#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 -4.62 3.17 2.03 -1.26 -4.60 116.55 111.27 2k9a n ASP 2 Ca 0.00 0.00 -0.32 0.00 0.52 0.00 0.00 54.79 54.99 2k9a n ASP 2 Cb 0.00 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 40.30 2k9a n ASP 2 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2k9a s ALA 3 N -1.00 3.11 -0.01 -1.67 0.00 -1.26 -5.12 121.76 115.81 2k9a s ALA 3 Ca 0.00 -1.04 -0.14 0.00 0.00 0.00 0.00 51.96 50.78 2k9a s ALA 3 Cb 0.00 -1.16 -0.05 0.00 0.00 0.00 0.00 23.12 21.91 2k9a s ALA 3 CO 0.00 0.64 0.38 -0.51 0.00 0.00 0.00 175.76 176.27 2k9a s LEU 4 N -1.66 4.46 0.28 0.00 1.43 -1.26 -5.08 118.68 116.85 2k9a s LEU 4 Ca 0.19 0.91 -0.18 0.00 -1.03 0.00 0.00 54.13 54.03 2k9a s LEU 4 Cb -0.11 -2.54 0.01 0.00 0.03 0.00 0.00 46.19 43.58 2k9a s LEU 4 CO 0.10 0.33 0.64 -1.83 0.23 0.00 0.00 176.35 175.82 2k9a s GLU 5 N -1.04 1.74 0.00 1.70 -1.05 -1.26 -5.06 118.70 113.73 2k9a s GLU 5 Ca 0.23 -1.10 0.00 0.00 -0.15 0.00 0.00 54.97 53.95 2k9a s GLU 5 Cb -0.16 0.56 0.00 0.00 -0.44 0.00 0.00 34.13 34.09 2k9a s GLU 5 CO 0.12 -0.77 0.00 0.41 0.95 0.00 0.00 175.26 175.97 2k9a n GLY 6 N -0.44 0.74 0.21 -3.83 0.00 -1.26 -5.09 105.19 95.53 2k9a n GLY 6 Ca -0.03 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.91 2k9a n GLY 6 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2k9a h GLU 7 N 0.00 -0.47 0.00 1.61 4.39 -1.96 -3.44 114.58 114.71 2k9a h GLU 7 Ca 0.00 0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.73 2k9a h GLU 7 Cb 0.00 0.11 0.00 0.00 -0.10 0.00 0.00 28.75 28.76 2k9a h GLU 7 CO 0.00 -0.31 -0.21 0.45 -1.16 0.00 0.00 179.01 177.77 2k9a n SER 8 N -4.42 0.45 -1.08 1.42 2.88 -1.26 -5.11 113.62 106.49 2k9a n SER 8 Ca -0.06 0.07 0.00 0.00 -1.33 0.00 0.00 58.87 57.55 2k9a n SER 8 Cb 0.19 -0.49 0.00 0.00 -0.75 0.00 0.00 64.21 63.16 2k9a n SER 8 CO 0.00 0.00 0.00 2.22 -1.23 0.00 0.00 175.04 176.03 2k9a n PHE 9 N -2.95 0.00 -0.37 0.66 -1.74 -1.26 -5.16 117.46 106.64 2k9a n PHE 9 Ca -0.03 0.00 -0.29 0.00 -0.56 0.00 0.00 57.45 56.57 2k9a n PHE 9 Cb 0.11 0.00 0.27 0.00 1.52 0.00 0.00 39.48 41.38 2k9a n PHE 9 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2k9a n ALA 10 N -3.00 -4.00 -0.99 1.98 0.00 -1.26 -4.61 120.51 108.63 2k9a n ALA 10 Ca 0.00 -1.56 0.03 0.00 0.00 0.00 0.00 53.44 51.91 2k9a n ALA 10 Cb 0.00 -1.72 -0.01 0.00 0.00 0.00 0.00 19.45 17.72 2k9a n ALA 10 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2k9a n LEU 11 N -4.96 0.00 -3.85 0.00 7.99 -1.26 -4.78 117.00 110.14 2k9a n LEU 11 Ca 0.07 0.25 -0.27 0.00 -0.01 0.00 0.00 56.01 56.05 2k9a n LEU 11 Cb 0.56 -0.72 -0.17 0.00 -0.11 0.00 0.00 43.42 42.99 2k9a n LEU 11 CO 0.48 -1.60 -0.41 -0.55 -1.51 0.00 0.00 177.39 173.80 2k9a s SER 12 N -4.48 2.72 0.00 -1.43 0.15 -1.26 -4.69 113.70 104.71 2k9a s SER 12 Ca 0.00 -0.64 0.00 0.00 0.70 0.00 0.00 55.95 56.01 2k9a s SER 12 Cb 0.00 -0.80 0.00 0.00 -1.71 0.00 0.00 66.02 63.51 2k9a s SER 12 CO 0.00 -0.21 0.00 0.33 1.20 0.00 0.00 173.24 174.56 2k9a n PHE 13 N 4.94 0.00 -4.22 3.44 7.35 -1.26 -4.62 117.46 123.08 2k9a n PHE 13 Ca -0.11 0.00 -0.14 0.00 -0.76 0.00 0.00 57.45 56.45 2k9a n PHE 13 Cb 0.48 0.00 -0.10 0.00 0.35 0.00 0.00 39.48 40.21 2k9a n PHE 13 CO 0.00 0.00 0.00 -1.54 -0.76 0.00 0.00 176.76 174.46 2k9a s SER 14 N -4.00 0.51 0.00 -2.13 1.04 -1.26 -5.06 113.70 102.80 2k9a s SER 14 Ca 0.00 -1.47 0.00 0.00 0.48 0.00 0.00 55.95 54.96 2k9a s SER 14 Cb 0.00 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.53 2k9a s SER 14 CO 0.00 -0.88 0.00 -1.54 0.98 0.00 0.00 173.24 171.80 2k9a n SER 15 N -0.54 0.00 0.29 7.02 3.41 -1.26 -4.58 113.62 117.96 2k9a n SER 15 Ca 0.03 0.00 0.19 0.00 -0.26 0.00 0.00 58.87 58.83 2k9a n SER 15 Cb 0.65 0.00 0.96 0.00 -0.26 0.00 0.00 64.21 65.57 2k9a n SER 15 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2k9a h ALA 16 N 0.00 1.39 0.00 7.33 0.00 -1.95 0.34 119.26 126.37 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 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2k9a h ALA 16 CO 0.00 -0.20 -0.20 0.45 0.00 0.00 0.00 179.25 179.30 2k9a n SER 17 N -3.29 1.15 0.00 0.00 2.88 -1.26 -3.94 113.62 109.16 2k9a n SER 17 Ca -0.01 -2.34 0.00 0.00 -1.33 0.00 0.00 58.87 55.18 2k9a n SER 17 Cb 0.25 -0.25 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 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 -0.63 0.00 0.24 -3.46 9.92 -0.48 -4.80 116.55 117.34 2k9a n ASP 18 Ca 0.06 0.00 -0.13 0.00 -0.53 0.00 0.00 54.79 54.19 2k9a n ASP 18 Cb 0.61 0.00 -0.07 0.00 -0.64 0.00 0.00 41.12 41.02 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 0.65 -0.64 -0.67 2.24 0.00 -1.75 -1.54 119.26 