#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k9a s ASP 2 N 0.00 6.53 0.00 7.83 1.01 -1.26 -4.99 116.67 125.79 2k9a s ASP 2 Ca 0.00 0.73 0.00 0.00 0.71 0.00 0.00 52.55 53.99 2k9a s ASP 2 Cb 0.00 -2.15 0.00 0.00 1.01 0.00 0.00 42.92 41.78 2k9a s ASP 2 CO 0.00 -0.04 0.59 0.00 0.21 0.00 0.00 175.17 175.93 2k9a n ALA 3 N -0.21 1.46 -1.00 5.23 0.00 -1.26 -5.15 120.51 119.59 2k9a n ALA 3 Ca -0.01 -0.53 0.03 0.00 0.00 0.00 0.00 53.44 52.93 2k9a n ALA 3 Cb 0.52 -0.17 -0.01 0.00 0.00 0.00 0.00 19.45 19.80 2k9a n ALA 3 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2k9a n LEU 4 N 0.00 0.00 -4.15 0.00 4.32 -1.26 -4.62 117.00 111.29 2k9a n LEU 4 Ca 0.00 0.23 -0.36 0.00 -0.02 0.00 0.00 56.01 55.87 2k9a n LEU 4 Cb 0.57 -0.66 -0.13 0.00 -1.62 0.00 0.00 43.42 41.58 2k9a n LEU 4 CO 0.00 -1.60 -0.26 -0.70 -1.22 0.00 0.00 177.39 173.61 2k9a s GLU 5 N -0.34 2.19 0.51 3.23 2.12 -1.26 -5.10 118.70 120.05 2k9a s GLU 5 Ca 0.00 -1.55 -0.10 0.00 0.36 0.00 0.00 54.97 53.68 2k9a s GLU 5 Cb 0.00 -3.40 -0.05 0.00 0.26 0.00 0.00 34.13 30.95 2k9a s GLU 5 CO 0.00 -0.85 0.89 0.20 -0.54 0.00 0.00 175.26 174.95 2k9a s GLY 6 N 1.52 1.72 -0.41 -1.50 0.00 -1.26 -5.03 107.32 102.36 2k9a s GLY 6 Ca 0.02 -0.22 -0.24 0.00 0.00 0.00 0.00 44.72 44.29 2k9a s GLY 6 CO -0.03 0.00 0.82 -0.54 0.00 0.00 0.00 173.10 173.35 2k9a s GLU 7 N -4.59 3.59 0.00 2.90 0.41 -1.26 -4.80 118.70 114.94 2k9a s GLU 7 Ca 0.52 0.14 0.00 0.00 -0.41 0.00 0.00 54.97 55.22 2k9a s GLU 7 Cb -0.10 -3.88 0.00 0.00 -1.78 0.00 0.00 34.13 28.37 2k9a s GLU 7 CO 0.43 -1.02 0.00 0.45 -0.49 0.00 0.00 175.26 174.62 2k9a n SER 8 N 6.69 0.96 -4.76 -0.19 2.88 -1.26 -5.07 113.62 112.87 2k9a n SER 8 Ca 0.03 -0.22 -0.39 0.00 -1.33 0.00 0.00 58.87 56.97 2k9a n SER 8 Cb 0.48 0.63 0.01 0.00 -0.75 0.00 0.00 64.21 64.58 2k9a n SER 8 CO 0.00 0.00 0.00 -0.36 -1.23 0.00 0.00 175.04 173.45 2k9a s PHE 9 N -0.82 2.69 -0.12 0.66 0.08 -1.26 -4.94 117.98 114.26 2k9a s PHE 9 Ca 0.00 1.42 0.20 0.00 0.12 0.00 0.00 56.93 58.66 2k9a s PHE 9 Cb 0.00 -3.65 -0.29 0.00 -0.57 0.00 0.00 43.02 38.51 2k9a s PHE 9 CO 0.00 -2.19 0.26 0.00 -0.10 0.00 0.00 175.22 173.18 2k9a n ALA 10 N -0.27 2.10 -2.88 5.36 0.00 -1.26 -4.96 120.51 118.60 2k9a n ALA 10 Ca 0.06 -0.95 -0.29 0.00 0.00 0.00 0.00 53.44 52.27 2k9a n ALA 10 Cb 0.45 -0.43 -0.04 0.00 0.00 0.00 0.00 19.45 19.42 2k9a n ALA 10 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 2k9a s LEU 11 N -5.02 4.14 0.80 0.00 0.05 -1.26 -5.12 