#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 -7.87 -2.65 7.83 9.92 -1.26 -4.68 116.55 117.84 2k9a n ASP 2 Ca 0.00 0.97 -0.05 0.00 -0.53 0.00 0.00 54.79 55.18 2k9a n ASP 2 Cb 0.00 -5.09 -0.04 0.00 -0.64 0.00 0.00 41.12 35.35 2k9a n ASP 2 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2k9a n ALA 3 N 0.29 -3.54 -3.89 2.24 0.00 -1.26 -5.03 120.51 109.32 2k9a n ALA 3 Ca 0.05 2.14 -0.28 0.00 0.00 0.00 0.00 53.44 55.34 2k9a n ALA 3 Cb 0.24 -4.21 -0.17 0.00 0.00 0.00 0.00 19.45 15.31 2k9a n ALA 3 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2k9a s LEU 4 N -0.73 1.52 -0.07 0.00 2.96 -1.26 -5.12 118.68 115.98 2k9a s LEU 4 Ca -0.25 -0.41 -0.00 0.00 -0.22 0.00 0.00 54.13 53.26 2k9a s LEU 4 Cb 0.02 -1.03 0.02 0.00 0.50 0.00 0.00 46.19 45.70 2k9a s LEU 4 CO 0.75 -0.06 -0.05 -0.70 -1.32 0.00 0.00 176.35 174.97 2k9a s GLU 5 N 1.43 1.04 0.94 1.98 2.12 -1.26 -5.15 118.70 119.81 2k9a s GLU 5 Ca 0.02 -0.11 -0.14 0.00 0.36 0.00 0.00 54.97 55.10 2k9a s GLU 5 Cb -0.13 -1.14 0.21 0.00 0.26 0.00 0.00 34.13 33.33 2k9a s GLU 5 CO -0.08 -0.19 1.28 0.41 -0.54 0.00 0.00 175.26 176.15 2k9a n GLY 6 N 4.62 -1.17 0.11 -1.50 0.00 -1.26 -5.05 105.19 100.94 2k9a n GLY 6 Ca -0.15 -1.76 -0.22 0.00 0.00 0.00 0.00 46.02 43.89 2k9a n GLY 6 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2k9a n GLU 7 N -3.68 0.56 -1.75 1.61 0.00 -1.26 -5.00 120.64 111.12 2k9a n GLU 7 Ca 0.17 0.42 -0.19 0.00 0.00 0.00 0.00 57.16 57.55 2k9a n GLU 7 Cb 0.58 -1.61 0.12 0.00 0.00 0.00 0.00 31.44 30.53 2k9a n GLU 7 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.13 176.00 2k9a n SER 8 N -4.39 0.56 -2.59 4.31 3.41 -1.26 -4.88 113.62 108.79 2k9a n SER 8 Ca -0.37 -1.61 -0.06 0.00 -0.26 0.00 0.00 58.87 56.57 2k9a n SER 8 Cb 0.70 -0.61 -0.05 0.00 -0.26 0.00 0.00 64.21 64.00 2k9a n SER 8 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 2k9a n PHE 9 N -2.89 -4.51 -2.76 7.33 7.35 -1.26 -5.04 117.46 115.68 2k9a n PHE 9 Ca 0.12 2.61 -0.20 0.00 -0.76 0.00 0.00 57.45 59.22 2k9a n PHE 9 Cb 0.43 -3.94 0.05 0.00 0.35 0.00 0.00 39.48 36.37 2k9a n PHE 9 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2k9a s ALA 10 N -0.69 4.10 -0.25 3.13 0.00 -1.26 -4.99 121.76 121.79 2k9a s ALA 10 Ca -0.29 -1.57 -0.18 0.00 0.00 0.00 0.00 51.96 49.92 2k9a s ALA 10 Cb 0.02 -1.89 -0.03 0.00 0.00 0.00 0.00 23.12 21.22 2k9a s ALA 10 CO 0.80 -0.78 0.53 -0.51 0.00 0.00 0.00 175.76 175.80 2k9a s LEU 11 N -4.73 4.06 0.00 0.00 1.43 -1.26 -4.75 118.68 113.43 2k9a s LEU 11 Ca 0.59 0.56 0.00 0.00 -1.03 0.00 0.00 54.13 54.25 2k9a s LEU 11 Cb -0.09 -2.70 0.00 0.00 0.03 0.00 0.00 46.19 43.44 2k9a s LEU 11 CO 0.38 -0.29 0.00 -0.24 0.23 0.00 0.00 176.35 176.43 2k9a n SER 12 N 5.50 0.00 -2.66 2.29 2.88 -1.26 -5.11 113.62 115.26 2k9a n SER 12 Ca -0.04 -0.87 -0.05 0.00 -1.33 0.00 0.00 58.87 56.59 2k9a n SER 12 Cb 0.50 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.92 2k9a n SER 12 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 2k9a n PHE 13 N 0.00 -4.07 -4.85 0.66 3.01 -1.26 -5.02 117.46 105.92 2k9a n PHE 13 Ca 0.00 2.29 -0.32 0.00 1.01 0.00 0.00 57.45 60.43 2k9a n PHE 13 Cb 0.26 -3.71 -0.17 0.00 -0.01 0.00 0.00 39.48 35.86 2k9a n PHE 13 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 2k9a s SER 14 N -0.77 3.07 -0.10 4.37 0.15 -1.26 -5.01 113.70 114.15 2k9a s SER 14 Ca -0.23 -0.58 -0.11 0.00 0.70 0.00 0.00 55.95 55.74 2k9a s SER 14 Cb 0.02 -1.41 -0.28 0.00 -1.71 0.00 0.00 66.02 62.63 2k9a s SER 14 CO 0.73 0.11 0.50 0.28 1.20 0.00 0.00 173.24 176.06 2k9a h SER 15 N 7.11 0.47 0.25 5.45 0.02 -1.96 -3.33 113.55 121.55 2k9a h SER 15 Ca -0.28 -0.91 0.00 0.00 -0.84 0.00 0.00 61.79 59.76 2k9a h SER 15 Cb 1.21 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.60 2k9a h SER 15 CO 0.52 1.78 0.00 0.00 -1.14 0.00 0.00 176.83 177.99 2k9a n ALA 16 N -2.97 1.98 -1.00 3.77 0.00 -1.26 -0.69 120.51 120.35 2k9a n ALA 16 Ca -0.28 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.07 2k9a n ALA 16 Cb 1.01 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 19.18 2k9a n ALA 16 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2k9a n SER 17 N -1.22 0.00 0.01 0.00 3.41 -1.25 -4.88 113.62 109.69 2k9a n SER 17 Ca 0.09 0.50 0.00 0.00 -0.26 0.00 0.00 58.87 59.20 2k9a n SER 17 Cb 0.12 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.07 2k9a n SER 17 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2k9a n ASP 18 N -0.68 -0.17 0.34 4.04 -0.08 -1.26 -4.94 116.55 113.80 2k9a n ASP 18 Ca 0.00 0.08 -0.17 0.00 -1.51 0.00 0.00 54.79 53.19 2k9a n ASP 18 Cb 0.00 0.34 -0.09 0.00 2.34 0.00 0.00 41.12 43.71 