117.55 2k9a h ALA 19 Ca 0.00 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 2k9a h ALA 19 Cb 0.00 0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 2k9a h ALA 19 CO 0.00 -0.68 0.41 1.49 0.00 0.00 0.00 179.25 180.47 2k9a h GLU 20 N -1.00 0.90 -0.89 0.00 4.57 -0.70 -2.12 114.58 115.35 2k9a h GLU 20 Ca -0.07 -0.08 0.04 0.00 -1.18 0.00 0.00 59.36 58.08 2k9a h GLU 20 Cb 0.59 -0.19 -0.05 0.00 -0.16 0.00 0.00 28.75 28.93 2k9a h GLU 20 CO 0.11 0.64 0.58 0.35 -1.18 0.00 0.00 179.01 179.51 2k9a h PHE 21 N 0.91 1.06 -0.64 0.92 3.04 -1.50 -1.91 116.94 118.82 2k9a h PHE 21 Ca 0.24 0.03 -0.06 0.00 3.98 0.00 0.00 57.97 62.16 2k9a h PHE 21 Cb -0.04 -0.35 -0.03 0.00 2.56 0.00 0.00 35.95 38.09 2k9a h PHE 21 CO -0.02 0.59 0.16 0.22 -2.02 0.00 0.00 178.31 177.24 2k9a h ASP 22 N 1.08 0.97 -0.49 0.41 3.58 -0.64 -2.74 116.42 118.59 2k9a h ASP 22 Ca 0.36 -0.23 0.06 0.00 0.42 0.00 0.00 57.03 57.64 2k9a h ASP 22 Cb 0.08 -0.26 -0.05 0.00 1.72 0.00 0.00 39.33 40.82 2k9a h ASP 22 CO -0.12 0.95 0.19 0.00 -2.88 0.00 0.00 179.24 177.39 2k9a h ALA 23 N 1.05 0.61 -0.04 -0.78 0.00 -0.83 -2.22 119.26 117.06 2k9a h ALA 23 Ca 0.20 0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.18 2k9a h ALA 23 Cb 0.36 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 2k9a h ALA 23 CO 0.00 -0.19 -0.04 0.28 0.00 0.00 0.00 179.25 179.30 2k9a h VAL 24 N 0.38 0.87 -0.99 0.00 2.07 -1.32 -1.88 116.25 115.39 2k9a h VAL 24 Ca 0.23 0.00 0.24 0.00 0.82 0.00 0.00 66.70 67.99 2k9a h VAL 24 Cb 0.22 0.87 -0.08 0.00 -1.52 0.00 0.00 31.29 30.78 2k9a h VAL 24 CO -0.22 0.00 0.64 0.58 0.02 0.00 0.00 177.57 178.59 2k9a h VAL 25 N -0.06 0.60 -0.33 2.57 2.07 -1.14 0.59 116.25 120.55 2k9a h VAL 25 Ca 0.03 -0.14 -0.04 0.00 0.82 0.00 0.00 66.70 67.37 2k9a h VAL 25 Cb 0.11 0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.00 2k9a h VAL 25 CO -0.08 0.08 0.06 1.23 0.02 0.00 0.00 177.57 178.88 2k9a h GLY 26 N 0.42 0.58 0.83 2.17 0.00 -0.77 -2.70 103.07 103.61 2k9a h GLY 26 Ca 0.54 -0.38 0.02 0.00 0.00 0.00 0.00 47.33 47.51 2k9a h GLY 26 CO -0.24 0.36 0.13 -0.97 0.00 0.00 0.00 176.54 175.81 2k9a h TYR 27 N 0.38 0.24 -0.51 5.60 0.05 -0.58 -2.52 116.97 119.63 2k9a h TYR 27 Ca 0.10 0.01 0.07 0.00 0.05 0.00 0.00 58.73 58.97 2k9a h TYR 27 Cb 0.34 -0.07 -0.06 0.00 1.01 0.00 0.00 36.73 37.95 2k9a h TYR 27 CO 0.02 0.13 0.18 -0.07 -1.05 0.00 0.00 178.16 177.36 2k9a h LEU 28 N 0.28 0.17 -0.99 3.88 4.07 -1.36 -1.38 115.31 119.98 2k9a h LEU 28 Ca 0.13 0.07 0.10 0.00 0.08 0.00 0.00 57.88 58.25 2k9a h LEU 28 Cb 0.06 0.05 -0.08 0.00 1.08 0.00 0.00 40.66 41.77 2k9a h LEU 28 CO -0.10 0.12 0.63 -0.33 -1.08 0.00 0.00 178.44 177.68 2k9a h GLU 29 N 0.35 1.00 -0.25 1.13 5.08 -1.13 0.53 114.58 121.30 2k9a h GLU 29 Ca 0.25 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.53 2k9a h GLU 29 Cb 0.28 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 2k9a h GLU 29 CO -0.26 0.66 0.07 -0.44 -1.00 0.00 0.00 179.01 178.04 2k9a h ASP 30 N 1.04 0.31 0.61 1.42 3.32 -0.85 -2.11 116.42 120.16 2k9a h ASP 30 Ca 0.47 -0.03 -0.22 0.00 0.02 0.00 0.00 57.03 57.28 2k9a h ASP 30 Cb 0.39 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.85 2k9a h ASP 30 CO -0.24 0.32 -0.97 0.40 -1.72 0.00 0.00 179.24 177.04 2k9a h ILE 31 N 0.35 1.51 -0.63 0.35 2.04 -0.57 -2.98 117.51 117.58 2k9a h ILE 31 Ca 0.09 -2.77 -0.06 0.00 1.00 0.00 0.00 64.86 63.11 2k9a h ILE 31 Cb 0.13 2.59 -0.03 0.00 -0.74 0.00 0.00 36.82 38.78 2k9a h ILE 31 CO -0.00 0.81 0.14 0.40 0.00 0.00 0.00 178.15 179.49 2k9a h ILE 32 N 0.10 1.25 -0.07 -0.67 2.04 -0.51 -2.02 117.51 117.63 2k9a h ILE 32 Ca -0.06 -0.93 0.00 0.00 1.00 0.00 0.00 64.86 64.87 2k9a h ILE 32 Cb 1.63 0.62 0.00 0.00 -0.74 0.00 0.00 36.82 38.33 2k9a h ILE 32 CO 0.15 0.35 0.00 0.23 0.00 0.00 0.00 178.15 178.88 2k9a n MET 33 N -4.24 1.53 -2.19 2.37 2.81 -0.98 -4.70 117.12 111.72 2k9a n MET 33 Ca 0.05 -0.79 -0.42 0.00 -1.81 0.00 0.00 57.70 54.73 2k9a n MET 33 Cb 0.25 -1.42 -0.03 0.00 -0.71 0.00 0.00 33.22 31.31 2k9a n MET 33 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 2k9a s ASP 34 N -1.77 6.86 0.12 7.83 2.15 -0.76 -4.94 116.67 126.17 2k9a s ASP 34 Ca 0.36 2.38 -0.19 0.00 0.43 0.00 0.00 52.55 55.52 2k9a s ASP 34 Cb 0.19 -2.60 -0.06 0.00 -0.30 0.00 0.00 42.92 40.15 2k9a s ASP 34 CO 0.29 -0.58 1.77 -2.24 -0.17 0.00 0.00 175.17 174.25 2k9a h ASP 35 N 5.89 0.21 0.20 -0.34 2.03 -1.90 -1.66 116.42 120.85 2k9a h ASP 35 Ca -0.44 -0.00 -0.01 0.00 -0.73 0.00 0.00 57.03 55.85 2k9a h ASP 35 Cb 1.21 -0.04 -0.00 0.00 -0.83 0.00 0.00 39.33 39.67 2k9a h ASP 35 CO 0.81 0.15 -0.04 -0.08 -1.03 0.00 0.00 179.24 179.05 2k9a h GLU 36 N 