118.68 112.27 2k9a s LEU 11 Ca -0.09 0.11 -0.05 0.00 0.05 0.00 0.00 54.13 54.16 2k9a s LEU 11 Cb 0.10 -2.75 0.16 0.00 -2.05 0.00 0.00 46.19 41.64 2k9a s LEU 11 CO 0.85 0.12 1.10 -0.44 -0.55 0.00 0.00 176.35 177.43 2k9a s SER 12 N -2.80 3.90 0.00 1.48 0.01 -1.26 -5.06 113.70 109.98 2k9a s SER 12 Ca 0.33 -0.27 0.00 0.00 1.31 0.00 0.00 55.95 57.32 2k9a s SER 12 Cb -0.12 0.04 0.00 0.00 0.21 0.00 0.00 66.02 66.15 2k9a s SER 12 CO 0.26 -2.18 0.64 0.49 0.41 0.00 0.00 173.24 172.87 2k9a n PHE 13 N -3.12 0.00 0.06 2.43 3.72 -1.26 -5.01 117.46 114.28 2k9a n PHE 13 Ca 0.16 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.56 2k9a n PHE 13 Cb 0.60 -0.15 0.00 0.00 -0.94 0.00 0.00 39.48 38.99 2k9a n PHE 13 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 2k9a n SER 14 N -0.95 -1.09 0.00 4.37 3.41 -1.26 -5.04 113.62 113.06 2k9a n SER 14 Ca 0.00 0.38 0.00 0.00 -0.26 0.00 0.00 58.87 58.99 2k9a n SER 14 Cb 0.00 1.25 0.00 0.00 -0.26 0.00 0.00 64.21 65.20 2k9a n SER 14 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2k9a n SER 15 N -2.63 0.00 0.31 4.04 2.88 -1.26 -4.66 113.62 112.30 2k9a n SER 15 Ca 0.00 0.00 0.20 0.00 -1.33 0.00 0.00 58.87 57.74 2k9a n SER 15 Cb 0.00 0.00 1.04 0.00 -0.75 0.00 0.00 64.21 64.50 2k9a n SER 15 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2k9a h ALA 16 N 0.00 1.25 0.00 -1.46 0.00 -1.95 0.31 119.26 117.41 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 -0.13 -0.21 0.43 0.00 0.00 0.00 179.25 179.34 2k9a n SER 17 N -3.21 1.25 0.00 0.00 7.64 -1.26 -3.94 113.62 114.10 2k9a n SER 17 Ca -0.02 -2.49 0.00 0.00 1.01 0.00 0.00 58.87 57.36 2k9a n SER 17 Cb 0.19 -0.30 0.00 0.00 -1.01 0.00 0.00 64.21 63.09 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 -0.73 0.00 0.21 6.43 2.03 -0.54 -4.83 116.55 119.13 2k9a n ASP 18 Ca 0.08 0.00 -0.13 0.00 0.52 0.00 0.00 54.79 55.26 2k9a n ASP 18 Cb 0.64 0.00 -0.07 0.00 -0.72 0.00 0.00 41.12 40.97 2k9a n ASP 18 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2k9a h ALA 19 N 0.86 -0.57 -0.66 -1.67 0.00 -1.78 -2.07 119.26 113.37 2k9a h ALA 19 Ca 0.00 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 2k9a h ALA 19 Cb 0.00 0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 2k9a h ALA 19 CO 0.00 -0.62 0.29 1.49 0.00 0.00 0.00 179.25 180.41 2k9a h GLU 20 N -0.96 0.95 0.50 0.00 4.81 -0.75 -2.17 114.58 116.96 2k9a h GLU 20 Ca -0.06 -0.14 -0.02 0.00 -0.13 0.00 0.00 59.36 59.01 2k9a h GLU 20 Cb 0.56 