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 0.00 -0.85 -0.22 -1.67 0.00 -1.90 -1.78 119.26 112.83 2k9a h ALA 19 Ca 0.00 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 2k9a h ALA 19 Cb 0.00 0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2k9a h ALA 19 CO 0.00 -0.93 0.11 1.49 0.00 0.00 0.00 179.25 179.92 2k9a h GLU 20 N -0.95 0.32 -0.74 0.00 4.57 -1.81 -2.58 114.58 113.38 2k9a h GLU 20 Ca -0.09 -0.05 0.15 0.00 -1.18 0.00 0.00 59.36 58.20 2k9a h GLU 20 Cb 0.68 -0.06 -0.10 0.00 -0.16 0.00 0.00 28.75 29.11 2k9a h GLU 20 CO 0.14 0.33 0.23 0.35 -1.18 0.00 0.00 179.01 178.88 2k9a h PHE 21 N 0.23 0.37 -0.73 0.92 3.04 -0.91 0.34 116.94 120.19 2k9a h PHE 21 Ca 0.08 0.04 -0.01 0.00 3.98 0.00 0.00 57.97 62.06 2k9a h PHE 21 Cb 0.12 -0.05 -0.03 0.00 2.56 0.00 0.00 35.95 38.54 2k9a h PHE 21 CO -0.02 -0.03 0.43 0.22 -2.02 0.00 0.00 178.31 176.89 2k9a h ASP 22 N 0.33 0.88 -0.93 0.41 3.58 -1.07 -2.37 116.42 117.27 2k9a h ASP 22 Ca 0.41 -0.07 0.06 0.00 0.42 0.00 0.00 57.03 57.85 2k9a h ASP 22 Cb 0.68 -0.22 -0.06 0.00 1.72 0.00 0.00 39.33 41.44 2k9a h ASP 22 CO -0.47 0.70 0.59 0.00 -2.88 0.00 0.00 179.24 177.18 2k9a h ALA 23 N 1.22 1.27 0.27 -0.78 0.00 -0.58 -2.44 119.26 118.23 2k9a h ALA 23 Ca 0.26 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 2k9a h ALA 23 Cb -0.01 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.50 2k9a h ALA 23 CO -0.05 0.38 -0.13 0.28 0.00 0.00 0.00 179.25 179.73 2k9a h VAL 24 N 1.09 0.75 -1.00 0.00 2.07 -0.83 -2.31 116.25 116.01 2k9a h VAL 24 Ca 0.40 -0.10 0.25 0.00 0.82 0.00 0.00 66.70 68.07 2k9a h VAL 24 Cb 0.14 0.81 -0.08 0.00 -1.52 0.00 0.00 31.29 30.64 2k9a h VAL 24 CO -0.16 0.02 0.66 0.58 0.02 0.00 0.00 177.57 178.69 2k9a h VAL 25 N -0.41 0.57 -0.27 2.57 2.07 -1.10 0.10 116.25 119.79 2k9a h VAL 25 Ca -0.04 -0.12 -0.03 0.00 0.82 0.00 0.00 66.70 67.33 2k9a h VAL 25 Cb 0.32 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.26 2k9a h VAL 25 CO 0.06 0.06 0.07 1.23 0.02 0.00 0.00 177.57 179.01 2k9a h GLY 26 N 0.35 0.47 0.86 2.17 0.00 -0.97 -2.46 103.07 103.49 2k9a h GLY 26 Ca 0.54 -0.29 0.02 0.00 0.00 0.00 0.00 47.33 47.59 2k9a h GLY 26 CO -0.22 0.27 0.04 -0.97 0.00 0.00 0.00 176.54 175.67 2k9a h TYR 27 N 0.27 0.07 -0.44 5.60 0.05 -0.45 -2.64 116.97 119.43 2k9a h TYR 27 Ca 0.09 0.01 0.06 0.00 0.05 0.00 0.00 58.73 58.94 2k9a h TYR 27 Cb 0.29 -0.01 -0.05 0.00 1.01 0.00 0.00 36.73 37.96 2k9a h TYR 27 CO 0.01 0.03 0.13 -0.07 -1.05 0.00 0.00 178.16 177.22 2k9a h LEU 28 N 0.11 0.10 -0.57 3.88 4.07 -1.36 -2.23 115.31 119.31 2k9a h LEU 28 Ca 0.07 0.06 0.10 0.00 0.08 0.00 0.00 57.88 58.19 2k9a h LEU 28 Cb 0.05 0.06 -0.08 0.00 1.08 0.00 0.00 40.66 41.77 2k9a h LEU 28 CO -0.08 0.09 0.12 -0.33 -1.08 0.00 0.00 178.44 177.16 2k9a h GLU 29 N 0.28 0.24 -0.46 1.13 5.08 -1.15 0.11 114.58 119.82 2k9a h GLU 29 Ca 0.21 -0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.62 2k9a h GLU 29 Cb 0.23 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.40 2k9a h GLU 29 CO -0.24 0.16 0.31 -0.44 -1.00 0.00 0.00 179.01 177.80 2k9a h ASP 30 N 0.25 0.30 0.46 1.42 3.32 -1.07 -1.09 116.42 120.02 2k9a h ASP 30 Ca 0.29 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 57.13 2k9a h ASP 30 Cb 0.42 -0.06 -0.00 0.00 0.22 0.00 0.00 39.33 39.90 2k9a h ASP 30 CO -0.38 0.20 -0.91 0.40 -1.72 0.00 0.00 179.24 176.83 2k9a h ILE 31 N 0.35 1.45 -0.41 0.35 2.04 -0.55 -3.05 117.51 117.68 2k9a h ILE 31 Ca 0.20 -2.53 -0.04 0.00 1.00 0.00 0.00 64.86 63.48 2k9a h ILE 31 Cb 0.35 2.44 -0.02 0.00 -0.74 0.00 0.00 36.82 38.86 2k9a h ILE 31 CO -0.05 0.75 0.07 0.40 0.00 0.00 0.00 178.15 179.32 2k9a h ILE 32 N 0.17 1.20 -0.25 -0.67 2.04 0.18 -1.64 117.51 118.53 2k9a h ILE 32 Ca -0.06 -0.73 0.00 0.00 1.00 0.00 0.00 64.86 65.07 2k9a h ILE 32 Cb 1.54 0.81 0.00 0.00 -0.74 0.00 0.00 36.82 38.43 2k9a h ILE 32 CO 0.15 0.26 0.00 0.23 0.00 0.00 0.00 178.15 178.79 2k9a n MET 33 N -4.30 1.84 -2.52 2.37 2.81 -0.96 -4.70 117.12 111.65 2k9a n MET 33 Ca 0.02 -1.27 -0.42 0.00 -1.81 0.00 0.00 57.70 54.22 2k9a n MET 33 Cb 0.22 -1.37 -0.03 0.00 -0.71 0.00 0.00 33.22 31.33 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 -1.38 7.16 0.13 7.83 -1.08 -0.62 -4.95 116.67 123.77 2k9a s ASP 34 Ca 0.31 1.87 -0.18 0.00 -0.52 0.00 0.00 52.55 54.03 2k9a s ASP 34 Cb 0.17 -2.57 -0.01 0.00 -1.46 0.00 0.00 42.92 39.04 2k9a s ASP 34 CO 0.24 -0.43 1.75 0.44 0.52 0.00 0.00 175.17 177.70 2k9a h ASP 35 N 6.90 0.11 0.02 -0.34 3.32 -1.90 -1.13 116.42 123.39 2k9a h ASP 35 Ca -0.40 0.02 -0.00 0.00 0.02 0.00 0.00 57.03 56.67 2k9a h ASP 35 Cb 1.21 0.01 -0.00 0.00 0.22 0.00 0.00 39.33 40.77 2k9a h ASP 35 CO 0.80 0.10 -0.01 -0.08 -1.72 0.00 0.00 179.24 178.33 2k9a h GLU 36 N 0.21 0.00 -0.01 3.56 4.57 -1.94 -0.53 114.58 120.44 2k9a h GLU 36 Ca 0.11 0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 58.26 2k9a h GLU 36 Cb 0.07 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.66 2k9a h GLU 36 CO -0.11 0.01 -0.12 0.35 -1.18 0.00 0.00 179.01 177.97 2k9a h PHE 37 N 0.00 0.14 0.00 0.92 3.57 -1.52 -2.68 116.94 117.37 2k9a h PHE 37 Ca -0.00 -0.07 -0.05 0.00 3.53 0.00 0.00 57.97 61.38 2k9a h PHE 37 Cb 0.02 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 38.73 2k9a h PHE 37 CO 0.00 0.80 -0.25 1.96 -2.23 0.00 0.00 178.31 178.59 2k9a h GLN 38 N -0.55 0.00 -0.00 1.11 4.20 -0.80 -1.35 115.11 117.71 2k9a h GLN 38 Ca -0.01 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.70 2k9a h GLN 38 Cb 0.82 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.60 2k9a h GLN 38 CO 0.02 0.25 -0.00 1.25 -0.67 0.00 0.00 178.83 179.68 2k9a h LEU 39 N 0.00 0.01 -0.12 1.46 7.12 -1.14 -2.16 115.31 120.49 2k9a h LEU 39 Ca -0.00 -0.48 -0.02 0.00 0.13 0.00 0.00 57.88 57.50 2k9a h LEU 39 Cb 0.50 -0.00 -0.00 0.00 -0.53 0.00 0.00 40.66 40.62 2k9a h LEU 39 CO 0.03 0.49 0.00 0.25 -0.13 0.00 0.00 178.44 179.08 2k9a h LEU 40 N -0.48 0.20 -0.69 2.25 6.46 -1.34 -0.67 115.31 121.04 2k9a h LEU 40 Ca 0.00 -0.31 0.05 0.00 -0.12 0.00 0.00 57.88 57.51 2k9a h LEU 40 Cb 0.49 -0.05 -0.05 0.00 -0.73 0.00 0.00 40.66 40.31 2k9a h LEU 40 CO 0.00 0.46 0.40 -0.61 -0.62 0.00 0.00 178.44 178.07 2k9a h GLN 41 N -0.06 0.72 -0.04 1.25 4.15 -1.34 -1.87 115.11 117.93 2k9a h GLN 41 Ca 0.03 -0.04 -0.14 0.00 0.77 0.00 0.00 58.65 59.27 2k9a h GLN 41 Cb 0.35 -0.16 -0.01 0.00 0.21 0.00 0.00 27.48 27.87 2k9a h GLN 41 CO 0.01 0.48 -0.62 -0.09 -1.93 0.00 0.00 178.83 176.67 2k9a h ARG 42 N 0.75 0.17 -0.10 1.69 2.43 -1.34 -1.67 114.38 116.30 2k9a h ARG 42 Ca 0.30 -0.12 -0.00 0.00 -0.81 0.00 0.00 59.98 59.35 2k9a h ARG 42 Cb 0.15 0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 29.72 2k9a h ARG 42 CO -0.17 0.73 0.06 -0.97 -1.51 0.00 0.00 179.97 178.12 2k9a h ASN 43 N 0.12 0.13 0.06 -3.80 -0.73 -0.33 -1.63 115.58 109.40 2k9a h ASN 43 Ca -0.01 -0.08 -0.24 0.00 1.87 0.00 0.00 56.30 57.84 2k9a h ASN 43 Cb 1.12 -0.03 0.02 0.00 0.27 0.00 0.00 38.32 39.70 2k9a h ASN 43 CO 0.09 0.17 -0.97 -0.26 -0.37 0.00 0.00 177.43 176.10 2k9a h PHE 44 N 0.08 0.86 -0.00 0.67 0.04 -1.45 -3.22 116.94 113.91 2k9a h PHE 44 Ca 0.04 -0.51 0.00 0.00 2.80 0.00 0.00 57.97 60.30 2k9a h PHE 44 Cb 0.07 -0.08 -0.00 0.00 2.20 0.00 0.00 35.95 38.14 2k9a h PHE 44 CO -0.05 1.35 0.00 0.00 -0.60 0.00 0.00 178.31 179.02 2k9a h MET 45 N 0.12 0.00 -0.10 1.51 -0.00 -1.30 -0.56 114.93 114.60 2k9a h MET 45 Ca -0.14 0.00 -0.01 0.00 -0.00 0.00 0.00 59.70 59.56 2k9a h MET 45 Cb 1.66 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 33.26 2k9a h MET 45 CO 0.19 0.00 0.03 0.22 -0.00 0.00 0.00 176.91 177.35 2k9a h ASP 46 N 0.00 0.12 0.06 -0.10 3.58 -1.30 -1.04 116.42 117.74 2k9a h ASP 46 Ca 0.00 -0.01 -0.38 0.00 0.42 0.00 0.00 57.03 57.07 2k9a h ASP 46 Cb 0.01 -0.03 -0.04 0.00 1.72 0.00 0.00 39.33 40.98 2k9a h ASP 46 CO -0.00 0.12 -2.21 1.17 -2.88 0.00 0.00 179.24 175.44 2k9a n LYS 47 N -4.49 0.69 0.02 0.28 0.00 -0.33 -4.25 118.16 110.08 2k9a n LYS 47 Ca -0.01 0.23 -0.10 0.00 0.00 0.00 0.00 58.31 58.42 2k9a n LYS 47 Cb 0.11 -1.61 -0.04 0.00 0.00 0.00 0.00 35.03 33.48 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 -0.08 -0.21 -0.00 5.64 -1.99 -1.11 -1.32 116.97 117.89 2k9a h TYR 48 Ca -0.51 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.24 2k9a h TYR 48 Cb 1.91 0.10 -0.00 0.00 2.00 0.00 0.00 36.73 40.74 2k9a h TYR 48 CO 0.05 -0.13 0.05 0.10 -0.00 0.00 0.00 178.16 178.23 2k9a h TYR 49 N -0.11 0.00 0.24 4.88 -0.00 -1.41 -0.65 116.97 119.91 2k9a h TYR 49 Ca 0.06 0.00 -0.33 0.00 -0.00 0.00 0.00 58.73 58.46 2k9a h TYR 49 Cb 0.20 0.00 0.04 0.00 -0.00 0.00 0.00 36.73 36.96 2k9a h TYR 49 CO -0.19 0.00 -1.45 -0.07 -0.00 0.00 0.00 178.16 176.45 2k9a h LEU 50 N 0.00 0.84 -0.22 0.10 3.38 -1.43 -3.33 115.31 114.65 2k9a h LEU 50 Ca 0.00 -0.89 -0.18 0.00 0.09 0.00 0.00 57.88 56.91 2k9a h LEU 50 Cb 0.11 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.59 2k9a h LEU 50 CO -0.00 1.69 -0.55 -0.08 0.09 0.00 0.00 178.44 179.59 2k9a h GLU 51 N 0.16 0.76 -5.83 1.13 4.57 -0.73 -3.39 114.58 111.24 2k9a h GLU 51 Ca -0.25 -0.53 -0.38 0.00 -1.18 0.00 0.00 59.36 57.03 2k9a h GLU 51 Cb 2.14 0.08 -0.06 0.00 -0.16 0.00 0.00 28.75 30.75 2k9a h GLU 51 CO 0.27 1.15 0.94 -0.06 -1.18 0.00 0.00 179.01 180.13 2k9a s PHE 52 N -3.98 1.94 0.07 0.92 0.40 -0.39 -4.95 117.98 111.99 2k9a s PHE 52 Ca -0.11 0.35 0.01 0.00 -0.60 0.00 0.00 56.93 56.57 2k9a s PHE 52 Cb 0.09 -4.19 -0.04 0.00 0.51 0.00 0.00 43.02 39.39 2k9a s PHE 52 CO 0.87 -1.84 0.19 -1.21 0.70 0.00 0.00 175.22 173.93 2k9a s GLU 53 N 6.60 3.35 -0.71 0.44 2.02 -1.26 -4.74 118.70 124.39 2k9a s GLU 53 Ca 0.64 -0.49 -0.26 0.00 0.02 0.00 0.00 54.97 54.89 2k9a s GLU 53 Cb -0.06 -2.98 -0.09 0.00 0.10 0.00 0.00 34.13 31.09 2k9a s GLU 53 CO -0.00 0.60 2.28 0.34 0.02 0.00 0.00 175.26 178.50 2k9a s ASP 54 N -2.53 4.37 0.03 -0.19 2.15 -1.26 -4.89 116.67 114.35 2k9a s ASP 54 Ca 0.34 0.23 -0.01 0.00 0.43 0.00 0.00 52.55 53.54 2k9a s ASP 54 Cb -0.13 -2.54 -0.02 0.00 -0.30 0.00 0.00 42.92 39.93 2k9a s ASP 54 CO 0.27 -3.29 -0.01 0.42 -0.17 0.00 0.00 175.17 172.40 2k9a s THR 55 N 12.79 0.15 -0.52 1.71 -4.23 -1.26 -5.04 115.64 119.23 2k9a s THR 55 Ca 0.88 -1.23 0.23 0.00 -1.18 0.00 0.00 61.69 60.39 2k9a s THR 55 Cb -0.13 -0.78 -0.05 0.00 1.34 0.00 0.00 72.50 72.89 2k9a s THR 55 CO 0.13 -0.68 1.10 -0.62 -0.54 0.00 0.00 174.62 174.01 2k9a n GLU 56 N 0.98 0.37 -3.42 3.99 -0.58 -1.26 -4.88 120.64 115.83 2k9a n GLU 56 Ca -0.20 0.04 -0.38 0.00 -0.42 0.00 0.00 57.16 56.20 2k9a n GLU 56 Cb 0.58 -1.67 -0.06 0.00 -0.57 0.00 0.00 31.44 29.72 2k9a n GLU 56 CO 0.00 0.00 0.00 -2.00 -0.48 0.00 0.00 177.13 174.65 2k9a s GLU 57 N -3.23 4.05 -0.24 3.49 2.56 -1.26 -5.07 118.70 119.00 2k9a s GLU 57 Ca 0.03 0.49 -0.04 0.00 0.00 0.00 0.00 54.97 55.45 2k9a s GLU 57 Cb 0.13 -3.26 0.00 0.00 2.00 0.00 0.00 34.13 33.00 2k9a s GLU 57 CO 0.78 0.59 -0.03 -0.80 -0.56 0.00 0.00 175.26 175.24 2k9a s ASN 58 N -0.80 4.45 0.69 -1.70 0.02 -1.26 -5.11 114.94 111.22 2k9a s ASN 58 Ca 0.25 -0.55 -0.05 0.00 -1.02 0.00 0.00 52.86 51.50 2k9a s ASN 58 Cb -0.17 -1.75 0.07 0.00 0.02 0.00 0.00 41.25 39.43 2k9a s ASN 58 CO 0.14 -0.07 0.98 -0.54 0.02 0.00 0.00 177.10 177.62 2k9a s LYS 59 N 1.45 2.10 0.06 -0.60 1.02 -1.26 -4.98 119.74 117.53 2k9a s LYS 59 Ca 0.04 -0.51 0.28 0.00 0.02 0.00 0.00 55.97 55.80 2k9a s LYS 59 Cb -0.15 -2.24 1.11 0.00 -0.52 0.00 0.00 37.83 36.02 2k9a s LYS 59 CO -0.03 -1.23 1.88 1.28 -0.92 0.00 0.00 175.35 176.34 2k9a n LEU 60 N -2.83 0.24 0.28 3.17 4.77 -1.26 -3.27 117.00 118.10 2k9a n LEU 60 Ca 0.09 0.52 0.18 0.00 -0.03 0.00 0.00 56.01 56.78 2k9a n LEU 60 Cb 0.60 -0.45 0.77 0.00 -2.33 0.00 0.00 43.42 42.02 2k9a n LEU 60 CO 0.49 -0.05 1.02 -0.29 -1.33 0.00 0.00 177.39 177.22 2k9a h ILE 61 N 0.00 0.00 0.00 -0.08 6.09 -2.03 -2.43 117.51 119.06 2k9a h ILE 61 Ca 0.00 -0.39 0.00 0.00 -1.37 0.00 0.00 64.86 63.10 2k9a h ILE 61 Cb 0.57 1.36 0.00 0.00 0.47 0.00 0.00 36.82 39.22 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 0.09 2.19 -1.99 -1.96 -2.83 116.97 112.47 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 0.00 -0.04 1.15 -0.00 0.00 0.00 178.16 179.27 2k9a h THR 63 N 0.00 1.11 -0.58 -2.88 2.02 -1.68 -2.55 112.91 108.34 2k9a h THR 63 Ca 0.00 -1.38 -0.08 0.00 0.77 0.00 0.00 66.41 65.71 2k9a h THR 63 Cb 0.50 1.91 -0.02 0.00 -1.74 0.00 0.00 68.15 68.80 2k9a h THR 63 CO 0.00 0.31 0.03 1.55 0.37 0.00 0.00 175.52 177.78 2k9a h PRO 64 N -0.82 1.01 -0.33 6.66 0.13 -1.71 -2.34 132.00 134.59 2k9a h PRO 64 Ca -0.01 -0.30 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 2k9a h PRO 64 Cb 0.59 -0.10 -0.02 0.00 0.13 0.00 0.00 31.00 31.60 2k9a h PRO 64 CO 0.02 0.98 0.21 0.82 -0.23 0.00 0.00 178.00 179.81 2k9a h ILE 65 N 0.90 1.09 -0.51 -3.56 2.04 -1.62 -2.02 117.51 113.83 2k9a h ILE 65 Ca 0.17 -0.19 -0.00 0.00 1.00 0.00 0.00 64.86 65.84 2k9a h ILE 65 Cb 0.51 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 37.19 2k9a h ILE 65 CO 0.02 0.09 0.30 0.15 0.00 0.00 0.00 178.15 178.72 2k9a h PHE 66 N 0.44 0.67 -0.15 1.37 3.57 -1.38 -2.04 116.94 119.41 2k9a h PHE 66 Ca 0.12 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.63 2k9a h PHE 66 Cb -0.03 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 38.48 2k9a h PHE 66 CO -0.05 0.47 0.10 -0.91 -2.23 0.00 0.00 178.31 175.69 2k9a h ASN 67 N 0.68 0.11 -0.24 0.41 -0.26 -1.15 -1.93 115.58 113.20 2k9a h ASN 67 Ca 0.18 -0.00 -0.08 0.00 -0.56 0.00 0.00 56.30 55.84 2k9a h ASN 67 Cb -0.00 -0.03 -0.00 0.00 -1.06 0.00 0.00 38.32 37.22 2k9a h ASN 67 CO -0.03 0.08 -0.17 -0.08 -1.06 0.00 0.00 177.43 176.17 2k9a h GLU 68 N 0.13 0.53 -0.15 0.81 4.81 -0.66 -1.67 114.58 118.38 2k9a h GLU 68 Ca 0.06 -0.26 -0.02 0.00 -0.13 0.00 0.00 59.36 59.02 2k9a h GLU 68 Cb 0.09 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 2k9a h GLU 68 CO -0.01 0.83 0.00 -0.92 -0.73 0.00 0.00 179.01 178.18 2k9a h TYR 69 N 0.24 0.20 0.31 0.92 3.20 -1.00 -0.08 116.97 120.76 2k9a h TYR 69 Ca 0.05 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.89 2k9a h TYR 69 Cb 0.70 -0.06 0.00 0.00 1.54 0.00 0.00 36.73 38.91 2k9a h TYR 69 CO 0.07 0.22 -0.15 0.82 -1.64 0.00 0.00 178.16 177.48 2k9a h ILE 70 N 0.21 0.00 -0.03 1.81 1.08 -1.25 0.17 117.51 119.49 2k9a h ILE 70 Ca 0.05 -0.60 0.01 0.00 -0.39 0.00 0.00 64.86 63.93 2k9a h ILE 70 Cb 0.14 0.00 -0.00 0.00 -3.07 0.00 0.00 36.82 33.89 2k9a h ILE 70 CO 0.00 0.00 0.03 0.77 -0.69 0.00 0.00 178.15 178.27 2k9a h SER 71 N -1.02 0.00 0.00 1.72 4.64 -1.26 0.12 113.55 117.74 2k9a h SER 71 Ca -0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 2k9a h SER 71 Cb 0.