#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 1.87 -1.09 6.12 5.68 -1.26 -4.66 116.55 123.21 2k9a n ASP 2 Ca 0.00 -1.81 -0.14 0.00 -0.50 0.00 0.00 54.79 52.35 2k9a n ASP 2 Cb 0.00 0.01 -0.06 0.00 -1.14 0.00 0.00 41.12 39.93 2k9a n ASP 2 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2k9a n ALA 3 N -2.49 -0.21 0.00 2.12 0.00 -1.26 -4.67 120.51 113.99 2k9a n ALA 3 Ca -0.07 0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.59 2k9a n ALA 3 Cb 0.26 -1.83 0.00 0.00 0.00 0.00 0.00 19.45 17.88 2k9a n ALA 3 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2k9a n LEU 4 N -1.61 0.85 -3.45 0.00 7.94 -1.26 -5.04 117.00 114.43 2k9a n LEU 4 Ca -0.14 0.00 -0.12 0.00 -1.11 0.00 0.00 56.01 54.64 2k9a n LEU 4 Cb 0.61 0.00 -0.10 0.00 0.53 0.00 0.00 43.42 44.46 2k9a n LEU 4 CO 0.21 0.14 -0.10 -0.70 -1.11 0.00 0.00 177.39 175.83 2k9a s GLU 5 N -1.61 0.28 0.00 1.96 2.56 -1.26 -5.14 118.70 115.48 2k9a s GLU 5 Ca 0.00 0.50 0.00 0.00 0.00 0.00 0.00 54.97 55.47 2k9a s GLU 5 Cb 0.00 -0.57 0.00 0.00 2.00 0.00 0.00 34.13 35.56 2k9a s GLU 5 CO 0.00 -0.57 0.00 0.41 -0.56 0.00 0.00 175.26 174.54 2k9a n GLY 6 N 5.35 0.97 3.72 -1.50 0.00 -1.26 -4.96 105.19 107.51 2k9a n GLY 6 Ca -0.05 -0.57 -0.24 0.00 0.00 0.00 0.00 46.02 45.16 2k9a n GLY 6 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2k9a s GLU 7 N 1.11 2.24 -0.28 1.61 -1.05 -1.26 -5.13 118.70 115.94 2k9a s GLU 7 Ca 0.00 -1.73 -0.00 0.00 -0.15 0.00 0.00 54.97 53.09 2k9a s GLU 7 Cb 0.00 -2.04 0.14 0.00 -0.44 0.00 0.00 34.13 31.79 2k9a s GLU 7 CO 0.00 0.01 0.31 -1.54 0.95 0.00 0.00 175.26 174.99 2k9a s SER 8 N -3.85 1.43 0.00 0.83 1.04 -1.26 -4.95 113.70 106.95 2k9a s SER 8 Ca 0.39 -0.64 0.00 0.00 0.48 0.00 0.00 55.95 56.18 2k9a s SER 8 Cb 0.01 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.73 2k9a s SER 8 CO 0.22 -0.38 0.00 0.49 0.98 0.00 0.00 173.24 174.55 2k9a n PHE 9 N 5.32 0.00 -1.42 5.02 3.72 -1.26 -5.01 117.46 123.83 2k9a n PHE 9 Ca -0.02 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.24 2k9a n PHE 9 Cb 0.47 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.95 2k9a n PHE 9 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2k9a n ALA 10 N 0.00 -0.22 -2.82 4.37 0.00 -1.26 -4.94 120.51 115.64 2k9a n ALA 10 Ca 0.00 0.24 -0.39 0.00 0.00 0.00 0.00 53.44 53.29 2k9a n ALA 10 Cb 0.00 -1.87 -0.11 0.00 0.00 0.00 0.00 19.45 17.46 2k9a n ALA 10 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2k9a s LEU 11 N -3.30 4.23 -0.29 0.00 1.43 -1.26 -5.04 118.68 114.45 2k9a s LEU 11 Ca 0.00 -0.56 -0.15 0.00 -1.03 0.00 0.00 54.13 52.39 2k9a s LEU 11 Cb 0.00 -2.02 0.15 0.00 0.03 0.00 0.00 46.19 44.35 2k9a s LEU 11 CO 0.00 -0.22 0.95 -0.55 0.23 0.00 0.00 176.35 176.76 2k9a s SER 12 N 1.62 -0.59 0.20 2.29 0.15 -1.26 -4.85 113.70 111.26 2k9a s SER 12 Ca 0.05 0.87 0.00 0.00 0.70 0.00 0.00 55.95 57.57 2k9a s SER 12 Cb -0.17 1.45 0.00 0.00 -1.71 0.00 0.00 66.02 65.59 2k9a s SER 12 CO 0.07 -0.13 0.00 0.33 1.20 0.00 0.00 173.24 174.71 2k9a n PHE 13 N 4.32 -2.17 0.07 3.44 7.35 -1.26 -4.93 117.46 124.28 2k9a n PHE 13 Ca -0.15 0.47 -0.09 0.00 -0.76 0.00 0.00 57.45 56.92 2k9a n PHE 13 Cb 0.55 1.14 -0.13 0.00 0.35 0.00 0.00 39.48 41.39 2k9a n PHE 13 CO 0.00 0.00 0.00 0.77 -0.76 0.00 0.00 176.76 176.77 2k9a h SER 14 N 0.00 0.10 0.00 -2.13 0.02 -1.98 -3.47 113.55 106.09 2k9a h SER 14 Ca 0.00 -0.11 0.00 0.00 -0.84 0.00 0.00 61.79 60.84 2k9a h SER 14 Cb 0.00 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.51 2k9a h SER 14 CO 0.00 1.09 0.00 -1.20 -1.14 0.00 0.00 176.83 175.58 2k9a n SER 15 N -3.38 0.00 0.26 3.07 7.64 -1.26 -3.31 113.62 116.64 2k9a n SER 15 Ca -0.03 0.00 0.18 0.00 1.01 0.00 0.00 58.87 60.03 2k9a n SER 15 Cb 0.96 0.00 0.92 0.00 -1.01 0.00 0.00 64.21 65.08 2k9a n SER 15 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k9a h ALA 16 N -0.85 1.55 -0.00 -0.43 0.00 -1.92 0.58 119.26 118.19 2k9a h ALA 16 Ca 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2k9a h ALA 16 Cb 0.00 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 2k9a h ALA 16 CO 0.00 -0.21 -0.12 0.43 0.00 0.00 0.00 179.25 179.35 2k9a n SER 17 N -3.55 2.21 0.00 0.00 7.64 -1.21 -3.70 113.62 115.01 2k9a n SER 17 Ca -0.00 -3.30 0.00 0.00 1.01 0.00 0.00 58.87 56.58 2k9a n SER 17 Cb 0.25 -0.46 0.00 0.00 -1.01 0.00 0.00 64.21 62.99 2k9a n SER 17 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2k9a n ASP 18 N -1.35 0.00 0.24 6.43 -0.08 -0.14 -4.88 116.55 116.77 2k9a n ASP 18 Ca 0.17 0.00 -0.13 0.00 -1.51 0.00 0.00 54.79 53.32 2k9a n ASP 18 Cb 0.66 0.00 -0.07 0.00 2.34 0.00 0.00 41.12 44.05 2k9a n ASP 18 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2k9a