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.77 2k9a h GLU 20 CO 0.09 0.76 -0.24 0.35 -0.73 0.00 0.00 179.01 179.24 2k9a h PHE 21 N 0.94 -0.63 -0.44 0.92 3.04 -1.45 -2.44 116.94 116.88 2k9a h PHE 21 Ca 0.23 -0.01 0.09 0.00 3.98 0.00 0.00 57.97 62.26 2k9a h PHE 21 Cb 0.14 0.21 -0.02 0.00 2.56 0.00 0.00 35.95 38.84 2k9a h PHE 21 CO 0.01 -0.35 0.31 -0.44 -2.02 0.00 0.00 178.31 175.82 2k9a h ASP 22 N -0.77 0.16 -0.24 0.41 3.32 -1.28 -1.44 116.42 116.58 2k9a h ASP 22 Ca -0.07 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.98 2k9a h ASP 22 Cb 0.56 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.07 2k9a h ASP 22 CO 0.11 0.10 0.13 0.00 -1.72 0.00 0.00 179.24 177.86 2k9a h ALA 23 N 1.78 0.31 -0.84 3.45 0.00 -1.02 -2.45 119.26 120.49 2k9a h ALA 23 Ca 0.21 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2k9a h ALA 23 Cb 0.58 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 2k9a h ALA 23 CO -0.03 -0.14 0.53 0.28 0.00 0.00 0.00 179.25 179.88 2k9a h VAL 24 N 0.28 1.23 -0.93 0.00 2.07 -0.81 -2.07 116.25 116.01 2k9a h VAL 24 Ca 0.09 -0.46 0.03 0.00 0.82 0.00 0.00 66.70 67.17 2k9a h VAL 24 Cb 0.08 0.02 -0.05 0.00 -1.52 0.00 0.00 31.29 29.82 2k9a h VAL 24 CO -0.01 0.23 0.61 0.58 0.02 0.00 0.00 177.57 178.99 2k9a h VAL 25 N 1.15 1.17 -0.25 2.57 2.07 -1.11 -1.02 116.25 120.83 2k9a h VAL 25 Ca 0.30 -0.41 -0.01 0.00 0.82 0.00 0.00 66.70 67.40 2k9a h VAL 25 Cb -0.08 -0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 29.56 2k9a h VAL 25 CO -0.06 0.22 0.10 1.23 0.02 0.00 0.00 177.57 179.08 2k9a h GLY 26 N 1.19 0.39 2.00 2.17 0.00 -0.93 -1.92 103.07 105.97 2k9a h GLY 26 Ca 0.36 -0.21 -0.02 0.00 0.00 0.00 0.00 47.33 47.46 2k9a h GLY 26 CO -0.11 0.20 -0.11 -0.97 0.00 0.00 0.00 176.54 175.55 2k9a h TYR 27 N 0.25 0.00 -0.09 5.60 0.05 -1.08 -2.53 116.97 119.16 2k9a h TYR 27 Ca 0.08 0.00 -0.04 0.00 0.05 0.00 0.00 58.73 58.82 2k9a h TYR 27 Cb 0.16 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.90 2k9a h TYR 27 CO -0.01 0.11 -0.10 -0.07 -1.05 0.00 0.00 178.16 177.03 2k9a h LEU 28 N 0.00 0.25 -0.95 3.88 3.38 -0.68 -3.06 115.31 118.13 2k9a h LEU 28 Ca -0.00 -0.50 0.09 0.00 0.09 0.00 0.00 57.88 57.56 2k9a h LEU 28 Cb 0.22 -0.07 -0.07 0.00 0.09 0.00 0.00 40.66 40.82 2k9a h LEU 28 CO 0.01 0.70 0.59 -0.33 0.09 0.00 0.00 178.44 179.50 2k9a h GLU 29 N -0.19 0.97 -0.29 1.13 5.08 -0.96 0.61 114.58 120.93 2k9a h GLU 29 Ca 0.01 -0.06 0.01 0.00 -1.00 0.00 0.00 59.36 58.33 2k9a h GLU 29 Cb 