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 2k9a h SER 71 CO 0.07 0.00 -0.29 -0.11 -0.87 0.00 0.00 176.83 175.63 2k9a n LEU 72 N -3.91 1.03 0.09 5.97 -0.00 -0.05 -4.17 117.00 115.96 2k9a n LEU 72 Ca -0.02 0.47 -0.05 0.00 -0.00 0.00 0.00 56.01 56.41 2k9a n LEU 72 Cb 0.12 -0.71 -0.02 0.00 -0.00 0.00 0.00 43.42 42.81 2k9a n LEU 72 CO 0.28 -0.49 0.14 0.58 -0.00 0.00 0.00 177.39 177.91 2k9a h VAL 73 N -0.57 0.00 -0.76 1.96 2.07 -0.70 -2.27 116.25 115.97 2k9a h VAL 73 Ca 0.00 -0.62 0.13 0.00 0.82 0.00 0.00 66.70 67.03 2k9a h VAL 73 Cb 0.29 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 29.97 2k9a h VAL 73 CO 0.00 0.00 0.34 -0.08 0.02 0.00 0.00 177.57 177.85 2k9a h GLU 74 N -0.93 0.49 -0.40 1.57 4.81 -0.85 -0.50 114.58 118.78 2k9a h GLU 74 Ca -0.03 -0.03 -0.11 0.00 -0.13 0.00 0.00 59.36 59.05 2k9a h GLU 74 Cb 0.24 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.49 2k9a h GLU 74 CO 0.05 0.33 -0.21 -0.22 -0.73 0.00 0.00 179.01 178.23 2k9a h LYS 75 N 0.51 0.79 -0.36 1.92 3.64 -0.97 -2.71 116.57 119.39 2k9a h LYS 75 Ca 0.41 -0.32 0.06 0.00 -1.27 0.00 0.00 60.65 59.54 2k9a h LYS 75 Cb 0.58 -0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 32.31 2k9a h LYS 75 CO -0.37 0.93 0.03 -0.92 -2.27 0.00 0.00 179.45 176.86 2k9a h TYR 76 N 0.70 0.04 -0.69 1.91 3.20 -0.48 -0.13 116.97 121.51 2k9a h TYR 76 Ca 0.10 0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.93 2k9a h TYR 76 Cb 0.72 0.04 -0.03 0.00 1.54 0.00 0.00 36.73 39.00 2k9a h TYR 76 CO 0.04 -0.03 0.20 0.82 -1.64 0.00 0.00 178.16 177.54 2k9a h ILE 77 N 0.14 1.26 -0.08 1.81 2.04 -1.37 -2.53 117.51 118.77 2k9a h ILE 77 Ca 0.17 -0.92 0.00 0.00 1.00 0.00 0.00 64.86 65.12 2k9a h ILE 77 Cb 0.22 0.54 -0.00 0.00 -0.74 0.00 0.00 36.82 36.84 2k9a h ILE 77 CO -0.26 0.35 0.05 -0.08 0.00 0.00 0.00 178.15 178.21 2k9a h GLU 78 N 1.02 0.11 0.28 2.37 4.81 -1.05 -1.99 114.58 120.14 2k9a h GLU 78 Ca 0.22 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.43 2k9a h GLU 78 Cb 0.33 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.69 2k9a h GLU 78 CO -0.00 0.09 -0.14 0.93 -0.73 0.00 0.00 179.01 179.16 2k9a h GLU 79 N 0.09 -0.37 -0.15 1.92 4.39 -0.97 -1.14 114.58 118.35 2k9a h GLU 79 Ca 0.03 0.03 0.04 0.00 0.34 0.00 0.00 59.36 59.80 2k9a h GLU 79 Cb 0.01 0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.74 2k9a h GLU 79 CO -0.01 -0.25 0.11 1.96 -1.16 0.00 0.00 179.01 179.67 2k9a h GLN 80 N -0.38 0.00 0.10 2.33 1.08 -1.42 -1.72 115.11 115.10 2k9a h GLN 80 Ca -0.04 0.00 -0.27 0.00 -1.45 0.00 0.00 58.65 56.89 2k9a h GLN 80 Cb 0.30 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.74 2k9a h GLN 80 CO 0.06 0.00 -1.18 -0.07 -0.95 0.00 0.00 178.83 176.69 2k9a h LEU 81 N 0.00 0.58 -1.18 1.46 3.38 -0.98 -3.24 115.31 115.32 2k9a h LEU 81 Ca 0.07 -0.56 -0.04 0.00 0.09 0.00 0.00 57.88 57.45 2k9a h LEU 81 Cb 0.29 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 2k9a h LEU 81 CO -0.00 1.40 -0.17 -0.07 0.09 0.00 0.00 178.44 179.69 2k9a h LEU 82 N 0.16 0.00 -2.35 1.67 -0.00 -0.37 -2.18 115.31 112.24 2k9a h LEU 82 Ca -0.14 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.74 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 0.21 0.17 0.04 1.56 -0.00 0.00 0.00 178.44 180.42 2k9a h GLN 83 N 0.00 0.00 0.00 1.13 4.20 -1.39 -2.37 115.11 116.69 2k9a h GLN 83 Ca -0.00 0.00 -0.12 0.00 0.06 0.00 0.00 58.65 58.59 2k9a h GLN 83 Cb 0.69 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.45 2k9a h GLN 83 CO 0.02 0.00 -1.45 -2.13 -0.67 0.00 0.00 178.83 174.60 2k9a n ARG 84 N -2.77 2.92 -3.89 1.46 3.00 -1.01 -4.91 116.66 111.45 2k9a n ARG 84 Ca -0.02 -0.00 -0.30 0.00 -0.00 0.00 0.00 57.85 57.52 2k9a n ARG 84 Cb 0.10 -1.17 -0.15 0.00 0.00 0.00 0.00 32.46 31.24 2k9a n ARG 84 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 2k9a s ILE 85 N -2.16 1.83 -1.10 5.15 1.01 -0.85 -4.96 121.20 120.13 2k9a s ILE 85 Ca -0.03 -2.28 0.20 0.00 0.00 0.00 0.00 60.65 58.53 2k9a s ILE 85 Cb 0.02 -2.34 0.21 0.00 0.01 0.00 0.00 42.46 40.36 2k9a