h ALA 19 N 1.36 -0.63 -0.57 -1.67 0.00 -1.77 -2.77 119.26 113.20 2k9a h ALA 19 Ca 0.00 -0.19 0.02 0.00 0.00 0.00 0.00 54.91 54.75 2k9a h ALA 19 Cb 0.00 0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 2k9a h ALA 19 CO 0.00 -0.67 0.38 1.49 0.00 0.00 0.00 179.25 180.45 2k9a h GLU 20 N -1.00 0.68 0.20 0.00 4.81 -0.23 -2.50 114.58 116.54 2k9a h GLU 20 Ca -0.06 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.13 2k9a h GLU 20 Cb 0.58 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.79 2k9a h GLU 20 CO 0.11 0.45 -0.25 0.35 -0.73 0.00 0.00 179.01 178.93 2k9a h PHE 21 N 0.70 -0.67 -0.49 0.92 3.57 -1.41 -1.69 116.94 117.88 2k9a h PHE 21 Ca 0.22 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.78 2k9a h PHE 21 Cb 0.03 0.27 -0.03 0.00 2.79 0.00 0.00 35.95 39.01 2k9a h PHE 21 CO -0.00 -0.36 0.33 -0.44 -2.23 0.00 0.00 178.31 175.60 2k9a h ASP 22 N -0.51 0.41 -0.16 0.41 3.32 -1.18 -2.07 116.42 116.64 2k9a h ASP 22 Ca 0.01 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.06 2k9a h ASP 22 Cb 0.49 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.94 2k9a h ASP 22 CO -0.09 0.28 0.10 0.00 -1.72 0.00 0.00 179.24 177.81 2k9a h ALA 23 N 1.73 0.21 -0.03 3.45 0.00 -0.92 -2.29 119.26 121.40 2k9a h ALA 23 Ca 0.21 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2k9a h ALA 23 Cb 0.22 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 2k9a h ALA 23 CO -0.05 -0.31 0.02 0.28 0.00 0.00 0.00 179.25 179.19 2k9a h VAL 24 N 0.21 1.02 -0.98 0.00 2.07 -0.67 -2.19 116.25 115.71 2k9a h VAL 24 Ca 0.06 -0.04 0.22 0.00 0.82 0.00 0.00 66.70 67.76 2k9a h VAL 24 Cb -0.01 0.98 -0.09 0.00 -1.52 0.00 0.00 31.29 30.65 2k9a h VAL 24 CO -0.01 0.01 0.63 0.58 0.02 0.00 0.00 177.57 178.80 2k9a h VAL 25 N 0.04 0.63 -0.56 2.57 2.07 -1.29 0.15 116.25 119.85 2k9a h VAL 25 Ca 0.01 -0.18 -0.11 0.00 0.82 0.00 0.00 66.70 67.25 2k9a h VAL 25 Cb 0.00 0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 29.83 2k9a h VAL 25 CO -0.00 0.09 -0.08 1.23 0.02 0.00 0.00 177.57 178.84 2k9a h GLY 26 N 0.51 1.13 0.90 2.17 0.00 -0.82 -2.73 103.07 104.24 2k9a h GLY 26 Ca 0.55 -0.89 -0.01 0.00 0.00 0.00 0.00 47.33 46.97 2k9a h GLY 26 CO -0.28 0.82 -0.11 -0.97 0.00 0.00 0.00 176.54 175.99 2k9a h TYR 27 N 0.93 -0.30 -0.62 5.60 0.05 -0.33 -2.63 116.97 119.68 2k9a h TYR 27 Ca 0.15 -0.01 0.12 0.00 0.05 0.00 0.00 58.73 59.04 2k9a h TYR 27 Cb 0.65 0.10 -0.09 0.00 1.01 0.00 0.00 36.73 38.39 2k9a h TYR 27 CO 0.04 -0.11 0.11 -0.07 -1.05 0.00 0.00 178.16 177.09 2k9a h LEU 28 N -0.42 -0.04 -0.68 3.88 -0.00 -1.34 -0.67 115.31 116.03 2k9a h LEU 28 Ca -0.03 0.12 0.08 0.00 -0.00 0.00 0.00 57.88 58.05 2k9a h LEU 28 Cb 0.32 0.18 -0.07 0.00 -0.00 0.00 0.00 40.66 41.09 2k9a h LEU 28 CO 0.05 -0.02 0.34 -0.33 -0.00 0.00 0.00 178.44 178.49 2k9a h GLU 29 N 0.23 0.59 -0.32 1.13 5.08 -1.35 -0.04 114.58 119.90 2k9a h GLU 29 Ca 0.33 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.62 2k9a h GLU 29 Cb 0.50 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.61 2k9a h GLU 29 CO -0.44 0.39 0.07 0.22 -1.00 0.00 0.00 179.01 178.25 2k9a h ASP 30 N 0.60 0.42 0.22 1.42 1.82 -0.78 -2.07 116.42 118.05 2k9a h ASP 30 Ca 0.32 -0.05 -0.15 0.00 -0.39 0.00 0.00 57.03 56.76 2k9a h ASP 30 Cb 0.30 -0.11 -0.01 0.00 0.68 0.00 0.00 39.33 40.20 2k9a h ASP 30 CO -0.24 0.43 -0.56 0.40 -1.61 0.00 0.00 179.24 177.66 2k9a h ILE 31 N 0.45 1.35 -0.58 2.25 2.04 -0.12 -2.77 117.51 120.13 2k9a h ILE 31 Ca 0.11 -1.86 -0.06 0.00 1.00 0.00 0.00 64.86 64.04 2k9a h ILE 31 Cb 0.19 1.88 -0.02 0.00 -0.74 0.00 0.00 36.82 38.13 2k9a h ILE 31 CO -0.00 0.56 0.11 0.40 0.00 0.00 0.00 178.15 179.22 2k9a h ILE 32 N 0.28 1.25 -0.24 -0.67 2.04 -0.45 -2.24 117.51 117.47 2k9a h ILE 32 Ca 0.00 -0.95 0.00 0.00 1.00 0.00 0.00 64.86 64.91 2k9a h ILE 32 Cb 1.07 0.75 0.00 0.00 -0.74 0.00 0.00 36.82 37.90 2k9a h ILE 32 CO 0.09 0.35 0.00 0.23 0.00 0.00 0.00 178.15 178.82 2k9a n MET 33 N -4.34 1.62 -2.55 2.37 2.81 -1.01 -4.66 117.12 111.36 2k9a n MET 33 Ca 0.03 -0.90 -0.42 0.00 -1.81 0.00 0.00 57.70 54.60 2k9a n MET 33 Cb 0.26 -1.23 -0.03 0.00 -0.71 0.00 0.00 33.22 31.50 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 -0.95 7.24 0.12 7.83 -1.08 -0.84 -4.96 116.67 124.03 2k9a s ASP 34 Ca 0.17 1.92 -0.25 0.00 -0.52 0.00 0.00 52.55 53.86 2k9a s ASP 34 Cb 0.09 -2.58 -0.06 0.00 -1.46 0.00 0.00 42.92 38.91 2k9a s ASP 34 CO 0.11 -0.31 1.66 -0.78 0.52 0.00 0.00 175.17 176.36 2k9a h ASP 35 N 6.27 -0.59 -0.09 -0.34 3.58 -1.89 -1.16 116.42 122.19 2k9a h ASP 35 Ca -0.42 0.08 0.03 0.00 0.42 0.00 0.00 57.03 57.14 2k9a h ASP 35 Cb 1.21 0.24 -0.00 0.00 1.72 