0.63 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 2k9a h GLU 29 CO 0.03 0.64 0.19 0.22 -1.00 0.00 0.00 179.01 179.09 2k9a h ASP 30 N 1.00 0.29 0.54 1.42 3.58 -1.46 -2.00 116.42 119.80 2k9a h ASP 30 Ca 0.44 -0.01 -0.29 0.00 0.42 0.00 0.00 57.03 57.60 2k9a h ASP 30 Cb 0.34 -0.07 0.01 0.00 1.72 0.00 0.00 39.33 41.33 2k9a h ASP 30 CO -0.23 0.21 -1.29 0.40 -2.88 0.00 0.00 179.24 175.45 2k9a h ILE 31 N 0.35 1.45 -0.29 2.25 2.04 -0.86 -2.43 117.51 120.02 2k9a h ILE 31 Ca 0.11 -2.97 -0.00 0.00 1.00 0.00 0.00 64.86 63.00 2k9a h ILE 31 Cb 0.02 2.96 -0.01 0.00 -0.74 0.00 0.00 36.82 39.05 2k9a h ILE 31 CO -0.02 0.87 0.17 0.40 0.00 0.00 0.00 178.15 179.57 2k9a h ILE 32 N 0.10 1.09 -0.45 -0.67 2.04 -0.37 -1.39 117.51 117.85 2k9a h ILE 32 Ca -0.16 -0.19 0.00 0.00 1.00 0.00 0.00 64.86 65.51 2k9a h ILE 32 Cb 2.01 0.68 0.00 0.00 -0.74 0.00 0.00 36.82 38.77 2k9a h ILE 32 CO 0.22 0.09 0.00 0.23 0.00 0.00 0.00 178.15 178.69 2k9a n MET 33 N -4.47 3.21 -2.36 2.37 2.81 -0.92 -4.82 117.12 112.94 2k9a n MET 33 Ca 0.01 -2.59 -0.41 0.00 -1.81 0.00 0.00 57.70 52.90 2k9a n MET 33 Cb 0.08 -1.66 -0.03 0.00 -0.71 0.00 0.00 33.22 30.90 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 -1.20 7.07 0.12 7.83 2.15 -0.52 -4.94 116.67 127.17 2k9a s ASP 34 Ca 0.39 2.22 -0.25 0.00 0.43 0.00 0.00 52.55 55.35 2k9a s ASP 34 Cb 0.26 -2.60 -0.05 0.00 -0.30 0.00 0.00 42.92 40.22 2k9a s ASP 34 CO 0.18 -0.40 1.65 -0.78 -0.17 0.00 0.00 175.17 175.65 2k9a h ASP 35 N 5.51 -0.59 -0.10 -0.34 1.82 -1.89 0.02 116.42 120.85 2k9a h ASP 35 Ca -0.44 0.09 0.03 0.00 -0.39 0.00 0.00 57.03 56.31 2k9a h ASP 35 Cb 1.21 0.25 -0.00 0.00 0.68 0.00 0.00 39.33 41.47 2k9a h ASP 35 CO 0.76 -0.27 0.09 -0.08 -1.61 0.00 0.00 179.24 178.13 2k9a h GLU 36 N -0.32 0.00 0.08 0.28 4.57 -1.95 -1.29 114.58 115.96 2k9a h GLU 36 Ca 0.06 0.00 -0.26 0.00 -1.18 0.00 0.00 59.36 57.98 2k9a h GLU 36 Cb 0.40 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.00 2k9a h GLU 36 CO -0.19 0.00 -1.14 0.35 -1.18 0.00 0.00 179.01 176.85 2k9a h PHE 37 N 0.00 0.70 -0.31 0.92 3.57 -1.46 -2.26 116.94 118.10 2k9a h PHE 37 Ca 0.05 -0.44 -0.04 0.00 3.53 0.00 0.00 57.97 61.07 2k9a h PHE 37 Cb 0.23 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.90 2k9a h PHE 37 CO 0.00 1.29 0.03 1.96 -2.23 0.00 0.00 178.31 179.36 2k9a h GLN 38 N 0.19 0.52 -0.33 1.11 1.08 0.08 -0.58 115.11 117.18 2k9a h GLN 38 Ca -0.13 -0.15 -0.12 0.00 -1.45 0.00 0.00 58.65 56.80 2k9a h GLN 38 Cb 1.81 