0.26 0.00 0.13 4.15 4.81 -1.94 -2.26 114.58 119.73 2k9a h GLU 36 Ca 0.08 0.00 -0.30 0.00 -0.13 0.00 0.00 59.36 59.01 2k9a h GLU 36 Cb -0.01 0.00 0.03 0.00 0.63 0.00 0.00 28.75 29.40 2k9a h GLU 36 CO -0.03 0.04 -1.26 0.35 -0.73 0.00 0.00 179.01 177.38 2k9a h PHE 37 N 0.00 1.01 -0.68 0.92 3.57 -1.59 -2.46 116.94 117.72 2k9a h PHE 37 Ca -0.00 -0.64 -0.07 0.00 3.53 0.00 0.00 57.97 60.78 2k9a h PHE 37 Cb 0.15 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 38.78 2k9a h PHE 37 CO 0.00 1.48 0.13 1.96 -2.23 0.00 0.00 178.31 179.65 2k9a h GLN 38 N 0.27 1.11 -0.15 1.11 4.20 -0.82 -1.14 115.11 119.69 2k9a h GLN 38 Ca -0.19 -0.28 -0.05 0.00 0.06 0.00 0.00 58.65 58.18 2k9a h GLN 38 Cb 1.93 -0.14 -0.00 0.00 0.30 0.00 0.00 27.48 29.57 2k9a h GLN 38 CO 0.24 1.00 -0.12 1.25 -0.67 0.00 0.00 178.83 180.53 2k9a h LEU 39 N 1.03 0.37 0.18 1.46 6.46 -1.55 -1.46 115.31 121.80 2k9a h LEU 39 Ca 0.21 -0.46 -0.00 0.00 -0.12 0.00 0.00 57.88 57.51 2k9a h LEU 39 Cb 0.41 -0.10 -0.00 0.00 -0.73 0.00 0.00 40.66 40.24 2k9a h LEU 39 CO 0.01 0.74 -0.11 0.25 -0.62 0.00 0.00 178.44 178.71 2k9a h LEU 40 N -0.01 -0.29 -0.07 2.25 5.85 -1.36 0.65 115.31 122.33 2k9a h LEU 40 Ca 0.03 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.77 2k9a h LEU 40 Cb 0.63 0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.74 2k9a h LEU 40 CO 0.03 -0.18 0.03 -0.61 -0.34 0.00 0.00 178.44 177.37 2k9a h GLN 41 N -0.29 0.10 -0.25 1.25 5.75 -1.27 -2.76 115.11 117.65 2k9a h GLN 41 Ca -0.01 -0.02 -0.05 0.00 -0.15 0.00 0.00 58.65 58.42 2k9a h GLN 41 Cb 0.24 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.76 2k9a h GLN 41 CO 0.01 0.19 -0.06 -0.09 -2.65 0.00 0.00 178.83 176.24 2k9a h ARG 42 N -0.01 0.38 -0.08 1.69 2.43 -1.22 -0.15 114.38 117.42 2k9a h ARG 42 Ca 0.02 -0.08 -0.00 0.00 -0.81 0.00 0.00 59.98 59.11 2k9a h ARG 42 Cb 0.12 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 29.61 2k9a h ARG 42 CO -0.00 0.46 0.04 -0.97 -1.51 0.00 0.00 179.97 177.99 2k9a h ASN 43 N 0.37 0.11 -0.02 -3.80 -0.73 -0.65 -1.94 115.58 108.92 2k9a h ASN 43 Ca 0.08 -0.10 -0.16 0.00 1.87 0.00 0.00 56.30 57.98 2k9a h ASN 43 Cb 0.34 -0.03 0.01 0.00 0.27 0.00 0.00 38.32 38.91 2k9a h ASN 43 CO 0.01 0.18 -0.62 -0.26 -0.37 0.00 0.00 177.43 176.37 2k9a h PHE 44 N 0.03 0.66 -0.25 0.67 -1.00 -1.35 -3.21 116.94 112.49 2k9a h PHE 44 Ca 0.03 -0.35 0.07 0.00 2.81 0.00 0.00 57.97 60.53 2k9a h PHE 44 Cb 0.10 -0.08 -0.01 0.00 3.61 0.00 0.00 35.95 39.57 2k9a h PHE 44 CO -0.04 1.16 0.22 0.52 -1.61 0.00 0.00 178.31 178.57 2k9a h MET 45 N -0.02 0.00 -0.36 1.51 2.86 -1.03 -0.02 114.93 117.87 2k9a h MET 45 Ca -0.07 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.56 2k9a h MET 45 Cb 1.32 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.96 2k9a h MET 45 CO 0.12 0.00 0.18 0.22 1.06 0.00 0.00 176.91 178.50 2k9a h ASP 46 N 0.00 0.43 0.28 1.22 1.82 -1.34 -1.60 116.42 117.22 2k9a h ASP 46 Ca 0.12 -0.03 -0.33 0.00 -0.39 0.00 0.00 57.03 56.40 2k9a h ASP 46 Cb 0.56 -0.11 -0.03 0.00 0.68 0.00 0.00 39.33 40.43 2k9a h ASP 46 CO -0.00 0.36 -1.88 1.17 -1.61 0.00 0.00 179.24 177.28 2k9a n LYS 47 N -4.43 0.71 0.03 0.28 3.00 -0.13 -3.88 118.16 113.74 2k9a n LYS 47 Ca 0.02 0.28 -0.11 0.00 -0.00 0.00 0.00 58.31 58.50 2k9a n LYS 47 Cb 0.10 -1.74 -0.05 0.00 0.00 0.00 0.00 35.03 33.34 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 0.04 -0.24 0.00 5.64 -1.99 -0.98 -1.50 116.97 117.94 2k9a h TYR 48 Ca -0.37 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.37 2k9a h TYR 48 Cb 2.03 0.11 0.00 0.00 2.00 0.00 0.00 36.73 40.87 2k9a h TYR 48 CO 0.05 -0.14 0.00 2.48 -0.00 0.00 0.00 178.16 180.54 2k9a n TYR 49 N -5.22 0.75 -0.01 4.88 0.18 -0.63 -2.05 117.16 115.05 2k9a n TYR 49 Ca -0.05 0.30 -0.13 0.00 1.88 0.00 0.00 57.90 59.91 2k9a n TYR 49 Cb 0.15 -0.99 -0.10 0.00 -0.38 0.00 0.00 39.34 38.02 2k9a n TYR 49 CO 0.00 0.00 0.00 -0.07 -2.08 0.00 0.00 176.86 174.71 2k9a h LEU 50 N 0.00 -0.03 -0.60 -3.48 -0.00 -1.39 -3.29 115.31 106.51 2k9a h LEU 50 Ca 0.00 -0.57 -0.12 0.00 -0.00 0.00 0.00 57.88 57.19 2k9a h LEU 50 Cb 0.31 0.01 -0.01 0.00 -0.00 0.00 0.00 40.66 40.97 2k9a h LEU 50 CO 0.00 0.57 -0.23 -0.33 -0.00 0.00 0.00 178.44 178.45 2k9a h GLU 51 N -0.65 0.87 -5.79 1.13 5.08 -1.30 -3.37 114.58 110.54 2k9a h GLU 51 Ca -0.00 -0.37 -0.44 0.00 -1.00 0.00 0.00 59.36 57.55 2k9a h GLU 51 Cb 0.60 -0.03 -0.07 0.00 0.50 0.00 0.00 28.75 29.75 2k9a h GLU 51 CO 0.01 1.01 1.24 -0.06 -1.00 0.00 0.00 179.01 180.21 2k9a s PHE 52 N -4.62 2.18 -0.11 4.33 0.40 -0.87 -4.95 117.98 114.35 2k9a s PHE 52 Ca -0.10 -0.15 -0.05 0.00 -0.60 0.00 0.00 56.93 56.02 2k9a s PHE 52 Cb 0.13 -4.32 -0.04 0.00 0.51 0.00 0.00 43.02 39.30 2k9a s PHE 52 CO 0.85 -1.69 0.09 -2.00 0.70 0.00 0.00 175.22 173.18 2k9a s GLU 53 N 5.91 3.31 -0.65 0.44 2.12 -1.26 -4.80 118.70 123.77 2k9a s GLU 53 Ca 0.61 -0.22 -0.26 0.00 0.36 0.00 0.00 54.97 55.46 2k9a s GLU 53 Cb -0.02 -3.07 -0.08 0.00 0.26 0.00 0.00 34.13 31.22 2k9a s GLU 53 CO 0.01 0.75 2.27 0.34 -0.54 0.00 0.00 175.26 178.09 2k9a s ASP 54 N -0.95 4.47 0.21 -1.70 2.15 -1.26 -4.88 116.67 114.71 2k9a s ASP 54 Ca 0.14 0.45 0.03 0.00 0.43 0.00 0.00 52.55 53.60 2k9a s ASP 54 Cb -0.12 -2.53 -0.01 0.00 -0.30 0.00 0.00 42.92 39.96 2k9a s ASP 54 CO 0.03 -3.10 0.10 0.35 -0.17 0.00 0.00 175.17 172.38 2k9a n THR 55 N 8.11 0.00 0.16 1.71 -2.24 -1.26 -5.06 114.28 115.69 2k9a n THR 55 Ca 0.38 -1.32 0.02 0.00 -2.27 0.00 0.00 64.05 60.86 2k9a n THR 55 Cb 0.50 0.52 -0.01 0.00 -2.10 0.00 0.00 70.33 69.25 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 -0.46 3.61 -3.31 -0.78 0.00 -1.26 -5.01 120.64 113.42 2k9a n GLU 56 Ca -0.01 -0.26 -0.38 0.00 0.00 0.00 0.00 57.16 56.51 2k9a n GLU 56 Cb 0.34 -0.81 -0.06 0.00 0.00 0.00 0.00 31.44 30.91 2k9a n GLU 56 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.13 175.13 2k9a s GLU 57 N -0.95 4.14 -0.31 3.44 2.56 -1.26 -5.05 118.70 121.27 2k9a s GLU 57 Ca 0.02 0.67 -0.19 0.00 0.00 0.00 0.00 54.97 55.48 2k9a s GLU 57 Cb 0.03 -3.19 -0.01 0.00 2.00 0.00 0.00 34.13 32.95 2k9a s GLU 57 CO 0.10 0.62 0.56 -0.80 -0.56 0.00 0.00 175.26 175.18 2k9a s ASN 58 N -1.19 6.42 -0.12 -1.70 0.01 -1.26 -5.06 114.94 112.04 2k9a s ASN 58 Ca 0.30 0.30 -0.04 0.00 -0.71 0.00 0.00 52.86 52.71 2k9a s ASN 58 Cb -0.19 -2.30 -0.03 0.00 0.41 0.00 0.00 41.25 39.14 2k9a s ASN 58 CO 0.18 -0.43 0.02 -0.54 -1.51 0.00 0.00 177.10 174.83 2k9a s LYS 59 N 2.46 3.36 0.00 -0.60 1.02 -1.26 -4.98 119.74 119.74 2k9a s LYS 59 Ca 0.22 -0.38 0.17 0.00 0.02 0.00 0.00 55.97 56.00 2k9a s LYS 59 Cb -0.15 -2.95 0.79 0.00 -0.52 0.00 0.00 37.83 35.00 2k9a s LYS 59 CO 0.12 0.54 1.53 1.28 -0.92 0.00 0.00 175.35 177.91 2k9a n LEU 60 N 2.65 0.00 0.00 3.17 4.77 -1.26 -2.95 117.00 123.38 2k9a n LEU 60 Ca -0.18 0.41 0.03 0.00 -0.03 0.00 0.00 56.01 56.25 2k9a n LEU 60 Cb 0.53 -0.41 0.15 0.00 -2.33 0.00 0.00 43.42 41.36 2k9a n LEU 60 CO 0.31 -0.17 0.61 0.00 -1.33 0.00 0.00 177.39 176.81 2k9a n ILE 61 N -1.41 1.50 0.13 -0.08 0.13 -1.26 -2.34 119.36 116.03 2k9a n ILE 61 Ca 0.06 0.38 0.00 0.00 -1.10 0.00 0.00 62.75 62.09 2k9a n ILE 61 Cb 0.17 -1.25 0.30 0.00 -0.84 0.00 0.00 39.64 38.02 2k9a n ILE 61 CO 0.00 0.00 0.00 1.88 2.80 0.00 0.00 176.55 181.23 2k9a h TYR 62 N 0.00 0.16 0.08 9.51 0.05 -1.97 -2.79 116.97 122.01 2k9a h TYR 62 Ca 0.00 -0.04 -0.00 0.00 0.05 0.00 0.00 58.73 58.74 2k9a h TYR 62 Cb 0.12 -0.04 0.00 0.00 1.01 0.00 0.00 36.73 37.82 2k9a h TYR 62 CO 0.00 0.49 -0.04 1.15 -1.05 0.00 0.00 178.16 178.71 2k9a h THR 63 N 0.13 1.18 -0.31 -2.88 2.02 -1.76 -2.43 112.91 108.86 2k9a h THR 63 Ca 0.01 -1.35 0.04 0.00 0.77 0.00 0.00 66.41 65.89 2k9a h THR 63 Cb 0.69 2.00 -0.04 0.00 -1.74 0.00 0.00 68.15 69.06 2k9a h THR 63 CO 0.05 0.31 0.06 -0.65 0.37 0.00 0.00 175.52 175.67 2k9a h PRO 64 N -0.77 0.17 -0.80 6.66 0.11 -1.72 -1.33 132.00 134.32 2k9a h PRO 64 Ca -0.01 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.09 2k9a h PRO 64 Cb 0.59 -0.04 -0.04 0.00 0.11 0.00 0.00 31.00 31.62 2k9a h PRO 64 CO 0.02 0.11 0.51 0.82 -0.21 0.00 0.00 178.00 179.25 2k9a h ILE 65 N 0.18 1.22 -0.82 4.15 2.04 -1.61 -2.32 117.51 120.34 2k9a h ILE 65 Ca 0.14 -0.43 0.01 0.00 1.00 0.00 0.00 64.86 65.58 2k9a h ILE 65 Cb 0.15 0.06 -0.04 0.00 -0.74 0.00 0.00 36.82 36.25 2k9a h ILE 65 CO -0.19 0.22 0.54 0.15 0.00 0.00 0.00 178.15 178.87 2k9a h PHE 66 N 1.09 1.03 -0.98 1.37 3.57 -0.90 -2.13 116.94 119.99 2k9a h PHE 66 Ca 0.29 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.82 2k9a h PHE 66 Cb -0.09 -0.35 -0.05 0.00 2.79 0.00 0.00 35.95 38.26 2k9a h PHE 66 CO -0.01 0.65 0.65 -0.91 -2.23 0.00 0.00 178.31 176.46 2k9a h ASN 67 N 1.11 1.13 -0.03 0.41 2.35 -0.73 -1.51 115.58 118.32 2k9a h ASN 67 Ca 0.30 -0.03 -0.06 0.00 -0.55 0.00 0.00 56.30 55.96 2k9a h ASN 67 Cb -0.12 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 37.95 2k9a h ASN 67 CO -0.07 0.82 -0.15 -0.08 -1.65 0.00 0.00 177.43 176.31 2k9a h GLU 68 N 1.34 0.34 -0.39 0.81 4.57 -0.98 -1.94 114.58 118.33 2k9a h GLU 68 Ca 0.36 -0.09 -0.10 0.00 -1.18 0.00 0.00 59.36 58.35 2k9a h GLU 68 Cb -0.15 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 28.38 2k9a h GLU 68 CO -0.08 0.49 -0.16 -0.92 -1.18 0.00 0.00 179.01 177.16 2k9a h TYR 69 N 0.32 0.79 0.00 0.92 3.20 -0.71 0.99 116.97 122.48 2k9a h TYR 69 Ca 0.06 -0.16 -0.14 0.00 3.14 0.00 0.00 58.73 61.63 2k9a h TYR 69 Cb 0.45 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.50 2k9a h TYR 69 CO 0.01 0.83 -0.67 0.82 -1.64 0.00 0.00 178.16 177.51 2k9a h ILE 70 N 0.64 1.43 0.00 1.81 1.08 -0.97 -0.06 117.51 121.45 2k9a h ILE 70 Ca 0.10 -2.33 -0.22 0.00 -0.39 0.00 0.00 64.86 62.03 2k9a h ILE 70 Cb 0.63 2.27 -0.03 0.00 -3.07 0.00 0.00 36.82 36.62 2k9a h ILE 70 CO 0.04 0.65 -1.26 0.28 -0.69 0.00 0.00 178.15 177.18 2k9a h SER 71 N 0.00 0.00 0.00 1.72 0.02 -1.11 -2.37 113.55 111.82 2k9a h SER 71 Ca -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 2k9a h SER 71 Cb 1.22 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.76 2k9a h SER 71 CO 0.09 0.85 -0.36 -0.11 -1.14 0.00 0.00 176.83 176.16 2k9a n LEU 72 N -3.14 1.21 0.09 5.07 -0.00 0.32 -4.17 117.00 116.38 2k9a n LEU 72 Ca -0.07 0.49 -0.05 0.00 -0.00 0.00 0.00 56.01 56.38 2k9a n LEU 72 Cb 0.93 -0.74 -0.02 0.00 -0.00 0.00 0.00 43.42 43.59 2k9a n LEU 72 CO 0.45 -0.48 0.15 0.58 -0.00 0.00 0.00 177.39 178.09 2k9a h VAL 73 N -0.66 0.00 -0.66 1.96 2.07 -1.22 -2.46 116.25 115.28 2k9a h VAL 73 Ca 0.00 -0.57 0.16 0.00 0.82 0.00 0.00 66.70 67.10 2k9a h VAL 73 Cb 0.36 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.09 2k9a h VAL 73 CO 0.00 0.00 0.46 -0.08 0.02 0.00 0.00 177.57 177.97 2k9a h GLU 74 N -0.87 0.21 -0.03 1.57 4.57 -1.51 -0.80 114.58 117.72 2k9a h GLU 74 Ca -0.03 -0.01 -0.25 0.00 -1.18 0.00 0.00 59.36 57.89 2k9a h GLU 74 Cb 0.23 -0.05 0.02 0.00 -0.16 0.00 0.00 28.75 28.79 2k9a h GLU 74 CO 0.05 0.14 -0.95 -0.22 -1.18 0.00 0.00 179.01 176.85 2k9a h LYS 75 N 0.22 0.70 -0.64 1.92 3.64 -1.53 -2.58 116.57 118.29 2k9a h LYS 75 Ca 0.32 -0.71 0.05 0.00 -1.27 0.00 0.00 60.65 59.05 2k9a h LYS 75 Cb 0.96 0.19 -0.05 0.00 -0.41 0.00 0.00 32.23 32.92 2k9a h LYS 75 CO -0.06 1.29 0.36 -0.92 -2.27 0.00 0.00 179.45 177.85 2k9a h TYR 76 N 0.38 0.66 -0.15 1.91 3.20 -0.65 -0.29 116.97 122.03 2k9a h TYR 76 Ca -0.11 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.73 2k9a h TYR 76 Cb 1.60 -0.20 -0.00 0.00 1.54 0.00 0.00 36.73 39.66 2k9a h TYR 76 CO 0.10 0.33 -0.10 0.82 -1.64 0.00 0.00 178.16 177.67 2k9a h ILE 77 N 0.67 1.33 -0.35 1.81 2.04 -1.50 -2.53 117.51 118.98 2k9a h ILE 77 Ca 0.28 -1.19 0.03 0.00 1.00 0.00 0.00 64.86 64.98 2k9a h ILE 77 Cb 0.15 1.79 -0.03 0.00 -0.74 0.00 0.00 36.82 37.99 2k9a h ILE 77 CO -0.17 0.35 0.16 -0.08 0.00 0.00 0.00 178.15 178.41 2k9a h GLU 78 N -0.02 0.33 0.31 2.37 4.81 -1.17 -1.83 114.58 119.38 2k9a h GLU 78 Ca 0.03 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.23 2k9a h GLU 78 Cb 0.59 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.90 2k9a h GLU 78 CO 0.03 0.22 -0.15 0.93 -0.73 0.00 0.00 179.01 179.31 2k9a h GLU 79 N 0.34 -0.39 -0.14 1.92 4.39 -1.09 -1.89 114.58 117.71 2k9a h GLU 79 Ca 0.15 0.03 0.04 0.00 0.34 0.00 0.00 59.36 59.92 2k9a h GLU 79 Cb 0.08 0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.81 2k9a h GLU 79 CO -0.12 -0.18 0.11 1.96 -1.16 0.00 0.00 179.01 179.62 2k9a h GLN 80 N -0.53 0.00 0.16 2.33 1.08 -1.36 -1.86 115.11 114.93 2k9a h GLN 80 Ca -0.04 0.00 -0.30 0.00 -1.45 0.00 0.00 58.65 56.86 2k9a h GLN 80 Cb 0.40 0.00 0.02 0.00 -0.05 0.00 0.00 27.48 27.85 2k9a h GLN 80 CO 0.07 0.00 -1.30 -0.07 -0.95 0.00 0.00 178.83 176.58 2k9a h LEU 81 N 0.00 0.72 -1.35 1.46 3.38 -1.13 -3.26 115.31 115.12 2k9a h LEU 81 Ca 0.07 -0.71 -0.04 0.00 0.09 0.00 0.00 57.88 57.29 2k9a h LEU 81 Cb 0.29 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 2k9a h LEU 81 CO -0.00 1.54 -0.17 -0.07 0.09 0.00 0.00 178.44 179.83 2k9a h LEU 82 N 0.18 0.00 -2.12 1.67 -0.00 -0.57 -2.41 115.31 112.06 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 1.98 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.64 2k9a h LEU 82 CO 0.24 0.17 0.14 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 1.08 -1.44 -1.64 115.11 114.24 2k9a h GLN 83 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2k9a h GLN 83 Cb 0.62 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.05 2k9a h GLN 83 CO 0.02 0.00 0.00 0.54 -0.95 0.00 0.00 178.83 178.44 2k9a n ARG 84 N -2.73 5.40 -3.52 1.46 1.74 -1.03 -4.92 116.66 113.04 2k9a n ARG 84 Ca -0.02 -0.02 -0.29 0.00 -0.77 0.00 0.00 57.85 56.75 2k9a n ARG 84 Cb 0.19 -0.43 -0.12 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 -0.78 0.49 -1.12 0.55 1.01 -0.62 -4.97 121.20 115.76 2k9a s ILE 85 Ca 0.00 -2.01 0.14 0.00 0.00 0.00 0.00 60.65 58.78 2k9a s ILE 85 Cb 0.00 -1.36 0.15 0.00 0.01 0.00 0.00 42.46 41.27 2k9a s ILE 85 CO 0.00 -0.99 1.43 -2.65 0.00 0.00 0.00 174.94 172.74 2k9a n PRO 86 N 3.81 0.06 -0.32 2.79 -0.02 -1.22 -2.00 135.00 138.09 2k9a n PRO 86 Ca 0.13 0.23 0.08 0.00 -2.02 0.00 0.00 63.50 61.91 2k9a n PRO 86 Cb 0.37 -1.50 0.21 0.00 -0.02 0.00 0.00 33.50 32.56 2k9a n PRO 86 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2k9a n GLU 87 N -1.44 2.75 -2.07 -0.52 -0.58 -1.26 -5.03 120.64 112.49 2k9a n GLU 87 Ca 0.04 -2.57 -0.37 0.00 -0.42 0.00 0.00 57.16 53.85 2k9a n GLU 87 Cb 0.15 -1.63 0.02 0.00 -0.57 0.00 0.00 31.44 29.41 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 -2.31 2.54 -0.41 -0.32 5.36 -0.85 -5.02 117.98 116.98 2k9a s PHE 88 Ca 0.35 1.50 0.02 0.00 -0.96 0.00 0.00 56.93 57.83 2k9a s PHE 88 Cb 0.27 -3.49 0.15 0.00 -0.34 0.00 0.00 43.02 39.60 2k9a s PHE 88 CO 0.09 -2.06 0.26 1.21 -1.46 0.00 0.00 175.22 173.26 2k9a s ASN 89 N -1.42 2.92 0.56 6.13 3.84 -1.26 -4.97 114.94 120.73 2k9a s ASN 89 Ca 0.72 -2.61 0.26 0.00 0.21 0.00 0.00 52.86 51.45 2k9a s ASN 89 Cb -0.31 -0.66 1.65 0.00 -0.55 0.00 0.00 41.25 41.38 2k9a s ASN 89 CO 0.35 -0.25 2.20 -0.03 -2.79 0.00 0.00 177.10 176.59 2k9a h MET 90 N 6.53 0.00 0.49 0.43 1.85 -1.97 -1.31 114.93 120.94 2k9a h MET 90 Ca 0.09 0.00 -0.02 0.00 -0.61 0.00 0.00 59.70 59.16 2k9a h MET 90 Cb 0.93 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.97 2k9a h MET 90 CO 0.38 0.02 -0.23 0.00 -0.40 0.00 0.00 176.91 176.68 2k9a h ALA 91 N 1.98 -0.65 0.00 0.39 0.00 -2.00 -0.14 119.26 118.84 2k9a h ALA 91 Ca -0.00 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 54.63 2k9a h ALA 91 Cb 0.06 0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 2k9a h ALA 91 CO 0.00 -0.81 -0.53 0.00 0.00 0.00 0.00 179.25 177.91 2k9a h ALA 92 N -0.31 0.93 -0.31 0.00 0.00 -1.95 -2.82 119.26 114.81 2k9a h ALA 92 Ca -0.07 -0.49 -0.12 0.00 0.00 0.00 0.00 54.91 54.24 2k9a h ALA 92 Cb 0.55 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2k9a h ALA 92 CO 0.11 0.67 -0.28 0.35 0.00 0.00 0.00 179.25 180.10 2k9a h PHE 93 N 0.00 0.87 0.04 0.00 3.57 -1.15 -2.50 116.94 117.77 2k9a h PHE 93 Ca -0.01 -0.26 -0.00 0.00 3.53 0.00 0.00 57.97 61.24 2k9a h PHE 93 Cb 1.07 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 39.62 2k9a h PHE 93 CO 0.00 1.01 -0.02 1.79 -2.23 0.00 0.00 178.31 178.86 2k9a h THR 94 N 0.49 1.28 -0.83 4.41 1.35 -1.01 -0.34 112.91 118.25 2k9a h THR 94 Ca 0.05 -1.08 0.10 0.00 -0.55 0.00 0.00 66.41 64.93 2k9a h THR 94 Cb 0.85 1.99 -0.06 0.00 -1.73 0.00 0.00 68.15 69.20 2k9a h THR 94 CO 0.07 0.27 0.54 0.00 -0.25 0.00 0.00 175.52 176.15 2k9a h THR 95 N -0.53 0.95 0.02 6.82 1.03 -1.58 -0.88 112.91 118.74 2k9a h THR 95 Ca -0.01 -0.27 -0.21 0.00 -0.01 0.00 0.00 66.41 65.91 2k9a h THR 95 Cb 0.48 0.10 -0.01 0.00 -1.07 0.00 0.00 68.15 67.65 2k9a h THR 95 CO 0.01 0.14 -0.94 0.74 -0.01 0.00 0.00 175.52 175.47 2k9a h THR 96 N 0.79 1.50 -0.46 0.00 2.02 -1.42 -3.25 112.91 112.09 2k9a h THR 96 Ca 0.38 -2.70 -0.06 0.00 0.77 0.00 0.00 66.41 64.81 2k9a h THR 96 Cb 0.43 2.54 -0.02 0.00 -1.74 0.00 0.00 68.15 69.36 2k9a h THR 96 CO -0.15 0.79 0.04 0.25 0.37 0.00 0.00 175.52 176.82 2k9a h LEU 97 N 0.11 0.68 -1.24 2.58 6.46 0.28 0.11 115.31 124.29 2k9a h LEU 97 Ca -0.06 -0.14 0.22 0.00 -0.12 0.00 0.00 57.88 57.79 2k9a h LEU 97 Cb 1.59 -0.18 -0.09 0.00 -0.73 0.00 0.00 40.66 41.24 2k9a h LEU 97 CO 0.15 0.72 0.63 1.56 -0.62 0.00 0.00 178.44 180.88 2k9a h GLN 98 N 0.69 0.53 0.00 1.25 4.20 -1.34 0.44 115.11 120.88 2k9a h GLN 98 Ca 0.14 -0.03 -0.27 0.00 0.06 0.00 0.00 58.65 58.55 2k9a h GLN 98 Cb 0.36 -0.12 -0.05 0.00 0.30 0.00 0.00 27.48 27.97 2k9a h GLN 98 CO 0.01 0.35 -2.20 -2.39 -0.67 0.00 0.00 178.83 173.94 2k9a n HIS 99 N -4.67 0.00 0.68 2.96 1.44 -1.09 -4.24 115.22 110.30 2k9a n HIS 99 Ca 0.23 0.00 0.08 0.00 -2.01 0.00 0.00 57.72 56.02 2k9a n HIS 99 Cb 0.71 -0.82 0.38 0.00 0.12 0.00 0.00 29.99 30.38 2k9a n HIS 99 CO 0.00 0.00 0.00 1.58 -2.81 0.00 0.00 176.34 175.11 2k9a n HIS 100 N -2.59 0.00 0.30 -1.40 -0.00 0.36 -2.63 115.22 109.26 2k9a n HIS 100 Ca -0.25 0.00 0.19 0.00 -0.00 0.00 0.00 57.72 57.66 2k9a n HIS 100 Cb 0.99 -0.35 0.99 0.00 -0.00 0.00 0.00 29.99 31.62 2k9a n HIS 100 CO 0.00 0.00 0.00 1.57 -0.00 0.00 0.00 176.34 177.91 2k9a h LYS 101 N 0.00 0.00 0.00 1.57 2.10 -1.11 -1.15 116.57 117.98 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 0.19 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.52 2k9a h LYS 101 CO 0.00 0.00 0.00 -3.47 -2.00 0.00 0.00 179.45 173.98 2k9a n ASP 102 N -2.87 0.36 -0.04 7.07 2.03 -1.08 -3.49 116.55 118.53 2k9a n ASP 102 Ca -0.02 0.63 -0.05 0.00 0.52 0.00 0.00 54.79 55.87 2k9a n ASP 102 Cb 0.10 -0.69 -0.02 0.00 -0.72 0.00 0.00 41.12 39.80 2k9a n ASP 102 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 