0.00 0.00 39.33 42.51 2k9a h ASP 35 CO 0.76 -0.27 0.08 -0.08 -2.88 0.00 0.00 179.24 176.85 2k9a h GLU 36 N -0.33 0.00 -0.12 0.28 4.57 -1.94 -1.45 114.58 115.59 2k9a h GLU 36 Ca 0.06 0.00 -0.12 0.00 -1.18 0.00 0.00 59.36 58.11 2k9a h GLU 36 Cb 0.40 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.99 2k9a h GLU 36 CO -0.18 0.00 -0.40 0.35 -1.18 0.00 0.00 179.01 177.60 2k9a h PHE 37 N 0.00 0.64 -0.24 0.92 3.57 -1.51 -1.87 116.94 118.44 2k9a h PHE 37 Ca 0.04 -0.26 -0.09 0.00 3.53 0.00 0.00 57.97 61.19 2k9a h PHE 37 Cb 0.20 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.81 2k9a h PHE 37 CO 0.00 1.01 -0.23 1.96 -2.23 0.00 0.00 178.31 178.82 2k9a h GLN 38 N 0.09 0.45 -0.05 1.11 4.20 -0.58 -0.55 115.11 119.77 2k9a h GLN 38 Ca -0.01 -0.16 -0.02 0.00 0.06 0.00 0.00 58.65 58.52 2k9a h GLN 38 Cb 1.02 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.77 2k9a h GLN 38 CO 0.08 0.65 -0.04 1.25 -0.67 0.00 0.00 178.83 180.11 2k9a h LEU 39 N 0.40 0.13 -0.07 1.46 7.12 -1.29 -2.12 115.31 120.95 2k9a h LEU 39 Ca 0.06 -0.46 -0.01 0.00 0.13 0.00 0.00 57.88 57.61 2k9a h LEU 39 Cb 0.62 -0.04 -0.00 0.00 -0.53 0.00 0.00 40.66 40.72 2k9a h LEU 39 CO 0.04 0.56 0.01 0.25 -0.13 0.00 0.00 178.44 179.17 2k9a h LEU 40 N -0.30 0.11 -0.21 2.25 6.46 -1.27 -0.88 115.31 121.47 2k9a h LEU 40 Ca 0.01 -0.25 0.04 0.00 -0.12 0.00 0.00 57.88 57.56 2k9a h LEU 40 Cb 0.51 -0.03 -0.03 0.00 -0.73 0.00 0.00 40.66 40.38 2k9a h LEU 40 CO 0.01 0.33 -0.00 -0.61 -0.62 0.00 0.00 178.44 177.54 2k9a h GLN 41 N -0.12 0.06 -0.14 1.25 4.15 -1.17 -1.96 115.11 117.19 2k9a h GLN 41 Ca 0.02 -0.00 -0.07 0.00 0.77 0.00 0.00 58.65 59.37 2k9a h GLN 41 Cb 0.26 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 27.93 2k9a h GLN 41 CO 0.00 0.04 -0.24 -0.09 -1.93 0.00 0.00 178.83 176.62 2k9a h ARG 42 N 0.07 0.24 -0.11 1.69 2.43 -1.37 -0.39 114.38 116.95 2k9a h ARG 42 Ca 0.10 -0.07 -0.00 0.00 -0.81 0.00 0.00 59.98 59.19 2k9a h ARG 42 Cb 0.13 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 29.65 2k9a h ARG 42 CO -0.17 0.47 0.06 -0.97 -1.51 0.00 0.00 179.97 177.84 2k9a h ASN 43 N 0.22 0.13 0.05 -3.80 -0.73 -0.43 -1.73 115.58 109.29 2k9a h ASN 43 Ca 0.04 -0.09 -0.14 0.00 1.87 0.00 0.00 56.30 57.97 2k9a h ASN 43 Cb 0.54 -0.03 0.01 0.00 0.27 0.00 0.00 38.32 39.11 2k9a h ASN 43 CO 0.04 0.19 -0.58 -0.26 -0.37 0.00 0.00 177.43 176.44 2k9a h PHE 44 N 0.07 0.49 -0.18 0.67 0.04 -1.32 -3.25 116.94 113.46 2k9a h PHE 44 Ca 0.04 -0.30 0.05 0.00 2.80 0.00 0.00 57.97 60.56 2k9a h PHE 44 Cb 0.09 -0.04 -0.01 0.00 2.20 0.00 0.00 35.95 38.19 2k9a h PHE 44 CO -0.04 1.16 0.22 0.52 -0.60 0.00 0.00 178.31 179.57 2k9a h MET 45 N -0.32 0.00 -0.09 1.51 2.86 -1.10 0.59 114.93 118.37 2k9a h MET 45 Ca -0.09 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.54 2k9a h MET 45 Cb 1.36 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.02 2k9a h MET 45 CO 0.11 0.00 -0.01 0.22 1.06 0.00 0.00 176.91 178.29 2k9a h ASP 46 N 0.00 0.11 0.04 1.22 3.58 -1.34 -1.46 116.42 118.58 2k9a h ASP 46 Ca 0.08 -0.01 -0.35 0.00 0.42 0.00 0.00 57.03 57.17 2k9a h ASP 46 Cb 0.51 -0.03 -0.04 0.00 1.72 0.00 0.00 39.33 41.49 2k9a h ASP 46 CO -0.00 0.15 -2.01 1.17 -2.88 0.00 0.00 179.24 175.67 2k9a n LYS 47 N -4.44 0.65 0.05 0.28 3.00 0.11 -4.22 118.16 113.59 2k9a n LYS 47 Ca -0.02 0.32 -0.11 0.00 -0.00 0.00 0.00 58.31 58.51 2k9a n LYS 47 Cb 0.14 -1.64 -0.04 0.00 0.00 0.00 0.00 35.03 33.49 2k9a n LYS 47 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.40 179.28 2k9a h TYR 48 N -0.43 -0.65 -0.01 5.64 -1.99 -1.25 -0.71 116.97 117.56 2k9a h TYR 48 Ca -0.49 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.26 2k9a h TYR 48 Cb 1.73 0.29 -0.00 0.00 2.00 0.00 0.00 36.73 40.75 2k9a h TYR 48 CO 0.04 -0.33 0.16 0.10 -0.00 0.00 0.00 178.16 178.13 2k9a h TYR 49 N -0.37 0.00 0.18 4.88 -0.00 -1.49 -0.49 116.97 119.68 2k9a h TYR 49 Ca 0.07 0.00 -0.27 0.00 -0.00 0.00 0.00 58.73 58.52 2k9a h TYR 49 Cb 0.46 0.00 0.03 0.00 -0.00 0.00 0.00 36.73 37.22 2k9a h TYR 49 CO -0.29 0.00 -1.18 -0.07 -0.00 0.00 0.00 178.16 176.62 2k9a h LEU 50 N 0.00 0.72 -0.39 0.10 3.38 -1.31 -3.34 115.31 114.47 2k9a h LEU 50 Ca 0.00 -0.91 -0.17 0.00 0.09 0.00 0.00 57.88 56.90 2k9a h LEU 50 Cb 0.32 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 2k9a h LEU 50 CO -0.00 1.57 -0.45 -0.33 0.09 0.00 0.00 178.44 179.32 2k9a h GLU 51 N -0.01 0.88 -5.96 1.13 4.39 -0.68 -3.38 114.58 110.94 2k9a h GLU 51 Ca -0.20 -0.49 -0.59 0.00 0.34 0.00 0.00 59.36 58.41 2k9a h GLU 51 Cb 1.91 0.03 -0.09 0.00 -0.10 0.00 0.00 28.75 30.51 2k9a h GLU 51 CO 0.22 1.14 1.67 -0.06 -1.16 0.00 0.00 179.01 180.82 2k9a s PHE 