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 29.18 2k9a h GLN 38 CO 0.20 0.64 -0.26 1.25 -0.95 0.00 0.00 178.83 179.70 2k9a h LEU 39 N 0.33 0.81 -0.14 1.46 7.12 -1.49 -1.29 115.31 122.11 2k9a h LEU 39 Ca 0.09 -0.45 -0.01 0.00 0.13 0.00 0.00 57.88 57.64 2k9a h LEU 39 Cb 0.38 -0.23 -0.01 0.00 -0.53 0.00 0.00 40.66 40.28 2k9a h LEU 39 CO 0.01 1.09 0.04 0.25 -0.13 0.00 0.00 178.44 179.69 2k9a h LEU 40 N 0.54 0.21 -0.35 2.25 6.46 -1.37 0.09 115.31 123.13 2k9a h LEU 40 Ca 0.06 -0.22 -0.06 0.00 -0.12 0.00 0.00 57.88 57.54 2k9a h LEU 40 Cb 0.83 -0.06 -0.01 0.00 -0.73 0.00 0.00 40.66 40.69 2k9a h LEU 40 CO 0.07 0.38 -0.01 -0.61 -0.62 0.00 0.00 178.44 177.65 2k9a h GLN 41 N 0.03 0.63 -0.35 1.25 4.15 -1.14 -2.71 115.11 116.97 2k9a h GLN 41 Ca 0.04 -0.20 -0.09 0.00 0.77 0.00 0.00 58.65 59.17 2k9a h GLN 41 Cb 0.25 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 27.87 2k9a h GLN 41 CO -0.00 0.75 -0.15 -0.09 -1.93 0.00 0.00 178.83 177.41 2k9a h ARG 42 N 0.43 0.63 -0.10 1.69 2.43 -1.21 -0.59 114.38 117.66 2k9a h ARG 42 Ca 0.10 -0.21 -0.00 0.00 -0.81 0.00 0.00 59.98 59.06 2k9a h ARG 42 Cb 0.47 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 29.96 2k9a h ARG 42 CO 0.02 0.75 0.04 -0.97 -1.51 0.00 0.00 179.97 178.31 2k9a h ASN 43 N 0.57 0.13 -0.08 -3.80 -1.24 -0.86 -1.19 115.58 109.11 2k9a h ASN 43 Ca 0.10 -0.14 -0.10 0.00 0.71 0.00 0.00 56.30 56.87 2k9a h ASN 43 Cb 0.58 -0.03 0.00 0.00 0.73 0.00 0.00 38.32 39.60 2k9a h ASN 43 CO 0.04 0.24 -0.33 -0.26 -1.29 0.00 0.00 177.43 175.83 2k9a h PHE 44 N 0.02 0.49 -0.03 0.67 -1.00 -1.43 -3.09 116.94 112.56 2k9a h PHE 44 Ca 0.03 -0.21 0.01 0.00 2.81 0.00 0.00 57.97 60.62 2k9a h PHE 44 Cb 0.15 -0.08 -0.00 0.00 3.61 0.00 0.00 35.95 39.63 2k9a h PHE 44 CO -0.02 0.94 0.04 0.52 -1.61 0.00 0.00 178.31 178.18 2k9a h MET 45 N -0.10 0.00 -0.10 1.51 2.86 -1.12 -0.33 114.93 117.65 2k9a h MET 45 Ca -0.02 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.61 2k9a h MET 45 Cb 0.97 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.62 2k9a h MET 45 CO 0.07 0.00 -0.01 0.22 1.06 0.00 0.00 176.91 178.25 2k9a h ASP 46 N 0.00 0.12 0.05 1.22 1.82 -1.12 -1.37 116.42 117.14 2k9a h ASP 46 Ca 0.02 -0.01 -0.38 0.00 -0.39 0.00 0.00 57.03 56.27 2k9a h ASP 46 Cb 0.10 -0.03 -0.06 0.00 0.68 0.00 0.00 39.33 40.02 2k9a h ASP 46 CO -0.00 0.16 -2.34 0.29 -1.61 0.00 0.00 179.24 175.74 2k9a n LYS 47 N -4.44 0.68 -0.02 0.28 4.76 -0.26 -4.22 118.16 114.94 2k9a n LYS 47 