 -2.74 119.26 115.52 2k9a h ALA 92 Ca -0.02 -0.57 -0.09 0.00 0.00 0.00 0.00 54.91 54.24 2k9a h ALA 92 Cb 1.05 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 2k9a h ALA 92 CO 0.09 0.75 -0.15 0.35 0.00 0.00 0.00 179.25 180.29 2k9a h PHE 93 N 0.23 0.75 -0.21 0.00 3.57 -1.23 -2.53 116.94 117.51 2k9a h PHE 93 Ca -0.01 -0.19 -0.01 0.00 3.53 0.00 0.00 57.97 61.29 2k9a h PHE 93 Cb 1.19 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 39.75 2k9a h PHE 93 CO 0.03 0.87 0.08 1.79 -2.23 0.00 0.00 178.31 178.85 2k9a h THR 94 N 0.41 1.18 -1.00 4.41 1.35 -1.47 0.15 112.91 117.94 2k9a h THR 94 Ca 0.07 -0.54 0.06 0.00 -0.55 0.00 0.00 66.41 65.45 2k9a h THR 94 Cb 0.68 1.14 -0.06 0.00 -1.73 0.00 0.00 68.15 68.17 2k9a h THR 94 CO 0.05 0.17 0.65 0.74 -0.25 0.00 0.00 175.52 176.87 2k9a h THR 95 N 0.18 1.11 0.00 6.82 2.02 -1.50 -1.31 112.91 120.23 2k9a h THR 95 Ca 0.07 -0.41 -0.16 0.00 0.77 0.00 0.00 66.41 66.68 2k9a h THR 95 Cb 0.20 -0.19 -0.02 0.00 -1.74 0.00 0.00 68.15 66.40 2k9a h THR 95 CO -0.00 0.22 -0.75 0.74 0.37 0.00 0.00 175.52 176.09 2k9a h THR 96 N 1.19 1.47 -0.64 3.16 2.02 -1.25 -3.23 112.91 115.64 2k9a h THR 96 Ca 0.42 -2.65 -0.05 0.00 0.77 0.00 0.00 66.41 64.90 2k9a h THR 96 Cb 0.12 2.45 -0.03 0.00 -1.74 0.00 0.00 68.15 68.95 2k9a h THR 96 CO -0.16 0.74 0.18 0.25 0.37 0.00 0.00 175.52 176.90 2k9a h LEU 97 N 0.00 0.91 -1.08 2.58 6.46 0.43 -1.19 115.31 123.43 2k9a h LEU 97 Ca -0.01 -0.17 0.12 0.00 -0.12 0.00 0.00 57.88 57.71 2k9a h LEU 97 Cb 1.39 -0.24 -0.08 0.00 -0.73 0.00 0.00 40.66 41.00 2k9a h LEU 97 CO 0.10 0.87 0.62 1.56 -0.62 0.00 0.00 178.44 180.96 2k9a h GLN 98 N 0.94 0.90 0.08 1.25 4.20 -1.41 0.19 115.11 121.26 2k9a h GLN 98 Ca 0.21 -0.05 -0.22 0.00 0.06 0.00 0.00 58.65 58.64 2k9a h GLN 98 Cb 0.29 -0.20 0.02 0.00 0.30 0.00 0.00 27.48 27.89 2k9a h GLN 98 CO -0.01 0.60 -0.92 1.25 -0.67 0.00 0.00 178.83 179.08 2k9a h HIS 99 N 0.93 0.78 0.00 2.96 2.76 -1.60 -3.15 115.15 117.83 2k9a h HIS 99 Ca 0.48 -0.48 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 2k9a h HIS 99 Cb 0.53 -0.07 0.00 0.00 1.55 0.00 0.00 27.41 29.42 2k9a h HIS 99 CO -0.00 1.33 0.00 0.72 -1.30 0.00 0.00 177.93 178.67 2k9a n HIS 100 N -4.02 0.00 0.32 5.26 8.25 -0.49 -2.66 115.22 121.88 2k9a n HIS 100 Ca -0.12 0.00 0.20 0.00 -0.26 0.00 0.00 57.72 57.54 2k9a n HIS 100 Cb 0.84 -0.16 1.08 0.00 1.12 0.00 0.00 29.99 32.86 2k9a n HIS 100 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 