52 N -4.28 2.54 0.16 4.33 0.40 -0.57 -4.97 117.98 115.59 2k9a s PHE 52 Ca -0.10 -0.94 -0.01 0.00 -0.60 0.00 0.00 56.93 55.27 2k9a s PHE 52 Cb 0.11 -4.64 -0.04 0.00 0.51 0.00 0.00 43.02 38.96 2k9a s PHE 52 CO 0.88 -1.84 0.35 -1.21 0.70 0.00 0.00 175.22 174.09 2k9a s GLU 53 N 4.94 3.52 -0.93 0.44 2.02 -1.26 -4.77 118.70 122.66 2k9a s GLU 53 Ca 0.52 -0.34 -0.25 0.00 0.02 0.00 0.00 54.97 54.92 2k9a s GLU 53 Cb 0.01 -2.89 -0.07 0.00 0.10 0.00 0.00 34.13 31.28 2k9a s GLU 53 CO -0.02 0.46 2.01 0.34 0.02 0.00 0.00 175.26 178.07 2k9a s ASP 54 N -2.92 4.92 0.06 -0.19 2.15 -1.26 -4.87 116.67 114.56 2k9a s ASP 54 Ca 0.38 -0.71 0.01 0.00 0.43 0.00 0.00 52.55 52.65 2k9a s ASP 54 Cb -0.12 -2.56 -0.00 0.00 -0.30 0.00 0.00 42.92 39.94 2k9a s ASP 54 CO 0.28 -2.99 0.02 0.35 -0.17 0.00 0.00 175.17 172.66 2k9a n THR 55 N 8.02 0.00 -0.58 1.71 -2.24 -1.26 -5.07 114.28 114.86 2k9a n THR 55 Ca 0.42 -0.38 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 2k9a n THR 55 Cb 0.46 0.14 0.00 0.00 -2.10 0.00 0.00 70.33 68.83 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 -0.14 0.71 -3.96 -0.78 0.00 -1.26 -5.06 120.64 110.14 2k9a n GLU 56 Ca -0.01 -0.69 -0.35 0.00 0.00 0.00 0.00 57.16 56.12 2k9a n GLU 56 Cb 0.10 -0.71 -0.06 0.00 0.00 0.00 0.00 31.44 30.77 2k9a n GLU 56 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.13 175.92 2k9a s GLU 57 N -0.28 3.34 -0.39 3.44 2.02 -1.26 -5.08 118.70 120.50 2k9a s GLU 57 Ca 0.00 -0.28 -0.15 0.00 0.02 0.00 0.00 54.97 54.56 2k9a s GLU 57 Cb 0.00 -3.07 0.01 0.00 0.10 0.00 0.00 34.13 31.16 2k9a s GLU 57 CO 0.00 0.71 0.35 -0.80 0.02 0.00 0.00 175.26 175.54 2k9a s ASN 58 N -1.46 6.15 0.20 -0.19 0.02 -1.26 -5.07 114.94 113.32 2k9a s ASN 58 Ca 0.21 -0.60 0.02 0.00 -1.02 0.00 0.00 52.86 51.47 2k9a s ASN 58 Cb -0.12 -2.19 -0.04 0.00 0.02 0.00 0.00 41.25 38.93 2k9a s ASN 58 CO 0.11 -0.43 0.35 -0.54 0.02 0.00 0.00 177.10 176.61 2k9a s LYS 59 N 1.91 3.47 0.00 -0.60 1.02 -1.26 -5.00 119.74 119.28 2k9a s LYS 59 Ca 0.09 -0.53 0.29 0.00 0.02 0.00 0.00 55.97 55.84 2k9a s LYS 59 Cb -0.18 -2.89 1.30 0.00 -0.52 0.00 0.00 37.83 35.55 2k9a s LYS 59 CO 0.12 0.44 1.96 1.28 -0.92 0.00 0.00 175.35 178.22 2k9a n LEU 60 N -0.84 0.01 0.15 3.17 7.99 -1.26 -3.27 117.00 122.95 2k9a n LEU 60 Ca -0.07 0.44 0.13 0.00 -0.01 0.00 0.00 56.01 56.51 2k9a n LEU 60 Cb 0.55 -0.44 0.51 0.00 -0.11 0.00 0.00 43.42 43.92 2k9a n LEU 60 CO 0.48 0.00 0.88 -0.29 -1.51 0.00 0.00 177.39 176.95 2k9a h ILE 61 N 0.00 0.00 0.00 -0.08 6.09 -2.03 -2.68 117.51 118.82 2k9a h ILE 61 Ca 0.00 -0.32 0.00 0.00 -1.37 0.00 0.00 64.86 63.17 2k9a h ILE 61 Cb 0.45 1.13 0.00 0.00 0.47 0.00 0.00 36.82 38.87 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 0.05 2.19 0.05 -1.98 -2.83 116.97 114.45 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 0.44 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.18 2k9a h TYR 62 CO 0.00 0.00 -0.03 1.15 -1.05 0.00 0.00 178.16 178.23 2k9a h THR 63 N 0.00 1.19 -0.64 -2.88 2.02 -1.73 -2.48 112.91 108.38 2k9a h THR 63 Ca 0.00 -1.60 -0.08 0.00 0.77 0.00 0.00 66.41 65.50 2k9a h THR 63 Cb 0.47 2.12 -0.02 0.00 -1.74 0.00 0.00 68.15 68.98 2k9a h THR 63 CO 0.00 0.36 0.08 1.55 0.37 0.00 0.00 175.52 177.88 2k9a h PRO 64 N -0.88 1.07 -0.15 6.66 0.13 -1.73 -1.85 132.00 135.25 2k9a h PRO 64 Ca -0.01 -0.30 -0.01 0.00 -0.87 0.00 0.00 66.00 64.82 2k9a h PRO 64 Cb 0.64 -0.12 -0.01 0.00 0.13 0.00 0.00 31.00 31.64 2k9a h PRO 64 CO 0.01 1.00 0.06 0.82 -0.23 0.00 0.00 178.00 179.66 2k9a h ILE 65 N 0.98 1.15 0.16 -3.56 2.04 -1.63 -1.82 117.51 114.83 2k9a h ILE 65 Ca 0.19 -0.45 -0.01 0.00 1.00 0.00 0.00 64.86 65.59 2k9a h ILE 65 Cb 0.46 1.17 0.00 0.00 -0.74 0.00 0.00 36.82 37.71 2k9a h ILE 65 CO 0.02 0.14 -0.08 0.15 0.00 0.00 0.00 178.15 178.38 2k9a h PHE 66 N 0.10 -0.20 -0.61 1.37 3.57 -1.39 -2.17 116.94 117.61 2k9a h PHE 66 Ca 0.05 -0.00 0.13 0.00 3.53 0.00 0.00 57.97 61.68 2k9a h PHE 66 Cb 0.17 0.07 -0.04 0.00 2.79 0.00 0.00 35.95 38.94 2k9a h PHE 66 CO -0.02 -0.12 0.42 -0.91 -2.23 0.00 0.00 178.31 175.45 2k9a h ASN 67 N -0.22 0.25 -0.61 0.41 2.35 -1.29 0.09 115.58 116.56 2k9a h ASN 67 Ca -0.02 0.01 -0.10 0.00 -0.55 0.00 0.00 56.30 55.64 2k9a h ASN 67 Cb 0.17 -0.04 -0.02 0.00 0.05 0.00 0.00 38.32 38.47 2k9a h ASN 67 CO 0.04 0.14 -0.01 -0.08 -1.65 0.00 0.00 177.43 175.86 2k9a h GLU 68 N 0.27 1.08 -0.10 0.81 4.81 -0.71 -1.67 114.58 119.07 2k9a h GLU 68 Ca 0.29 -0.35 -0.11 0.00 -0.13 0.00 0.00 59.36 59.06 2k9a h GLU 68 Cb 0.78 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.05 2k9a h GLU 68 CO -0.07 1.06 -0.44 -0.92 -0.73 0.00 0.00 179.01 177.91 2k9a h TYR 69 N 0.98 0.29 0.00 0.92 