Ca -0.01 0.15 -0.10 0.00 -2.87 0.00 0.00 58.31 55.48 2k9a n LYS 47 Cb 0.15 -1.57 -0.04 0.00 -1.84 0.00 0.00 35.03 31.73 2k9a n LYS 47 CO 0.00 0.00 0.00 1.88 -1.37 0.00 0.00 177.40 177.91 2k9a h TYR 48 N 0.01 0.08 0.00 2.13 -1.99 -1.11 -1.66 116.97 114.43 2k9a h TYR 48 Ca -0.53 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.20 2k9a h TYR 48 Cb 1.99 -0.02 0.00 0.00 2.00 0.00 0.00 36.73 40.70 2k9a h TYR 48 CO 0.03 0.04 0.00 0.10 -0.00 0.00 0.00 178.16 178.33 2k9a h TYR 49 N 0.11 0.00 0.01 4.88 -0.00 -1.47 -1.58 116.97 118.92 2k9a h TYR 49 Ca 0.06 0.00 -0.05 0.00 -0.00 0.00 0.00 58.73 58.74 2k9a h TYR 49 Cb 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 36.77 2k9a h TYR 49 CO -0.11 0.00 -0.20 -0.07 -0.00 0.00 0.00 178.16 177.78 2k9a h LEU 50 N 0.00 0.16 -0.90 0.10 3.38 -1.48 -3.31 115.31 113.26 2k9a h LEU 50 Ca 0.00 -0.84 -0.11 0.00 0.09 0.00 0.00 57.88 57.02 2k9a h LEU 50 Cb 0.16 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 2k9a h LEU 50 CO 0.00 0.98 -0.47 -0.33 0.09 0.00 0.00 178.44 178.70 2k9a h GLU 51 N -0.64 0.18 -5.96 1.13 5.08 -1.13 -3.38 114.58 109.85 2k9a h GLU 51 Ca -0.03 -0.09 -0.57 0.00 -1.00 0.00 0.00 59.36 57.67 2k9a h GLU 51 Cb 1.02 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 30.18 2k9a h GLU 51 CO 0.04 0.62 1.58 -0.06 -1.00 0.00 0.00 179.01 180.18 2k9a s PHE 52 N -4.00 2.48 -0.00 4.33 0.40 -0.62 -4.96 117.98 115.60 2k9a s PHE 52 Ca -0.04 -0.81 0.01 0.00 -0.60 0.00 0.00 56.93 55.50 2k9a s PHE 52 Cb 0.13 -4.60 -0.04 0.00 0.51 0.00 0.00 43.02 39.02 2k9a s PHE 52 CO 0.77 -1.84 0.02 -1.21 0.70 0.00 0.00 175.22 173.66 2k9a s GLU 53 N 5.10 2.84 -0.73 0.44 2.02 -1.26 -4.77 118.70 122.34 2k9a s GLU 53 Ca 0.52 -0.58 -0.26 0.00 0.02 0.00 0.00 54.97 54.67 2k9a s GLU 53 Cb 0.00 -2.71 -0.04 0.00 0.10 0.00 0.00 34.13 31.48 2k9a s GLU 53 CO -0.03 0.63 1.97 0.34 0.02 0.00 0.00 175.26 178.19 2k9a s ASP 54 N -1.59 5.07 0.24 -0.19 2.15 -1.26 -4.90 116.67 116.20 2k9a s ASP 54 Ca 0.20 -0.03 0.03 0.00 0.43 0.00 0.00 52.55 53.18 2k9a s ASP 54 Cb -0.12 -2.54 -0.01 0.00 -0.30 0.00 0.00 42.92 39.95 2k9a s ASP 54 CO 0.11 -2.66 0.12 0.35 -0.17 0.00 0.00 175.17 172.92 2k9a n THR 55 N 7.63 0.00 -0.07 1.71 -2.24 -1.26 -5.08 114.28 114.97 2k9a n THR 55 Ca 0.31 -1.51 -0.08 0.00 -2.27 0.00 0.00 64.05 60.51 2k9a n THR 55 Cb 0.50 0.61 -0.11 0.00 -2.10 0.00 0.00 70.33 69.23 2k9a n THR 55 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2k9a n GLU 56 N -0.52 1.51 -2.96 -0.78 1.02 -1.26 -4.97 120.64 112.67 2k9a n GLU 56 Ca -0.01 0.01 -0.40 0.00 -0.02 0.00 0.00 57.16 56.74 2k9a n GLU 56 Cb 0.38 -1.36 -0.05 0.00 -0.02 0.00 0.00 31.44 30.40 2k9a n GLU 56 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 2k9a s GLU 57 N -2.34 4.50 -0.05 3.49 2.56 -1.26 -5.05 118.70 120.55 2k9a s GLU 57 Ca -0.10 1.08 -0.12 0.00 0.00 0.00 0.00 54.97 55.83 2k9a s GLU 57 Cb 0.04 -3.37 -0.05 0.00 2.00 0.00 0.00 34.13 32.75 2k9a s GLU 57 CO 0.55 0.26 0.32 1.21 -0.56 0.00 0.00 175.26 177.03 2k9a s ASN 58 N 0.03 6.66 0.15 -1.70 2.47 -1.26 -5.10 114.94 116.20 2k9a s ASN 58 Ca 0.39 0.78 0.05 0.00 0.42 0.00 0.00 52.86 54.51 2k9a s ASN 58 Cb -0.20 -2.19 -0.04 0.00 -1.45 0.00 0.00 41.25 37.36 2k9a s ASN 58 CO 0.23 0.33 0.11 -0.54 -3.72 0.00 0.00 177.10 173.51 2k9a s LYS 59 N -0.92 2.84 0.05 0.43 1.02 -1.26 -5.01 119.74 116.89 2k9a s LYS 59 Ca 0.21 -0.87 0.28 0.00 0.02 0.00 0.00 55.97 55.61 2k9a s LYS 59 Cb -0.15 -2.62 1.14 0.00 -0.52 0.00 0.00 37.83 35.67 2k9a s LYS 59 CO 0.10 0.49 1.89 1.28 -0.92 0.00 0.00 175.35 178.19 2k9a n LEU 60 N -0.21 0.20 0.09 3.17 4.77 -1.26 -3.23 117.00 120.53 2k9a n LEU 60 Ca -0.09 0.52 0.09 0.00 -0.03 0.00 0.00 56.01 56.51 2k9a n LEU 60 Cb 0.54 -0.46 0.41 0.00 -2.33 0.00 0.00 43.42 41.59 2k9a n LEU 60 CO 0.43 -0.04 0.78 0.00 -1.33 0.00 0.00 177.39 177.23 2k9a n ILE 61 N -1.68 1.01 0.28 -0.08 0.13 -1.26 -2.00 119.36 115.76 2k9a n ILE 61 Ca 0.07 0.32 0.16 0.00 -1.10 0.00 0.00 62.75 62.20 2k9a n ILE 61 Cb 0.36 -1.22 0.54 0.00 -0.84 0.00 0.00 39.64 38.49 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 0.00 0.05 9.51 -1.99 -1.99 -2.84 116.97 119.72 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 0.25 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.98 2k9a h TYR 62 CO 0.00 0.00 -0.03 1.15 -0.00 0.00 0.00 178.16 179.28 2k9a h THR 63 N 0.00 1.21 -0.67 -2.88 2.02 -1.66 -2.49 112.91 108.43 2k9a h THR 63 Ca 0.00 -1.60 -0.02 0.00 0.77 0.00 0.00 66.41 65.56 2k9a h THR 63 Cb 0.63 2.15 -0.03 0.00 -1.74 0.00 0.00 68.15 69.16 2k9a h THR 63 CO 0.00 0.36 0.35 -0.65 0.37 0.00 0.00 175.52 175.95 2k9a h PRO 64 N -0.88 0.95 -0.61 6.66 0.11 -1.72 -1.48 132.00 135.03 2k9a h PRO 64 Ca -0.01 -0.12 0.01 0.00 0.11 0.00 0.00 66.00 65.99 2k9a h PRO 64 Cb 0.65 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 31.54 2k9a h PRO 64 CO 0.01 0.73 0.40 0.82 -0.21 0.00 0.00 178.00 179.75 2k9a h ILE 65 N 0.93 1.14 -0.63 4.15 2.04 -1.62 -1.87 117.51 121.65 2k9a