s ILE 85 CO 0.27 -0.69 1.64 -0.81 0.00 0.00 0.00 174.94 175.34 2k9a n PRO 86 N 4.12 0.06 -0.31 2.79 -0.04 -1.21 -2.39 135.00 138.03 2k9a n PRO 86 Ca 0.03 0.14 0.07 0.00 -0.04 0.00 0.00 63.50 63.71 2k9a n PRO 86 Cb 0.39 -1.50 0.21 0.00 -0.04 0.00 0.00 33.50 32.56 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 -1.45 2.83 -1.87 0.54 0.28 -1.26 -5.03 120.64 114.67 2k9a n GLU 87 Ca 0.06 -2.50 -0.37 0.00 -0.16 0.00 0.00 57.16 54.19 2k9a n GLU 87 Cb 0.22 -1.59 0.04 0.00 1.43 0.00 0.00 31.44 31.54 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 -2.11 2.31 -0.49 -1.84 5.36 -1.01 -5.00 117.98 115.19 2k9a s PHE 88 Ca 0.33 1.45 0.03 0.00 -0.96 0.00 0.00 56.93 57.79 2k9a s PHE 88 Cb 0.25 -3.66 0.15 0.00 -0.34 0.00 0.00 43.02 39.42 2k9a s PHE 88 CO 0.11 -2.62 0.32 -0.80 -1.46 0.00 0.00 175.22 170.77 2k9a s ASN 89 N -1.26 3.35 0.51 6.13 0.02 -1.26 -4.95 114.94 117.47 2k9a s ASN 89 Ca 0.75 -3.01 0.22 0.00 -1.02 0.00 0.00 52.86 49.80 2k9a s ASN 89 Cb -0.36 -1.01 1.36 0.00 0.02 0.00 0.00 41.25 41.26 2k9a s ASN 89 CO 0.41 -0.20 2.10 -0.03 0.02 0.00 0.00 177.10 179.40 2k9a h MET 90 N 6.15 0.00 0.18 -0.60 4.05 -1.98 0.63 114.93 123.36 2k9a h MET 90 Ca 0.10 0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 59.51 2k9a h MET 90 Cb 0.88 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.69 2k9a h MET 90 CO 0.50 0.10 -0.09 0.00 0.23 0.00 0.00 176.91 177.65 2k9a h ALA 91 N 1.90 -0.25 0.00 0.39 0.00 -2.00 -2.18 119.26 117.13 2k9a h ALA 91 Ca -0.00 -0.21 -0.10 0.00 0.00 0.00 0.00 54.91 54.60 2k9a h ALA 91 Cb 0.20 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2k9a h ALA 91 CO 0.01 -0.39 -0.47 0.00 0.00 0.00 0.00 179.25 178.40 2k9a h ALA 92 N -0.09 1.17 -0.08 0.00 0.00 -1.95 -2.67 119.26 115.65 2k9a h ALA 92 Ca -0.03 -0.43 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 2k9a h ALA 92 Cb 0.51 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 2k9a h ALA 92 CO 0.04 0.59 -0.00 0.35 0.00 0.00 0.00 179.25 180.23 2k9a h PHE 93 N 0.00 0.15 -0.71 0.00 3.57 -0.90 -2.50 116.94 116.55 2k9a h PHE 93 Ca -0.00 -0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.41 2k9a h PHE 93 Cb 0.86 -0.04 -0.03 0.00 2.79 0.00 0.00 35.95 39.53 2k9a h PHE 93 CO 0.00 0.41 0.21 1.79 -2.23 0.00 0.00 178.31 178.49 2k9a h THR 94 N -0.16 1.26 -0.44 4.41 1.35 -1.37 -0.22 112.91 117.75 2k9a h THR 94 Ca 0.02 -0.91 0.04 0.00 -0.55 0.00 0.00 66.41 65.01 2k9a h THR 94 Cb 0.35 0.51 -0.04 0.00 -1.73 0.00 0.00 68.15 67.24 2k9a h THR 94 CO 0.00 0.35 0.21 0.74 -0.25 0.00 0.00 175.52 176.57 2k9a h THR 95 N 1.05 0.94 0.00 6.82 2.02 -1.43 -2.06 112.91 120.25 2k9a h THR 95 Ca 0.23 -0.14 -0.14 0.00 0.77 0.00 0.00 66.41 67.12 2k9a h THR 95 Cb 0.32 0.49 -0.02 0.00 -1.74 0.00 0.00 68.15 67.20 2k9a h THR 95 CO -0.00 0.08 -0.68 0.74 0.37 0.00 0.00 175.52 176.02 2k9a h THR 96 N 0.41 1.47 -0.71 3.16 2.02 -1.28 -3.16 112.91 114.82 2k9a h THR 96 Ca 0.20 -2.36 -0.00 0.00 0.77 0.00 0.00 66.41 65.01 2k9a h THR 96 Cb 0.13 2.28 -0.04 0.00 -1.74 0.00 0.00 68.15 68.78 2k9a h THR 96 CO -0.15 0.67 0.44 0.25 0.37 0.00 0.00 175.52 177.10 2k9a h LEU 97 N 0.00 0.84 -1.84 2.58 6.46 -0.36 -0.58 115.31 122.42 2k9a h LEU 97 Ca -0.01 -0.04 0.24 0.00 -0.12 0.00 0.00 57.88 57.95 2k9a h LEU 97 Cb 1.23 -0.21 -0.05 0.00 -0.73 0.00 0.00 40.66 40.90 2k9a h LEU 97 CO 0.09 0.63 0.61 1.56 -0.62 0.00 0.00 178.44 180.72 2k9a h GLN 98 N 0.98 0.13 0.01 1.25 4.20 -1.39 0.06 115.11 120.34 2k9a h GLN 98 Ca 0.26 -0.01 -0.35 0.00 0.06 0.00 0.00 58.65 58.61 2k9a h GLN 98 Cb -0.06 -0.03 -0.06 0.00 0.30 0.00 0.00 27.48 27.63 2k9a h GLN 98 CO -0.05 0.08 -2.18 0.72 -0.67 0.00 0.00 178.83 176.73 2k9a n HIS 99 N -4.36 0.35 0.50 2.96 8.25 -0.76 -4.11 115.22 118.04 2k9a n HIS 99 Ca 0.18 0.12 0.06 0.00 -0.26 0.00 0.00 57.72 57.82 2k9a n HIS 99 Cb 0.86 -1.06 0.28 0.00 1.12 0.00 0.00 29.99 31.19 2k9a n HIS 99 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2k9a n HIS 100 N -2.91 0.00 0.29 4.41 -0.00 -0.14 -2.60 115.22 114.26 2k9a n HIS 100 Ca -0.29 0.00 0.17 0.00 -0.00 0.00 0.00 57.72 57.60 2k9a n HIS 100 Cb 1.11 -0.39 0.95 0.00 -0.00 0.00 0.00 29.99 31.67 2k9a n HIS 100 CO 0.00 0.00 0.00 0.87 -0.00 0.00 0.00 176.34 177.21 2k9a h LYS 101 N 0.00 0.00 0.00 1.57 1.57 -1.30 0.75 116.57 119.16 2k9a h LYS 101 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2k9a h LYS 101 Cb 0.