5.03 -0.55 0.11 116.97 123.75 2k9a h TYR 69 Ca 0.17 -0.08 -0.13 0.00 2.58 0.00 0.00 58.73 61.26 2k9a h TYR 69 Cb 0.58 -0.06 -0.02 0.00 1.55 0.00 0.00 36.73 38.78 2k9a h TYR 69 CO 0.04 0.64 -0.64 0.82 -1.32 0.00 0.00 178.16 177.71 2k9a h ILE 70 N 0.20 1.36 0.00 1.81 1.08 -1.03 -1.58 117.51 119.35 2k9a h ILE 70 Ca 0.01 -2.26 -0.17 0.00 -0.39 0.00 0.00 64.86 62.06 2k9a h ILE 70 Cb 0.86 2.25 -0.03 0.00 -3.07 0.00 0.00 36.82 36.83 2k9a h ILE 70 CO 0.07 0.63 -1.70 -0.24 -0.69 0.00 0.00 178.15 176.21 2k9a n SER 71 N -3.64 0.51 -0.05 1.72 2.88 -0.65 -3.47 113.62 110.92 2k9a n SER 71 Ca -0.01 0.22 -0.03 0.00 -1.33 0.00 0.00 58.87 57.72 2k9a n SER 71 Cb 0.66 0.71 -0.01 0.00 -0.75 0.00 0.00 64.21 64.82 2k9a n SER 71 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 2k9a h LEU 72 N 0.00 0.00 0.32 2.46 7.12 -0.81 -3.36 115.31 121.03 2k9a h LEU 72 Ca -0.20 0.00 -0.02 0.00 0.13 0.00 0.00 57.88 57.79 2k9a h LEU 72 Cb 1.57 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 41.70 2k9a h LEU 72 CO 0.03 0.54 -0.15 0.58 -0.13 0.00 0.00 178.44 179.31 2k9a h VAL 73 N -0.73 0.07 -0.96 1.05 2.07 -1.48 -1.86 116.25 114.41 2k9a h VAL 73 Ca 0.00 -0.71 0.17 0.00 0.82 0.00 0.00 66.70 66.98 2k9a h VAL 73 Cb 0.36 0.12 -0.10 0.00 -1.52 0.00 0.00 31.29 30.15 2k9a h VAL 73 CO 0.00 0.02 0.56 -0.08 0.02 0.00 0.00 177.57 178.09 2k9a h GLU 74 N -1.10 0.72 -0.01 1.57 4.81 -1.61 0.16 114.58 119.13 2k9a h GLU 74 Ca -0.04 -0.04 -0.15 0.00 -0.13 0.00 0.00 59.36 58.99 2k9a h GLU 74 Cb 0.36 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.56 2k9a h GLU 74 CO 0.07 0.48 -0.69 0.87 -0.73 0.00 0.00 179.01 179.01 2k9a h LYS 75 N 0.75 0.05 -0.77 1.92 1.79 -1.66 -2.76 116.57 115.88 2k9a h LYS 75 Ca 0.54 -0.04 -0.03 0.00 -2.18 0.00 0.00 60.65 58.93 2k9a h LYS 75 Cb 0.78 0.01 -0.04 0.00 -1.58 0.00 0.00 32.23 31.40 2k9a h LYS 75 CO -0.37 0.72 0.36 -0.92 -1.08 0.00 0.00 179.45 178.16 2k9a h TYR 76 N 0.03 1.13 0.08 -1.35 3.20 0.17 -1.24 116.97 118.98 2k9a h TYR 76 Ca -0.01 -0.06 -0.00 0.00 3.14 0.00 0.00 58.73 61.80 2k9a h TYR 76 Cb 1.22 -0.35 0.00 0.00 1.54 0.00 0.00 36.73 39.15 2k9a h TYR 76 CO 0.01 0.83 -0.04 0.82 -1.64 0.00 0.00 178.16 178.14 2k9a h ILE 77 N 1.10 1.18 -0.22 1.81 2.04 -1.27 -2.77 117.51 119.37 2k9a h ILE 77 Ca 0.26 -1.02 0.05 0.00 1.00 0.00 0.00 64.86 65.15 2k9a h ILE 77 Cb 0.13 1.82 -0.05 0.00 -0.74 0.00 0.00 36.82 37.99 2k9a h ILE 77 CO -0.03 0.25 -0.08 -0.08 0.00 0.00 0.00 178.15 178.21 2k9a h GLU 78 N -0.58 -0.04 0.04 2.37 4.81 -1.43 -1.30 114.58 118.46 2k9a h GLU 78 Ca -0.01 0.00 0.02 0.00 -0.13 0.00 0.00 59.36 59.24 2k9a h GLU 78 Cb 0.48 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.84 2k9a h GLU 78 CO 0.02 -0.03 -0.17 0.93 -0.73 0.00 0.00 179.01 179.03 2k9a h GLU 79 N -0.04 -0.29 0.00 1.92 4.39 -1.30 -0.33 114.58 118.93 2k9a h GLU 79 Ca 0.11 0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.83 2k9a h GLU 79 Cb 0.21 0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 28.93 2k9a h GLU 79 CO -0.25 -0.20 -0.01 1.96 -1.16 0.00 0.00 179.01 179.36 2k9a h GLN 80 N -0.30 0.00 0.15 2.33 1.08 -1.24 -2.04 115.11 115.09 2k9a h GLN 80 Ca 0.04 0.00 -0.27 0.00 -1.45 0.00 0.00 58.65 56.97 2k9a h GLN 80 Cb 0.35 0.00 0.03 0.00 -0.05 0.00 0.00 27.48 27.81 2k9a h GLN 80 CO -0.14 0.01 -1.16 -0.07 -0.95 0.00 0.00 178.83 176.52 2k9a h LEU 81 N 0.00 0.76 -1.50 1.46 3.38 -0.56 -3.28 115.31 115.57 2k9a h LEU 81 Ca -0.00 -0.87 -0.03 0.00 0.09 0.00 0.00 57.88 57.07 2k9a h LEU 81 Cb 0.01 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.51 2k9a h LEU 81 CO 0.00 1.56 -0.14 -0.07 0.09 0.00 0.00 178.44 179.88 2k9a h LEU 82 N 0.07 0.00 -2.10 1.67 -0.00 -0.65 -2.50 115.31 111.81 2k9a h LEU 82 Ca -0.19 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.69 2k9a h LEU 82 Cb 1.87 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.53 2k9a h LEU 82 CO 0.22 0.14 0.17 1.56 -0.00 0.00 0.00 178.44 180.54 2k9a h GLN 83 N 0.00 0.00 0.00 1.13 4.20 -1.44 -1.31 115.11 117.69 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 0.55 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.33 2k9a h GLN 83 CO 0.02 0.00 -0.06 0.54 -0.67 0.00 0.00 178.83 178.66 2k9a n ARG 84 N -2.76 5.42 -3.62 1.46 1.74 -1.04 -4.93 116.66 112.94 2k9a n ARG 84 Ca -0.02 0.00 -0.29 0.00 -0.77 0.00 0.00 57.85 56.77 2k9a n ARG 84 Cb 0.22 -0.45 -0.13 0.00 -1.02 0.00 0.00 32.46 31.08 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 -0.89 0.82 -1.55 0.55 1.01 -0.50 -4.97 121.20 115.68 2k9a s ILE 85 Ca 0.00 -2.02 0.21 0.00 0.00 0.00 0.00 60.65 58.84 2k9a s ILE 85 Cb 0.00 -1.59 0.43 0.00 0.01 0.00 0.00 42.46 41.30 2k9a s ILE 