2k9a n GLU 103 N -1.94 0.27 -0.77 -0.67 0.00 -0.44 -5.03 120.64 112.07 2k9a n GLU 103 Ca 0.01 0.11 -0.30 0.00 0.00 0.00 0.00 57.16 56.98 2k9a n GLU 103 Cb 0.10 -0.96 0.25 0.00 0.00 0.00 0.00 31.44 30.83 2k9a n GLU 103 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.13 177.27 2k9a s VAL 104 N -2.06 1.56 -0.39 6.31 -7.23 -1.22 -4.88 120.40 112.49 2k9a s VAL 104 Ca -0.15 0.00 -0.28 0.00 -1.81 0.00 0.00 61.98 59.74 2k9a s VAL 104 Cb 0.02 -2.28 -0.02 0.00 0.56 0.00 0.00 36.38 34.66 2k9a s VAL 104 CO 0.22 0.00 1.78 0.00 -0.31 0.00 0.00 175.10 176.80 2k9a s ALA 105 N -2.67 2.74 0.46 1.32 0.00 -1.26 -4.85 121.76 117.49 2k9a s ALA 105 Ca 0.69 0.05 0.13 0.00 0.00 0.00 0.00 51.96 52.83 2k9a s ALA 105 Cb -0.14 -4.07 1.04 0.00 0.00 0.00 0.00 23.12 19.95 2k9a s ALA 105 CO 0.58 -2.87 2.04 0.78 0.00 0.00 0.00 175.76 176.29 2k9a h GLY 106 N 14.14 0.10 1.14 0.00 0.00 -1.90 -2.42 103.07 114.13 2k9a h GLY 106 Ca -0.31 -0.05 -0.02 0.00 0.00 0.00 0.00 47.33 46.94 2k9a h GLY 106 CO 1.07 0.05 0.40 -1.80 0.00 0.00 0.00 176.54 176.27 2k9a h ASP 107 N 0.10 1.01 -0.01 0.19 3.58 -1.95 0.13 116.42 119.46 2k9a h ASP 107 Ca 0.02 -0.10 -0.02 0.00 0.42 0.00 0.00 57.03 57.35 2k9a h ASP 107 Cb 0.19 -0.26 0.00 0.00 1.72 0.00 0.00 39.33 40.98 2k9a h ASP 107 CO 0.01 0.83 -0.05 0.40 -2.88 0.00 0.00 179.24 177.55 2k9a h ILE 108 N 1.12 1.52 0.00 2.25 2.04 -1.85 -3.23 117.51 119.36 2k9a h ILE 108 Ca 0.28 -1.62 -0.04 0.00 1.00 0.00 0.00 64.86 64.48 2k9a h ILE 108 Cb 0.07 2.58 -0.01 0.00 -0.74 0.00 0.00 36.82 38.73 2k9a h ILE 108 CO -0.04 0.43 -0.19 0.15 0.00 0.00 0.00 178.15 178.50 2k9a h PHE 109 N -0.60 0.00 -1.06 1.37 3.57 -1.41 -2.66 116.94 116.16 2k9a h PHE 109 Ca -0.00 0.00 0.31 0.00 3.53 0.00 0.00 57.97 61.80 2k9a h PHE 109 Cb 0.73 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 39.43 2k9a h PHE 109 CO 0.16 0.19 0.82 0.22 -2.23 0.00 0.00 178.31 177.47 2k9a h ASP 110 N 0.00 0.00 0.08 0.41 3.58 -0.75 0.55 116.42 120.29 2k9a h ASP 110 Ca -0.00 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.44 2k9a h ASP 110 Cb 0.36 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.41 2k9a h ASP 110 CO 0.02 0.00 -0.04 -0.03 -2.88 0.00 0.00 179.24 176.32 2k9a h MET 111 N 0.00 -0.11 0.00 0.28 4.05 -1.63 -3.16 114.93 114.36 2k9a h MET 111 Ca 0.50 0.01 -0.02 0.00 -0.28 0.00 0.00 59.70 59.91 2k9a h MET 111 Cb 2.14 0.02 -0.00 0.00 -0.80 0.00 0.00 31.60 32.96 2k9a h MET 111 CO -0.01 0.40 -0.11 -0.07 0.23 0.00 0.00 176.91 177.36 2k9a h LEU 112 N -0.70 0.00 -1.90 3.39 3.38 -0.67 -2.79 115.31 116.01 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 0.56 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.28 2k9a h LEU 112 CO 0.02 0.11 0.61 0.25 0.09 0.00 0.00 178.44 179.51 2k9a h LEU 113 N 0.00 0.00 0.00 1.67 5.85 -0.05 0.12 115.31 122.90 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 0.40 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.43 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 -3.89 0.00 0.29 1.05 -2.24 -1.06 -2.30 114.28 106.13 2k9a n THR 114 Ca 0.14 0.00 0.14 0.00 -2.27 0.00 0.00 64.05 62.06 2k9a n THR 114 Cb 0.86 -0.79 0.69 0.00 -2.10 0.00 0.00 70.33 68.99 2k9a n THR 114 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 2k9a h PHE 115 N 0.00 0.00 0.00 4.78 0.04 -1.02 -3.36 116.94 117.37 2k9a h PHE 115 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 2k9a h PHE 115 Cb 0.00 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.15 2k9a h PHE 115 CO 0.00 0.00 0.00 -2.37 -0.60 0.00 0.00 178.31 175.34 2k9a n THR 116 N -2.53 0.00 -2.33 -1.55 5.66 -1.07 -5.02 114.28 107.43 2k9a n THR 116 Ca -0.00 0.00 -0.35 0.00 -3.05 0.00 0.00 64.05 60.64 2k9a n THR 116 Cb 0.15 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 68.89 2k9a n THR 116 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 2k9a s ASP 117 N -0.57 5.94 0.48 1.09 2.15 -0.97 -4.78 116.67 120.01 2k9a s ASP 117 Ca 0.00 -1.68 0.18 0.00 0.43 0.00 0.00 52.55 51.48 2k9a s ASP 117 Cb 0.00 -2.58 1.19 0.00 -0.30 0.00 0.00 42.92 41.23 2k9a s ASP 117 CO 0.00 -2.08 2.02 0.15 -0.17 0.00 0.00 175.17 175.09 2k9a h PHE 118 N 9.35 0.22 -0.67 -5.34 3.57 -1.89 -1.25 116.94 120.93 2k9a h PHE 118 Ca 0.26 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.79 2k9a h PHE 118 Cb 0.94 -0.07 -0.04 0.00 2.79 0.00 0.00 35.95 39.57 2k9a h PHE 118 CO 1.30 0.10 0.42 -0.07 -2.23 0.00 0.00 178.31 177.83 2k9a h LEU 119 N 0.20 0.70 -0.43 0.59 3.38 -1.98 -1.56 115.31 116.21 2k9a h LEU 119 Ca 0.22 -0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.08 2k9a h LEU 119 Cb 0.59 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 