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.47 2k9a h LYS 101 CO 0.00 0.00 0.00 -0.25 -0.57 0.00 0.00 179.45 178.63 2k9a n ASP 102 N -3.67 0.00 0.04 0.86 8.00 -1.07 -3.97 116.55 116.74 2k9a n ASP 102 Ca -0.02 -0.32 0.00 0.00 0.71 0.00 0.00 54.79 55.16 2k9a n ASP 102 Cb 0.14 -0.13 0.00 0.00 -0.02 0.00 0.00 41.12 41.11 2k9a n ASP 102 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 2k9a n GLU 103 N -1.13 0.00 -1.01 -1.24 2.13 0.12 -5.09 120.64 114.41 2k9a n GLU 103 Ca 0.12 0.00 -0.31 0.00 0.66 0.00 0.00 57.16 57.63 2k9a n GLU 103 Cb 0.10 -0.33 0.14 0.00 0.27 0.00 0.00 31.44 31.63 2k9a n GLU 103 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 2k9a s VAL 104 N -2.00 2.68 -0.32 6.31 0.11 -0.38 -4.87 120.40 121.93 2k9a s VAL 104 Ca 0.00 0.22 -0.28 0.00 -2.93 0.00 0.00 61.98 59.00 2k9a s VAL 104 Cb 0.00 -2.53 -0.05 0.00 -1.53 0.00 0.00 36.38 32.28 2k9a s VAL 104 CO 0.00 -0.29 2.18 0.00 -3.33 0.00 0.00 175.10 173.66 2k9a s ALA 105 N -2.80 2.45 0.44 1.54 0.00 -1.26 -4.79 121.76 117.36 2k9a s ALA 105 Ca 0.64 0.44 0.13 0.00 0.00 0.00 0.00 51.96 53.17 2k9a s ALA 105 Cb -0.20 -4.14 0.99 0.00 0.00 0.00 0.00 23.12 19.77 2k9a s ALA 105 CO 0.57 -3.23 2.00 0.78 0.00 0.00 0.00 175.76 175.89 2k9a h GLY 106 N 16.03 0.08 1.06 0.00 0.00 -1.90 -2.60 103.07 115.73 2k9a h GLY 106 Ca -0.35 -0.04 -0.08 0.00 0.00 0.00 0.00 47.33 46.86 2k9a h GLY 106 CO 1.03 0.04 0.05 -1.80 0.00 0.00 0.00 176.54 175.86 2k9a h ASP 107 N 0.07 1.00 -0.01 0.19 3.58 -1.97 0.22 116.42 119.51 2k9a h ASP 107 Ca 0.02 -0.28 -0.00 0.00 0.42 0.00 0.00 57.03 57.18 2k9a h ASP 107 Cb 0.26 -0.27 -0.00 0.00 1.72 0.00 0.00 39.33 41.05 2k9a h ASP 107 CO 0.02 1.03 -0.00 0.40 -2.88 0.00 0.00 179.24 177.81 2k9a h ILE 108 N 0.93 1.33 0.00 2.25 2.04 -1.87 -3.05 117.51 119.14 2k9a h ILE 108 Ca 0.18 -0.97 -0.05 0.00 1.00 0.00 0.00 64.86 65.01 2k9a h ILE 108 Cb 0.49 1.97 -0.01 0.00 -0.74 0.00 0.00 36.82 38.53 2k9a h ILE 108 CO 0.02 0.26 -0.24 0.15 0.00 0.00 0.00 178.15 178.34 2k9a h PHE 109 N -0.38 0.00 -1.11 1.37 3.57 -1.49 -2.68 116.94 116.22 2k9a h PHE 109 Ca 0.00 0.00 0.32 0.00 3.53 0.00 0.00 57.97 61.82 2k9a h PHE 109 Cb 0.42 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 39.10 2k9a h PHE 109 CO 0.07 0.24 0.79 0.22 -2.23 0.00 0.00 178.31 177.40 2k9a h ASP 110 N 0.00 0.08 -0.02 0.41 3.58 -0.83 0.29 116.42 119.92 2k9a h ASP 110 Ca -0.00 0.02 -0.02 0.00 0.42 0.00 0.00 57.03 57.44 2k9a h ASP 110 Cb 0.46 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.51 2k9a h ASP 110 CO 0.03 0.01 -0.08 -0.03 -2.88 0.00 0.00 179.24 176.29 2k9a h MET 111 N 0.07 0.10 0.00 0.28 4.05 -1.58 -3.17 114.93 114.67 2k9a h MET 111 Ca 0.55 -0.07 -0.01 0.00 -0.28 0.00 0.00 59.70 59.88 2k9a h MET 111 Cb 2.05 0.01 -0.00 0.00 -0.80 0.00 0.00 31.60 32.86 2k9a h MET 111 CO -0.06 0.70 -0.06 -0.07 0.23 0.00 0.00 176.91 177.66 2k9a h LEU 112 N -0.49 0.00 -1.86 3.39 3.38 -0.71 -2.78 115.31 116.23 2k9a h LEU 112 Ca -0.00 0.00 0.21 0.00 0.09 0.00 0.00 57.88 58.18 2k9a h LEU 112 Cb 0.71 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.43 2k9a h LEU 112 CO 0.02 0.06 0.67 -0.07 0.09 0.00 0.00 178.44 179.20 2k9a h LEU 113 N 0.00 0.00 0.00 1.67 3.38 -0.70 0.50 115.31 120.16 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 0.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.01 2k9a h LEU 113 CO 0.01 0.00 0.03 0.35 0.09 0.00 0.00 178.44 178.92 2k9a n THR 114 N -3.85 0.56 -0.01 0.22 -2.24 -1.05 -1.36 114.28 106.55 2k9a n THR 114 Ca 0.15 0.17 -0.01 0.00 -2.27 0.00 0.00 64.05 62.09 2k9a n THR 114 Cb 0.93 -1.17 0.27 0.00 -2.10 0.00 0.00 70.33 68.26 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 0.57 0.00 4.78 0.04 -1.17 -3.41 116.94 117.75 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 0.06 -0.16 0.00 0.00 2.20 0.00 0.00 35.95 38.05 2k9a h PHE 115 CO 0.00 0.57 0.00 0.25 -0.60 0.00 0.00 178.31 178.53 2k9a n THR 116 N -4.26 0.00 -1.62 -1.55 -2.24 -0.84 -5.02 114.28 98.75 2k9a n THR 116 Ca 0.01 0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.60 2k9a n THR 116 Cb 0.27 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.44 2k9a n THR 116 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2k9a s ASP 117 N -2.02 4.14 0.56 3.42 1.11 -0.46 -4.76 116.67 118.65 2k9a s ASP 117 Ca 0.00 0.20 0.23 0.00 0.18 0.00 0.00 52.55 53.16 2k9a s ASP 117 Cb 0.00 -2.54 1.56 0.00 1.07 0.00 0.00 42.92 43.01 2k9a s ASP 117 CO 0.00 -3.55 2.20 0.15 1.18 0.00 0.00 175.17 175.16 2k9a h PHE 118 N 14.02 0.00 -0.72 4.23 3.57 -1.90 -1.61 116.94 134.54 2k9a h PHE 118 Ca -0.05 0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.40 2k9a h PHE 118 Cb 1.06 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.77 2k9a h PHE 118 CO 1.12 0.00 0.23 -0.07 -2.23 0.00 0.00 178.31 177.36 2k9a h LEU 119 N 0.00 1.04 -0.34 0.59 3.38 -1.96 -1.76 115.31 116.26 2k9a h LEU 119 Ca 0.00 -0.21 -0.18 0.00 0.09 0.00 0.00 57.88 