85 CO 0.00 -0.89 1.68 -0.81 0.00 0.00 0.00 174.94 174.92 2k9a n PRO 86 N 3.97 0.38 -0.18 2.79 -0.04 -1.23 -2.44 135.00 138.26 2k9a n PRO 86 Ca 0.08 0.07 0.05 0.00 -0.04 0.00 0.00 63.50 63.66 2k9a n PRO 86 Cb 0.37 -1.50 0.14 0.00 -0.04 0.00 0.00 33.50 32.46 2k9a n PRO 86 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2k9a n GLU 87 N -1.23 2.78 -2.02 0.54 0.28 -1.26 -5.04 120.64 114.70 2k9a n GLU 87 Ca 0.11 -2.11 -0.38 0.00 -0.16 0.00 0.00 57.16 54.62 2k9a n GLU 87 Cb 0.15 -1.33 0.02 0.00 1.43 0.00 0.00 31.44 31.70 2k9a n GLU 87 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 177.13 177.09 2k9a s PHE 88 N -1.51 2.57 -0.37 -1.84 5.36 -1.02 -5.01 117.98 116.16 2k9a s PHE 88 Ca 0.22 1.46 0.01 0.00 -0.96 0.00 0.00 56.93 57.65 2k9a s PHE 88 Cb 0.15 -3.59 0.12 0.00 -0.34 0.00 0.00 43.02 39.36 2k9a s PHE 88 CO 0.10 -2.21 0.17 1.21 -1.46 0.00 0.00 175.22 173.03 2k9a s ASN 89 N -1.16 3.74 0.35 6.13 3.04 -1.26 -4.99 114.94 120.79 2k9a s ASN 89 Ca 0.68 -2.12 0.02 0.00 0.04 0.00 0.00 52.86 51.48 2k9a s ASN 89 Cb -0.34 -0.87 0.63 0.00 -1.54 0.00 0.00 41.25 39.13 2k9a s ASN 89 CO 0.41 -0.34 2.00 -0.03 -3.04 0.00 0.00 177.10 176.10 2k9a h MET 90 N 7.39 0.84 0.75 0.43 4.05 -1.97 0.10 114.93 126.52 2k9a h MET 90 Ca -0.06 -0.05 -0.04 0.00 -0.28 0.00 0.00 59.70 59.27 2k9a h MET 90 Cb 0.97 -0.19 0.01 0.00 -0.80 0.00 0.00 31.60 31.59 2k9a h MET 90 CO 0.45 0.56 -0.36 0.00 0.23 0.00 0.00 176.91 177.79 2k9a h ALA 91 N 1.59 -1.01 0.00 0.39 0.00 -2.00 -1.10 119.26 117.14 2k9a h ALA 91 Ca 0.25 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 2k9a h ALA 91 Cb -0.05 0.39 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 2k9a h ALA 91 CO -0.06 -1.02 -0.31 0.00 0.00 0.00 0.00 179.25 177.87 2k9a h ALA 92 N -0.93 1.25 -0.20 0.00 0.00 -1.97 -2.71 119.26 114.69 2k9a h ALA 92 Ca -0.10 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.47 2k9a h ALA 92 Cb 0.79 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 2k9a h ALA 92 CO 0.17 0.38 -0.11 0.35 0.00 0.00 0.00 179.25 180.05 2k9a h PHE 93 N 0.00 0.50 -0.56 0.00 3.57 -0.68 -2.67 116.94 117.10 2k9a h PHE 93 Ca -0.00 -0.13 -0.10 0.00 3.53 0.00 0.00 57.97 61.27 2k9a h PHE 93 Cb 0.64 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.25 2k9a h PHE 93 CO 0.00 0.73 -0.05 1.79 -2.23 0.00 0.00 178.31 178.54 2k9a h THR 94 N 0.13 1.26 -0.70 4.41 1.35 -1.10 0.92 112.91 119.19 2k9a h THR 94 Ca 0.04 -1.19 0.02 0.00 -0.55 0.00 0.00 66.41 64.73 2k9a h THR 94 Cb 0.60 0.89 -0.04 0.00 -1.73 0.00 0.00 68.15 67.87 2k9a h THR 94 CO 0.03 0.42 0.45 0.74 -0.25 0.00 0.00 175.52 176.92 2k9a h THR 95 N 0.91 1.13 0.00 6.82 2.02 -1.47 -1.00 112.91 121.32 2k9a h THR 95 Ca 0.15 -0.31 -0.17 0.00 0.77 0.00 0.00 66.41 66.86 2k9a h THR 95 Cb 0.60 0.15 -0.02 0.00 -1.74 0.00 0.00 68.15 67.14 2k9a h THR 95 CO 0.04 0.16 -0.80 0.74 0.37 0.00 0.00 175.52 176.03 2k9a h THR 96 N 0.90 1.49 -0.06 3.16 2.02 -1.32 -3.33 112.91 115.76 2k9a h THR 96 Ca 0.27 -2.82 -0.01 0.00 0.77 0.00 0.00 66.41 64.62 2k9a h THR 96 Cb -0.03 2.56 -0.00 0.00 -1.74 0.00 0.00 68.15 68.93 2k9a h THR 96 CO -0.09 0.78 -0.01 0.25 0.37 0.00 0.00 175.52 176.83 2k9a h LEU 97 N 0.00 0.11 -1.79 2.58 6.46 -0.20 0.80 115.31 123.27 2k9a h LEU 97 Ca -0.01 -0.34 0.04 0.00 -0.12 0.00 0.00 57.88 57.46 2k9a h LEU 97 Cb 1.49 -0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 41.38 2k9a h LEU 97 CO 0.10 0.43 0.45 0.06 -0.62 0.00 0.00 178.44 178.86 2k9a h GLN 98 N -0.20 0.00 0.00 1.25 3.07 -1.31 0.11 115.11 118.03 2k9a h GLN 98 Ca 0.02 0.00 -0.39 0.00 0.09 0.00 0.00 58.65 58.37 2k9a h GLN 98 Cb 0.37 0.00 -0.07 0.00 0.08 0.00 0.00 27.48 27.86 2k9a h GLN 98 CO 0.00 0.00 -2.45 1.58 0.09 0.00 0.00 178.83 178.05 2k9a n HIS 99 N -3.10 0.04 1.02 0.06 -0.00 -1.09 -4.27 115.22 107.89 2k9a n HIS 99 Ca 0.02 0.01 0.09 0.00 0.46 0.00 0.00 57.72 58.30 2k9a n HIS 99 Cb 0.54 -1.01 0.50 0.00 -0.12 0.00 0.00 29.99 29.91 2k9a n HIS 99 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 2k9a n HIS 100 N -3.20 0.00 0.29 1.57 8.25 0.26 -2.69 115.22 119.69 2k9a n HIS 100 Ca -0.44 0.00 0.16 0.00 -0.26 0.00 0.00 57.72 57.19 2k9a n HIS 100 Cb 1.01 -0.12 0.80 0.00 1.12 0.00 0.00 29.99 32.80 2k9a n HIS 100 CO 0.00 0.00 0.00 1.57 0.64 0.00 0.00 176.34 178.55 2k9a h LYS 101 N 0.00 0.00 0.00 -0.41 2.10 -1.07 -0.96 116.57 116.23 2k9a h LYS 101 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2k9a h LYS 101 Cb 0.07 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.40 2k9a h LYS 101 CO 0.00 0.00 0.00 0.22 -2.00 0.00 0.00 179.45 177.67 2k9a h ASP 102 N 0.00 0.00 0.00 7.07 3.58 -1.81 -3.34 116.42 121.92 2k9a h ASP 102 Ca 