2k9a h LYS 101 N 0.00 0.00 0.00 -0.41 3.64 -0.62 0.88 116.57 120.06 2k9a h LYS 101 Ca 0.00 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.34 2k9a h LYS 101 Cb 0.08 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.90 2k9a h LYS 101 CO 0.00 0.01 -0.17 0.22 -2.27 0.00 0.00 179.45 177.24 2k9a h ASP 102 N 0.00 0.00 0.00 4.20 3.58 -1.75 -3.37 116.42 119.08 2k9a h ASP 102 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2k9a h ASP 102 Cb 0.07 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.12 2k9a h ASP 102 CO 0.00 0.17 -0.51 1.21 -2.88 0.00 0.00 179.24 177.23 2k9a n GLU 103 N -3.37 0.27 -0.66 0.28 0.00 0.03 -5.03 120.64 112.16 2k9a n GLU 103 Ca -0.00 0.11 -0.31 0.00 0.00 0.00 0.00 57.16 56.96 2k9a n GLU 103 Cb 0.38 -0.93 0.17 0.00 0.00 0.00 0.00 31.44 31.06 2k9a n GLU 103 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.13 178.68 2k9a n VAL 104 N -3.72 0.00 -1.57 6.31 3.14 0.09 -4.79 118.33 117.79 2k9a n VAL 104 Ca -0.07 -0.16 -0.42 0.00 -2.96 0.00 0.00 64.34 60.73 2k9a n VAL 104 Cb 0.26 -0.87 -0.04 0.00 -1.06 0.00 0.00 33.84 32.14 2k9a n VAL 104 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2k9a n ALA 105 N -4.26 1.42 0.19 1.55 0.00 -1.26 -4.74 120.51 113.41 2k9a n ALA 105 Ca 0.08 -0.44 0.04 0.00 0.00 0.00 0.00 53.44 53.12 2k9a n ALA 105 Cb 0.54 -2.96 0.43 0.00 0.00 0.00 0.00 19.45 17.45 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 16.14 0.05 1.18 0.00 0.00 -1.87 -2.63 103.07 115.94 2k9a h GLY 106 Ca -0.34 -0.03 -0.02 0.00 0.00 0.00 0.00 47.33 46.93 2k9a h GLY 106 CO 1.03 0.03 0.37 -1.80 0.00 0.00 0.00 176.54 176.17 2k9a h ASP 107 N 0.04 0.96 -0.01 0.19 3.58 -1.94 0.15 116.42 119.38 2k9a h ASP 107 Ca 0.01 -0.10 -0.01 0.00 0.42 0.00 0.00 57.03 57.34 2k9a h ASP 107 Cb 0.45 -0.25 0.00 0.00 1.72 0.00 0.00 39.33 41.26 2k9a h ASP 107 CO 0.03 0.80 -0.04 0.40 -2.88 0.00 0.00 179.24 177.56 2k9a h ILE 108 N 1.06 1.46 0.00 2.25 2.04 -1.87 -3.18 117.51 119.27 2k9a h ILE 108 Ca 0.26 -1.42 -0.04 0.00 1.00 0.00 0.00 64.86 64.66 2k9a h ILE 108 Cb 0.09 2.39 -0.01 0.00 -0.74 0.00 0.00 36.82 38.55 2k9a h ILE 108 CO -0.04 0.38 -0.18 0.15 0.00 0.00 0.00 178.15 178.46 2k9a h PHE 109 N -0.52 0.00 -1.03 1.37 3.57 -1.40 -2.57 116.94 116.35 2k9a h PHE 109 Ca -0.00 0.00 0.28 0.00 3.53 0.00 0.00 57.97 61.78 2k9a h PHE 109 Cb 0.63 0.00 -0.07 0.00 2.79 0.00 0.00 35.95 39.30 2k9a h PHE 109 CO 0.13 0.18 0.70 0.22 -2.23 