2k9a h LEU 119 CO -0.04 0.49 -0.52 0.00 0.09 0.00 0.00 178.44 178.47 2k9a h ALA 120 N 1.28 0.78 0.39 1.53 0.00 -1.66 -2.41 119.26 119.17 2k9a h ALA 120 Ca 0.26 -0.47 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 2k9a h ALA 120 Cb -0.01 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2k9a h ALA 120 CO -0.09 0.65 -0.19 0.35 0.00 0.00 0.00 179.25 179.96 2k9a h PHE 121 N 0.00 -0.49 -0.42 0.00 3.57 -0.53 -0.78 116.94 118.30 2k9a h PHE 121 Ca -0.01 -0.01 -0.15 0.00 3.53 0.00 0.00 57.97 61.33 2k9a h PHE 121 Cb 1.22 0.16 -0.01 0.00 2.79 0.00 0.00 35.95 40.11 2k9a h PHE 121 CO 0.00 -0.18 -0.32 -0.22 -2.23 0.00 0.00 178.31 175.35 2k9a h LYS 122 N -0.78 0.95 0.00 1.11 3.64 -1.41 -2.83 116.57 117.26 2k9a h LYS 122 Ca -0.05 -0.47 -0.03 0.00 -1.27 0.00 0.00 60.65 58.82 2k9a h LYS 122 Cb 0.53 -0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.34 2k9a h LYS 122 CO 0.09 1.13 -0.16 1.49 -2.27 0.00 0.00 179.45 179.73 2k9a h GLU 123 N 0.79 0.00 -0.06 1.90 4.81 -1.46 -1.70 114.58 118.85 2k9a h GLU 123 Ca 0.08 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.26 2k9a h GLU 123 Cb 0.91 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.29 2k9a h GLU 123 CO 0.08 0.16 -0.13 1.98 -0.73 0.00 0.00 179.01 180.37 2k9a h MET 124 N 0.00 0.20 -0.24 1.92 4.05 -0.90 -2.20 114.93 117.76 2k9a h MET 124 Ca -0.00 -0.13 -0.01 0.00 -0.28 0.00 0.00 59.70 59.27 2k9a h MET 124 Cb 0.30 0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 31.10 2k9a h MET 124 CO 0.02 0.72 0.10 0.74 0.23 0.00 0.00 176.91 178.72 2k9a h PHE 125 N -0.29 0.37 -0.78 1.39 0.04 -1.28 -1.11 116.94 115.28 2k9a h PHE 125 Ca 0.00 -0.03 0.01 0.00 2.80 0.00 0.00 57.97 60.75 2k9a h PHE 125 Cb 0.72 -0.11 -0.04 0.00 2.20 0.00 0.00 35.95 38.72 2k9a h PHE 125 CO 0.12 0.39 0.51 -0.07 -0.60 0.00 0.00 178.31 178.65 2k9a h LEU 126 N 0.24 0.89 -0.74 1.54 4.07 -1.39 -0.87 115.31 119.05 2k9a h LEU 126 Ca 0.08 -0.03 -0.13 0.00 0.08 0.00 0.00 57.88 57.88 2k9a h LEU 126 Cb 0.18 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 41.68 2k9a h LEU 126 CO -0.01 0.65 -0.46 -0.78 -1.08 0.00 0.00 178.44 176.77 2k9a h ASP 127 N 1.05 0.42 0.16 -0.43 1.82 -1.16 -2.49 116.42 115.79 2k9a h ASP 127 Ca 0.28 -0.20 -0.12 0.00 -0.39 0.00 0.00 57.03 56.61 2k9a h ASP 127 Cb -0.11 -0.12 -0.01 0.00 0.68 0.00 0.00 39.33 39.76 2k9a h ASP 127 CO -0.06 0.82 -0.41 0.22 -1.61 0.00 0.00 179.24 178.20 2k9a h TYR 128 N 0.32 0.39 -0.27 0.28 3.20 -0.29 -2.34 116.97 118.26 2k9a h TYR 128 Ca 0.02 -0.11 -0.11 0.00 3.14 0.00 0.00 58.73 61.67 2k9a h TYR 128 Cb 0.93 -0.09 -0.00 0.00 1.54 0.00 0.00 36.73 39.11 2k9a h TYR 128 CO 0.03 0.70 -0.25 -0.09 -1.64 0.00 0.00 178.16 176.90 2k9a h ARG 129 N 0.28 0.64 -0.07 1.82 2.43 -0.98 -3.09 114.38 115.40 2k9a h ARG 129 Ca 0.02 -0.33 -0.07 0.00 -0.81 0.00 0.00 59.98 58.79 2k9a h ARG 129 Cb 0.85 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.40 2k9a h ARG 129 CO 0.07 0.94 -0.28 0.00 -1.51 0.00 0.00 179.97 179.18 2k9a h ALA 130 N 0.69 1.39 0.00 2.80 0.00 -1.37 -2.39 119.26 120.38 2k9a h ALA 130 Ca 0.04 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 2k9a h ALA 130 Cb 0.81 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.53 2k9a h ALA 130 CO 0.06 0.43 -0.05 1.49 0.00 0.00 0.00 179.25 181.18 2k9a h GLU 131 N 0.12 0.00 -0.76 0.00 4.57 -1.33 -2.12 114.58 115.05 2k9a h GLU 131 Ca 0.02 0.00 -0.04 0.00 -1.18 0.00 0.00 59.36 58.15 2k9a h GLU 131 Cb 0.57 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.13 2k9a h GLU 131 CO 0.04 0.05 0.30 0.87 -1.18 0.00 0.00 179.01 179.10 2k9a h LYS 132 N 0.00 1.14 -0.00 1.92 1.79 -1.45 -1.53 116.57 118.44 2k9a h LYS 132 Ca -0.00 -0.20 0.00 0.00 -2.18 0.00 0.00 60.65 58.26 2k9a h LYS 132 Cb 0.14 -0.19 0.00 0.00 -1.58 0.00 0.00 32.23 30.61 2k9a h LYS 132 CO 0.01 0.93 -0.05 0.39 -1.08 0.00 0.00 179.45 179.64 2k9a n GLU 133 N -4.28 0.35 0.07 3.15 1.02 -0.81 -1.96 120.64 118.18 2k9a n GLU 133 Ca 0.07 -0.05 -0.23 0.00 -0.02 0.00 0.00 57.16 56.93 2k9a n GLU 133 Cb 0.19 -1.50 -0.15 0.00 -0.02 0.00 0.00 31.44 29.96 2k9a n GLU 133 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 2k9a h GLY 134 N 4.99 0.43 0.00 0.62 0.00 -1.13 -3.45 103.07 104.53 2k9a h GLY 134 Ca 0.00 -1.10 0.00 0.00 0.00 0.00 0.00 47.33 46.23 2k9a h GLY 134 CO 0.00 0.97 -0.03 0.54 0.00 0.00 0.00 176.54 178.02 2k9a n ARG 135 N -3.71 0.00 0.00 4.80 1.74 -1.02 -5.12 116.66 113.35 2k9a n ARG 135 Ca -0.23 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.85 2k9a n ARG 135 Cb 1.03 -0.34 0.00 0.00 -1.02 0.00 0.00 32.46 32.13 2k9a n ARG 135 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52