0.00 0.00 -0.09 0.00 0.42 0.00 0.00 57.03 57.36 2k9a h ASP 102 Cb 0.19 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.22 2k9a h ASP 102 CO 0.00 0.00 -1.15 1.21 -2.88 0.00 0.00 179.24 176.42 2k9a n GLU 103 N -2.31 0.42 -0.46 0.28 4.07 -0.39 -5.04 120.64 117.21 2k9a n GLU 103 Ca 0.03 0.17 -0.22 0.00 -0.06 0.00 0.00 57.16 57.08 2k9a n GLU 103 Cb 0.29 -1.23 0.19 0.00 -0.06 0.00 0.00 31.44 30.63 2k9a n GLU 103 CO 0.00 0.00 0.00 1.33 -0.06 0.00 0.00 177.13 178.40 2k9a n VAL 104 N -4.17 0.00 -2.60 6.31 0.24 -1.04 -4.91 118.33 112.17 2k9a n VAL 104 Ca -0.19 -0.18 -0.43 0.00 -2.04 0.00 0.00 64.34 61.51 2k9a n VAL 104 Cb 0.51 -0.94 -0.02 0.00 -1.47 0.00 0.00 33.84 31.91 2k9a n VAL 104 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2k9a s ALA 105 N -2.56 3.08 0.51 2.33 0.00 -1.26 -4.89 121.76 118.97 2k9a s ALA 105 Ca 0.49 -0.65 0.18 0.00 0.00 0.00 0.00 51.96 51.98 2k9a s ALA 105 Cb -0.07 -3.95 1.25 0.00 0.00 0.00 0.00 23.12 20.35 2k9a s ALA 105 CO 0.39 -2.44 2.08 0.78 0.00 0.00 0.00 175.76 176.57 2k9a h GLY 106 N 11.53 0.11 1.72 0.00 0.00 -1.91 -0.99 103.07 113.52 2k9a h GLY 106 Ca -0.24 -0.03 -0.07 0.00 0.00 0.00 0.00 47.33 46.99 2k9a h GLY 106 CO 1.15 0.03 -0.17 1.29 0.00 0.00 0.00 176.54 178.84 2k9a h ASP 107 N 0.09 0.33 0.00 0.19 3.04 -1.96 -0.04 116.42 118.08 2k9a h ASP 107 Ca 0.12 -0.09 -0.00 0.00 -3.24 0.00 0.00 57.03 53.82 2k9a h ASP 107 Cb 0.36 -0.09 0.00 0.00 -1.04 0.00 0.00 39.33 38.56 2k9a h ASP 107 CO -0.01 0.53 -0.00 0.40 -2.04 0.00 0.00 179.24 178.12 2k9a h ILE 108 N 0.32 1.52 0.00 4.15 1.08 -1.59 -3.25 117.51 119.74 2k9a h ILE 108 Ca 0.06 -1.58 -0.06 0.00 -0.39 0.00 0.00 64.86 62.88 2k9a h ILE 108 Cb 0.50 2.60 -0.01 0.00 -3.07 0.00 0.00 36.82 36.84 2k9a h ILE 108 CO 0.03 0.41 -0.28 0.15 -0.69 0.00 0.00 178.15 177.77 2k9a h PHE 109 N -0.68 0.00 -0.91 1.37 3.57 -1.45 -2.75 116.94 116.09 2k9a h PHE 109 Ca -0.00 0.00 0.26 0.00 3.53 0.00 0.00 57.97 61.76 2k9a h PHE 109 Cb 0.67 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 39.38 2k9a h PHE 109 CO 0.16 0.28 0.77 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 1.82 -1.02 0.46 116.42 118.17 2k9a h ASP 110 Ca -0.00 0.00 -0.00 0.00 -0.39 0.00 0.00 57.03 56.63 2k9a h ASP 110 Cb 0.53 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.54 2k9a h ASP 110 CO 0.04 0.00 -0.04 -0.03 -1.61 0.00 0.00 179.24 177.60 2k9a h MET 111 N 0.00 -0.11 0.00 0.28 4.05 -1.63 -3.17 114.93 114.35 2k9a h MET 111 Ca 0.43 0.01 -0.02 0.00 -0.28 0.00 0.00 59.70 59.84 2k9a h MET 111 Cb 1.98 0.02 -0.00 0.00 -0.80 0.00 0.00 31.60 32.80 2k9a h MET 111 CO -0.00 0.41 -0.08 -0.07 0.23 0.00 0.00 176.91 177.40 2k9a h LEU 112 N -0.74 0.00 -1.90 3.39 3.38 -0.74 -2.81 115.31 115.89 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 41.30 2k9a h LEU 112 CO 0.02 0.08 0.61 0.25 0.09 0.00 0.00 178.44 179.49 2k9a h LEU 113 N 0.00 0.00 0.00 1.67 5.85 -0.22 0.56 115.31 123.17 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 0.34 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.37 2k9a h LEU 113 CO 0.01 0.00 0.00 0.35 -0.34 0.00 0.00 178.44 178.46 2k9a n THR 114 N -3.90 0.00 0.01 1.05 -2.24 -1.06 -2.40 114.28 105.74 2k9a n THR 114 Ca 0.14 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.91 2k9a n THR 114 Cb 0.86 -0.62 0.28 0.00 -2.10 0.00 0.00 70.33 68.76 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 0.52 0.00 4.78 0.04 -1.15 -3.39 116.94 117.73 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 -0.15 0.00 0.00 2.20 0.00 0.00 35.95 38.00 2k9a h PHE 115 CO 0.00 0.56 0.00 -2.37 -0.60 0.00 0.00 178.31 175.90 2k9a n THR 116 N -4.25 0.00 -2.04 -1.55 5.66 -1.13 -5.01 114.28 105.96 2k9a n THR 116 Ca 0.01 0.00 -0.27 0.00 -3.05 0.00 0.00 64.05 60.74 2k9a n THR 116 Cb 0.28 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.01 2k9a n THR 116 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 2k9a s ASP 117 N -0.42 5.09 0.44 1.09 1.11 -1.01 -4.77 116.67 118.20 2k9a s ASP 117 Ca 0.00 -0.84 0.11 0.00 0.18 0.00 0.00 52.55 52.00 2k9a s ASP 117 Cb 0.00 -2.57 0.98 0.00 1.07 0.00 0.00 42.92 42.41 2k9a s ASP 117 CO 0.00 -2.84 2.05 0.15 1.18 0.00 0.00 175.17 175.72 2k9a h PHE 118 N 11.03 0.40 -0.63 4.23 3.57 -1.89 -1.23 116.94 132.42 2k9a h PHE 118 Ca 0.12 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.57 2k9a h PHE 118 Cb 0.99 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 39.57 2k9a h PHE 118 CO 1.22 0.23 0.18 -0.07 -2.23 0.00 0.00 178.31 177.63 2k9a h LEU 119 N 0.41 0.91 -0.36 0.59 4.07 -1.99 -2.21 115.31 116.74 2k9a h LEU 119 Ca 0.16 -0.17 -0.17 0.00 0.08 0.00 0.00 57.88 57.78 2k9a h LEU 119 Cb 0.12 -0.24 -0.02 0.00 1.08 0.00 0.00 40.66 41.59 2k9a h LEU 119 CO -0.04 0.87 -0.82 0.00 -1.08 0.00 0.00 178.44 177.38 2k9a h ALA 120 N 1.25 0.65 0.33 1.53 0.00 -1.65 -2.33 119.26 119.04 2k9a h ALA 120 Ca 0.20 -0.74 -0.02 0.00 0.00 0.00 0.00 54.91 54.36 2k9a h ALA 120 Cb 0.30 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2k9a h ALA 120 CO -0.00 1.02 -0.16 0.35 0.00 0.00 0.00 179.25 180.45 2k9a h PHE 121 N 0.00 -0.42 -0.13 0.00 3.57 -0.90 -0.50 116.94 118.57 2k9a h PHE 121 Ca -0.01 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.47 2k9a h PHE 121 Cb 1.45 0.14 -0.00 0.00 2.79 0.00 0.00 35.95 40.32 2k9a h PHE 121 CO 0.00 -0.13 0.01 -0.22 -2.23 0.00 0.00 178.31 175.74 2k9a h LYS 122 N -0.66 0.22 -0.51 1.11 3.64 -1.50 -2.70 116.57 116.16 2k9a h LYS 122 Ca -0.05 -0.06 0.10 0.00 -1.27 0.00 0.00 60.65 59.37 2k9a h LYS 122 Cb 0.47 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.24 2k9a h LYS 122 CO 0.08 0.43 0.35 1.49 -2.27 0.00 0.00 179.45 179.52 2k9a h GLU 123 N -0.03 0.24 -0.17 1.90 4.22 -1.45 -1.18 114.58 118.12 2k9a h GLU 123 Ca 0.04 -0.01 -0.03 0.00 0.08 0.00 0.00 59.36 59.44 2k9a h GLU 123 Cb 0.32 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 2k9a h GLU 123 CO 0.00 0.16 -0.00 1.98 -2.18 0.00 0.00 179.01 178.97 2k9a h MET 124 N 0.25 0.30 -0.35 1.92 4.05 -0.77 -1.61 114.93 118.71 2k9a h MET 124 Ca 0.24 -0.10 -0.03 0.00 -0.28 0.00 0.00 59.70 59.53 2k9a h MET 124 Cb 0.61 -0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 31.37 2k9a h MET 124 CO -0.05 0.52 0.10 0.74 0.23 0.00 0.00 176.91 178.46 2k9a h PHE 125 N 0.04 0.57 -0.44 1.39 0.04 -1.02 -1.55 116.94 115.98 2k9a h PHE 125 Ca 0.05 -0.06 -0.01 0.00 2.80 0.00 0.00 57.97 60.75 2k9a h PHE 125 Cb 0.39 -0.16 -0.02 0.00 2.20 0.00 0.00 35.95 38.35 2k9a h PHE 125 CO 0.04 0.56 0.23 -0.07 -0.60 0.00 0.00 178.31 178.47 2k9a h LEU 126 N 0.41 0.53 -0.29 1.54 4.07 -1.24 0.02 115.31 120.35 2k9a h LEU 126 Ca 0.11 -0.04 -0.15 0.00 0.08 0.00 0.00 57.88 57.88 2k9a h LEU 126 Cb 0.26 -0.13 -0.00 0.00 1.08 0.00 0.00 40.66 41.87 2k9a h LEU 126 CO -0.00 0.44 -0.41 -0.78 -1.08 0.00 0.00 178.44 176.60 2k9a h ASP 127 N 0.60 0.87 -0.16 -0.43 3.58 -1.00 -1.47 116.42 118.42 2k9a h ASP 127 Ca 0.16 -0.51 -0.11 0.00 0.42 0.00 0.00 57.03 56.99 2k9a h ASP 127 Cb 0.03 -0.25 -0.01 0.00 1.72 0.00 0.00 39.33 40.82 2k9a h ASP 127 CO -0.02 1.20 -0.28 0.22 -2.88 0.00 0.00 179.24 177.48 2k9a h TYR 128 N 0.55 0.72 -0.30 0.28 3.20 -0.77 -2.17 116.97 118.48 2k9a h TYR 128 Ca 0.03 -0.17 -0.12 0.00 3.14 0.00 0.00 58.73 61.61 2k9a h TYR 128 Cb 1.01 -0.17 -0.00 0.00 1.54 0.00 0.00 36.73 39.11 2k9a h TYR 128 CO 0.07 0.84 -0.28 -0.09 -1.64 0.00 0.00 178.16 177.06 2k9a h ARG 129 N 0.54 0.73 -0.01 1.82 2.43 -0.96 -2.98 114.38 115.96 2k9a h ARG 129 Ca 0.07 -0.38 -0.05 0.00 -0.81 0.00 0.00 59.98 58.81 2k9a h ARG 129 Cb 0.76 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.31 2k9a h ARG 129 CO 0.06 0.99 -0.24 0.00 -1.51 0.00 0.00 179.97 179.27 2k9a h ALA 130 N 0.72 1.59 0.00 2.80 0.00 -1.17 -1.85 119.26 121.35 2k9a h ALA 130 Ca 0.05 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 2k9a h ALA 130 Cb 0.85 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 2k9a h ALA 130 CO 0.07 0.31 -0.14 1.49 0.00 0.00 0.00 179.25 180.98 2k9a h GLU 131 N 0.01 0.00 0.00 0.00 4.57 -1.24 -2.38 114.58 115.55 2k9a h GLU 131 Ca -0.00 0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 58.12 2k9a h GLU 131 Cb 0.43 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.02 2k9a h GLU 131 CO 0.03 0.14 -0.26 0.87 -1.18 0.00 0.00 179.01 178.61 2k9a h LYS 132 N 0.00 0.00 -0.00 1.92 1.79 -1.27 -2.01 116.57 117.00 2k9a h LYS 132 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2k9a h LYS 132 Cb 0.51 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.16 2k9a h LYS 132 CO 0.02 0.26 -0.29 0.39 -1.08 0.00 0.00 179.45 178.75 2k9a n GLU 133 N -3.73 0.30 -1.82 3.15 1.02 -0.90 -4.95 120.64 113.71 2k9a n GLU 133 Ca -0.01 -0.14 0.00 0.00 -0.02 0.00 0.00 57.16 56.98 2k9a n GLU 133 Cb 0.37 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.29 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 1.42 0.57 1.47 0.62 0.00 -0.75 -5.02 105.19 103.50 2k9a n GLY 134 Ca 0.09 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.69 2k9a n GLY 134 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2k9a n ARG 135 N -1.10 0.00 0.00 1.61 0.63 -1.22 -5.06 116.66 111.52 2k9a n ARG 135 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 2k9a n ARG 135 Cb 0.49 -0.18 0.00 0.00 0.45 0.00 0.00 32.46 33.22 2k9a n ARG 135 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53