0.00 0.00 178.31 177.31 2k9a h ASP 110 N 0.00 0.24 -0.09 0.41 1.82 -0.67 0.28 116.42 118.41 2k9a h ASP 110 Ca -0.00 0.04 -0.10 0.00 -0.39 0.00 0.00 57.03 56.58 2k9a h ASP 110 Cb 0.33 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.35 2k9a h ASP 110 CO 0.02 0.06 -0.32 -0.03 -1.61 0.00 0.00 179.24 177.36 2k9a h MET 111 N 0.22 0.38 0.00 0.28 4.05 -1.58 -3.11 114.93 115.16 2k9a h MET 111 Ca 0.54 -0.29 -0.02 0.00 -0.28 0.00 0.00 59.70 59.66 2k9a h MET 111 Cb 1.70 0.05 -0.00 0.00 -0.80 0.00 0.00 31.60 32.55 2k9a h MET 111 CO -0.15 0.91 -0.08 -0.07 0.23 0.00 0.00 176.91 177.75 2k9a h LEU 112 N -0.07 0.00 -1.89 3.39 3.38 -0.69 -2.79 115.31 116.63 2k9a h LEU 112 Ca -0.01 0.00 0.21 0.00 0.09 0.00 0.00 57.88 58.16 2k9a h LEU 112 Cb 0.95 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.67 2k9a h LEU 112 CO 0.07 0.08 0.63 -0.07 0.09 0.00 0.00 178.44 179.24 2k9a h LEU 113 N 0.00 0.00 0.00 1.67 3.38 -0.63 0.22 115.31 119.95 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 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 2k9a h LEU 113 CO 0.01 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.89 2k9a n THR 114 N -3.89 0.05 0.02 0.22 -2.24 -1.05 -1.71 114.28 105.68 2k9a n THR 114 Ca 0.14 0.01 -0.00 0.00 -2.27 0.00 0.00 64.05 61.94 2k9a n THR 114 Cb 0.89 -1.01 0.30 0.00 -2.10 0.00 0.00 70.33 68.40 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 0.50 0.00 4.78 0.04 -1.22 -3.41 116.94 117.63 2k9a h PHE 115 Ca 0.00 -0.06 0.00 0.00 2.80 0.00 0.00 57.97 60.71 2k9a h PHE 115 Cb 0.00 -0.14 0.00 0.00 2.20 0.00 0.00 35.95 38.01 2k9a h PHE 115 CO 0.00 0.53 0.00 0.25 -0.60 0.00 0.00 178.31 178.49 2k9a n THR 116 N -4.26 0.00 -1.72 -1.55 -2.24 -0.94 -5.02 114.28 98.55 2k9a n THR 116 Ca 0.01 0.00 -0.18 0.00 -2.27 0.00 0.00 64.05 61.61 2k9a n THR 116 Cb 0.27 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 68.43 2k9a n THR 116 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2k9a s ASP 117 N -1.51 4.23 0.52 3.42 -1.08 -0.70 -4.75 116.67 116.80 2k9a s ASP 117 Ca 0.00 -0.28 0.17 0.00 -0.52 0.00 0.00 52.55 51.92 2k9a s ASP 117 Cb 0.00 -2.56 1.28 0.00 -1.46 0.00 0.00 42.92 40.18 2k9a s ASP 117 CO 0.00 -3.62 2.13 0.15 0.52 0.00 0.00 175.17 174.35 2k9a h PHE 118 N 12.12 0.00 -0.92 -5.34 3.04 -1.90 -1.67 116.94 122.28 2k9a h PHE 118 Ca 0.04 0.00 -0.01 0.00 3.98 0.00 0.00 57.97 61.98 2k9a h PHE 118 Cb 1.00 -0.00 -0.04 0.00 2.56 0.00 0.00 35.95 