57.59 2k9a h LEU 119 Cb 0.02 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 2k9a h LEU 119 CO -0.00 0.97 -0.84 0.00 0.09 0.00 0.00 178.44 178.66 2k9a h ALA 120 N 1.11 0.60 0.33 1.53 0.00 -1.67 -2.34 119.26 118.82 2k9a h ALA 120 Ca 0.23 -0.73 -0.02 0.00 0.00 0.00 0.00 54.91 54.39 2k9a h ALA 120 Cb 0.30 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2k9a h ALA 120 CO -0.01 0.97 -0.16 0.35 0.00 0.00 0.00 179.25 180.41 2k9a h PHE 121 N 0.05 -0.41 -0.34 0.00 3.57 -1.14 -0.30 116.94 118.36 2k9a h PHE 121 Ca -0.02 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.43 2k9a h PHE 121 Cb 1.47 0.13 -0.01 0.00 2.79 0.00 0.00 35.95 40.33 2k9a h PHE 121 CO 0.01 -0.11 0.08 -0.22 -2.23 0.00 0.00 178.31 175.84 2k9a h LYS 122 N -0.70 0.55 -0.24 1.11 3.64 -1.42 -2.71 116.57 116.80 2k9a h LYS 122 Ca -0.04 -0.14 -0.02 0.00 -1.27 0.00 0.00 60.65 59.18 2k9a h LYS 122 Cb 0.48 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.22 2k9a h LYS 122 CO 0.07 0.61 0.08 1.49 -2.27 0.00 0.00 179.45 179.43 2k9a h GLU 123 N 0.40 0.34 -0.16 1.90 4.57 -1.45 -0.97 114.58 119.20 2k9a h GLU 123 Ca 0.11 -0.04 -0.02 0.00 -1.18 0.00 0.00 59.36 58.23 2k9a h GLU 123 Cb 0.31 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.83 2k9a h GLU 123 CO 0.00 0.30 0.03 1.98 -1.18 0.00 0.00 179.01 180.14 2k9a h MET 124 N 0.34 0.27 -0.08 1.92 4.05 -0.74 -1.30 114.93 119.38 2k9a h MET 124 Ca 0.08 -0.07 -0.02 0.00 -0.28 0.00 0.00 59.70 59.41 2k9a h MET 124 Cb 0.10 -0.03 -0.00 0.00 -0.80 0.00 0.00 31.60 30.87 2k9a h MET 124 CO -0.01 0.43 -0.05 0.74 0.23 0.00 0.00 176.91 178.26 2k9a h PHE 125 N 0.06 0.20 -0.50 1.39 0.04 -1.22 -2.44 116.94 114.47 2k9a h PHE 125 Ca 0.05 -0.05 0.05 0.00 2.80 0.00 0.00 57.97 60.82 2k9a h PHE 125 Cb 0.29 -0.05 -0.03 0.00 2.20 0.00 0.00 35.95 38.37 2k9a h PHE 125 CO 0.02 0.56 0.34 -0.07 -0.60 0.00 0.00 178.31 178.55 2k9a h LEU 126 N -0.21 0.42 -0.14 1.54 4.07 -1.22 -1.02 115.31 118.75 2k9a h LEU 126 Ca 0.02 -0.00 -0.05 0.00 0.08 0.00 0.00 57.88 57.92 2k9a h LEU 126 Cb 0.51 -0.09 -0.00 0.00 1.08 0.00 0.00 40.66 42.15 2k9a h LEU 126 CO 0.01 0.28 -0.11 -0.78 -1.08 0.00 0.00 178.44 176.76 2k9a h ASP 127 N 0.48 0.35 -0.26 -0.43 3.58 -1.15 -2.67 116.42 116.32 2k9a h ASP 127 Ca 0.21 -0.46 -0.02 0.00 0.42 0.00 0.00 57.03 57.19 2k9a h ASP 127 Cb 0.24 -0.10 -0.02 0.00 1.72 0.00 0.00 39.33 41.18 2k9a h ASP 127 CO -0.06 0.73 0.11 0.22 -2.88 0.00 0.00 179.24 177.36 2k9a h TYR 128 N -0.03 0.44 -0.24 0.28 3.20 -0.90 -2.34 116.97 117.38 2k9a h TYR 128 Ca 0.03 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.85 2k9a h TYR 128 Cb 0.62 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.74 2k9a h TYR 128 CO 0.08 0.37 0.03 -0.09 -1.64 0.00 0.00 178.16 176.91 2k9a h ARG 129 N 0.45 0.39 -0.14 1.82 2.43 -1.12 -2.85 114.38 115.37 2k9a h ARG 129 Ca 0.11 -0.11 -0.03 0.00 -0.81 0.00 0.00 59.98 59.14 2k9a h ARG 129 Cb 0.13 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.62 2k9a h ARG 129 CO -0.01 0.54 -0.07 0.00 -1.51 0.00 0.00 179.97 178.91 2k9a h ALA 130 N 0.84 1.62 0.00 2.80 0.00 -1.12 -1.50 119.26 121.90 2k9a h ALA 130 Ca 0.07 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 2k9a h ALA 130 Cb 0.34 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 2k9a h ALA 130 CO 0.01 0.28 -0.07 1.49 0.00 0.00 0.00 179.25 180.95 2k9a h GLU 131 N 0.20 0.00 0.00 0.00 4.81 -1.20 -2.35 114.58 116.04 2k9a h GLU 131 Ca 0.05 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.26 2k9a h GLU 131 Cb 0.26 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.64 2k9a h GLU 131 CO 0.01 0.07 -0.08 0.87 -0.73 0.00 0.00 179.01 179.15 2k9a h LYS 132 N 0.00 0.00 0.00 1.92 1.79 -1.12 -2.17 116.57 116.99 2k9a h LYS 132 Ca -0.00 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.43 2k9a h LYS 132 Cb 0.44 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.09 2k9a h LYS 132 CO 0.01 0.08 -0.19 0.93 -1.08 0.00 0.00 179.45 179.20 2k9a h GLU 133 N 0.00 0.00 0.00 3.15 4.39 -1.54 -3.47 114.58 117.11 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 0.40 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.05 2k9a h GLU 133 CO 0.01 0.19 0.00 0.41 -1.16 0.00 0.00 179.01 178.46 2k9a n GLY 134 N -0.09 2.95 0.00 -3.84 0.00 -0.82 -4.70 105.19 98.69 2k9a n GLY 134 Ca -0.00 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 44.97 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 0.00 1.21 0.00 1.61 0.63 -1.26 -5.05 116.66 113.81 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 0.00 -0.50 0.00 0.00 0.45 0.00 0.00 32.46 32.41 2k9a n ARG 135 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53