39.46 2k9a h PHE 118 CO 1.17 0.00 0.56 -0.07 -2.02 0.00 0.00 178.31 177.95 2k9a h LEU 119 N 0.00 1.11 -0.39 0.59 -0.00 -1.97 -1.60 115.31 113.05 2k9a h LEU 119 Ca 0.03 -0.07 -0.16 0.00 -0.00 0.00 0.00 57.88 57.68 2k9a h LEU 119 Cb 0.12 -0.28 -0.02 0.00 -0.00 0.00 0.00 40.66 40.47 2k9a h LEU 119 CO -0.00 0.85 -0.76 0.00 -0.00 0.00 0.00 178.44 178.53 2k9a h ALA 120 N 1.30 0.68 0.36 1.53 0.00 -1.69 -2.65 119.26 118.79 2k9a h ALA 120 Ca 0.33 -0.69 -0.02 0.00 0.00 0.00 0.00 54.91 54.53 2k9a h ALA 120 Cb -0.05 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.62 2k9a h ALA 120 CO -0.06 0.95 -0.17 0.35 0.00 0.00 0.00 179.25 180.32 2k9a h PHE 121 N 0.00 -0.44 -0.32 0.00 3.57 -0.88 0.07 116.94 118.94 2k9a h PHE 121 Ca -0.01 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.45 2k9a h PHE 121 Cb 1.39 0.15 -0.01 0.00 2.79 0.00 0.00 35.95 40.27 2k9a h PHE 121 CO 0.00 -0.15 0.08 -0.22 -2.23 0.00 0.00 178.31 175.79 2k9a h LYS 122 N -0.71 0.51 -0.09 1.11 3.11 -1.40 -2.74 116.57 116.36 2k9a h LYS 122 Ca -0.05 -0.12 -0.04 0.00 -2.81 0.00 0.00 60.65 57.63 2k9a h LYS 122 Cb 0.49 -0.07 -0.01 0.00 -1.00 0.00 0.00 32.23 31.64 2k9a h LYS 122 CO 0.08 0.57 -0.14 0.93 -2.81 0.00 0.00 179.45 178.08 2k9a h GLU 123 N 0.36 0.14 -0.22 1.90 4.39 -1.50 -2.64 114.58 117.00 2k9a h GLU 123 Ca 0.10 -0.03 -0.03 0.00 0.34 0.00 0.00 59.36 59.75 2k9a h GLU 123 Cb 0.29 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.91 2k9a h GLU 123 CO 0.00 0.29 0.03 1.98 -1.16 0.00 0.00 179.01 180.15 2k9a h MET 124 N 0.13 0.36 -0.08 2.33 4.05 -0.68 -1.41 114.93 119.63 2k9a h MET 124 Ca 0.03 -0.10 -0.00 0.00 -0.28 0.00 0.00 59.70 59.35 2k9a h MET 124 Cb 0.33 -0.04 -0.00 0.00 -0.80 0.00 0.00 31.60 31.09 2k9a h MET 124 CO 0.02 0.51 0.05 0.74 0.23 0.00 0.00 176.91 178.46 2k9a h PHE 125 N 0.16 0.11 -0.06 1.39 0.04 -1.26 -2.30 116.94 115.02 2k9a h PHE 125 Ca 0.07 -0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.82 2k9a h PHE 125 Cb 0.32 -0.04 -0.00 0.00 2.20 0.00 0.00 35.95 38.43 2k9a h PHE 125 CO 0.02 0.13 -0.03 -0.07 -0.60 0.00 0.00 178.31 177.76 2k9a h LEU 126 N 0.05 0.07 -0.17 1.54 4.07 -1.46 -2.34 115.31 117.09 2k9a h LEU 126 Ca 0.03 -0.01 -0.02 0.00 0.08 0.00 0.00 57.88 57.96 2k9a h LEU 126 Cb 0.06 -0.02 -0.01 0.00 1.08 0.00 0.00 40.66 41.77 2k9a h LEU 126 CO -0.00 0.12 0.01 -0.78 -1.08 0.00 0.00 178.44 176.71 2k9a h ASP 127 N 0.08 0.28 -0.31 -0.43 1.82 -0.79 -2.20 116.42 114.88 2k9a h ASP 127 Ca 0.02 -0.29 -0.01 0.00 -0.39 0.00 0.00 57.03 56.36 2k9a h ASP 127 Cb 0.12 -0.07 -0.02 0.00 0.68 0.00 0.00 39.33 40.04 2k9a h ASP 127 CO 0.01 0.50 0.17 0.22 -1.61 0.00 0.00 179.24 178.53 2k9a h TYR 128 N 0.05 0.45 -0.34 0.28 3.20 -0.97 -2.34 116.97 117.31 2k9a h TYR 128 Ca 0.05 -0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.85 2k9a h TYR 128 Cb 0.35 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.46 2k9a h TYR 128 CO 0.03 0.33 -0.03 -0.09 -1.64 0.00 0.00 178.16 176.75 2k9a h ARG 129 N 0.47 0.62 -0.79 1.82 2.43 -1.20 -2.98 114.38 114.74 2k9a h ARG 129 Ca 0.12 -0.21 0.02 0.00 -0.81 0.00 0.00 59.98 59.09 2k9a h ARG 129 Cb 0.04 -0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 29.50 2k9a h ARG 129 CO -0.02 0.76 0.52 0.00 -1.51 0.00 0.00 179.97 179.73 2k9a h ALA 130 N 0.83 1.46 -0.39 2.80 0.00 -0.88 -1.61 119.26 121.48 2k9a h ALA 130 Ca 0.09 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2k9a h ALA 130 Cb 0.51 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2k9a h ALA 130 CO 0.02 0.49 0.21 0.93 0.00 0.00 0.00 179.25 180.90 2k9a h GLU 131 N 1.04 0.53 0.00 0.00 4.39 -1.32 -1.47 114.58 117.75 2k9a h GLU 131 Ca 0.30 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.94 2k9a h GLU 131 Cb -0.08 -0.11 -0.00 0.00 -0.10 0.00 0.00 28.75 28.46 2k9a h GLU 131 CO -0.07 0.39 -0.05 0.87 -1.16 0.00 0.00 179.01 178.99 2k9a h LYS 132 N 0.54 0.00 0.00 2.33 1.79 -1.19 -1.50 116.57 118.54 2k9a h LYS 132 Ca 0.14 0.00 -0.21 0.00 -2.18 0.00 0.00 60.65 58.40 2k9a h LYS 132 Cb 0.02 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.64 2k9a h LYS 132 CO -0.02 0.05 -1.05 0.93 -1.08 0.00 0.00 179.45 178.27 2k9a h GLU 133 N 0.00 0.00 0.00 3.15 4.39 -1.30 -3.48 114.58 117.34 2k9a h GLU 133 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2k9a h GLU 133 Cb 0.13 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.78 2k9a h GLU 133 CO 0.01 0.88 0.00 0.41 -1.16 0.00 0.00 179.01 179.15 2k9a n GLY 134 N 1.37 2.90 3.52 -3.84 0.00 -0.56 -5.00 105.19 103.57 2k9a n GLY 134 Ca -0.02 -0.05 -0.41 0.00 0.00 0.00 0.00 46.02 45.54 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 0.00 3.44 0.00 1.61 3.52 -1.26 -5.01 118.95 121.25 2k9a s ARG 135 Ca 0.00 -0.60 0.00 0.00 -0.13 0.00 0.00 55.73 55.00 2k9a s ARG 135 Cb 0.00 -3.83 0.00 0.00 -1.56 0.00 0.00 34.95 29.56 2k9a s ARG 135 CO 0.00 -0.53 0.00 0.41 -0.81 0.00 0.00 175.30 174.37