h ILE 65 Ca 0.24 -0.28 -0.04 0.00 1.00 0.00 0.00 64.86 65.78 2k9a h ILE 65 Cb 0.07 0.26 -0.03 0.00 -0.74 0.00 0.00 36.82 36.38 2k9a h ILE 65 CO -0.04 0.15 0.23 0.15 0.00 0.00 0.00 178.15 178.64 2k9a h PHE 66 N 0.81 0.94 -0.29 1.37 3.57 -1.12 -2.22 116.94 120.01 2k9a h PHE 66 Ca 0.23 -0.07 -0.05 0.00 3.53 0.00 0.00 57.97 61.62 2k9a h PHE 66 Cb -0.07 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 38.37 2k9a h PHE 66 CO -0.04 0.74 -0.02 -0.91 -2.23 0.00 0.00 178.31 175.85 2k9a h ASN 67 N 0.91 0.42 -0.16 0.41 -0.26 -0.62 -1.85 115.58 114.42 2k9a h ASN 67 Ca 0.21 -0.08 -0.16 0.00 -0.56 0.00 0.00 56.30 55.72 2k9a h ASN 67 Cb 0.21 -0.11 -0.01 0.00 -1.06 0.00 0.00 38.32 37.36 2k9a h ASN 67 CO -0.01 0.50 -0.46 -0.08 -1.06 0.00 0.00 177.43 176.31 2k9a h GLU 68 N 0.43 0.72 -0.24 0.81 4.57 -0.78 -1.48 114.58 118.62 2k9a h GLU 68 Ca 0.09 -0.41 -0.06 0.00 -1.18 0.00 0.00 59.36 57.81 2k9a h GLU 68 Cb 0.32 0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.93 2k9a h GLU 68 CO 0.01 1.03 -0.07 -0.92 -1.18 0.00 0.00 179.01 177.88 2k9a h TYR 69 N 0.57 0.54 0.00 0.92 3.20 -1.04 0.16 116.97 121.32 2k9a h TYR 69 Ca 0.03 -0.12 -0.09 0.00 3.14 0.00 0.00 58.73 61.69 2k9a h TYR 69 Cb 1.02 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 39.15 2k9a h TYR 69 CO 0.05 0.71 -0.44 0.82 -1.64 0.00 0.00 178.16 177.66 2k9a h ILE 70 N 0.20 1.22 0.22 1.81 1.08 -1.36 0.69 117.51 121.38 2k9a h ILE 70 Ca 0.06 -1.57 -0.33 0.00 -0.39 0.00 0.00 64.86 62.63 2k9a h ILE 70 Cb 0.55 1.87 0.03 0.00 -3.07 0.00 0.00 36.82 36.20 2k9a h ILE 70 CO 0.03 0.44 -1.52 -1.28 -0.69 0.00 0.00 178.15 175.12 2k9a h SER 71 N 0.00 0.72 0.00 1.72 0.87 -1.17 -3.27 113.55 112.43 2k9a h SER 71 Ca -0.00 -0.84 0.00 0.00 -1.23 0.00 0.00 61.79 59.72 2k9a h SER 71 Cb 0.83 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 62.56 2k9a h SER 71 CO 0.06 1.67 -0.38 0.25 -0.53 0.00 0.00 176.83 177.90 2k9a h LEU 72 N 0.13 0.00 0.79 2.23 5.85 -0.94 -3.35 115.31 120.01 2k9a h LEU 72 Ca -0.26 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.42 2k9a h LEU 72 Cb 2.13 0.00 0.01 0.00 0.37 0.00 0.00 40.66 43.16 2k9a h LEU 72 CO 0.24 0.58 -0.38 0.58 -0.34 0.00 0.00 178.44 179.12 2k9a h VAL 73 N -0.78 0.00 -0.72 1.05 2.07 -1.04 0.11 116.25 116.94 2k9a h VAL 73 Ca 0.00 -0.11 0.13 0.00 0.82 0.00 0.00 66.70 67.53 2k9a h VAL 73 Cb 0.38 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.06 2k9a h VAL 73 CO 0.00 0.00 0.29 -0.08 0.02 0.00 0.00 177.57 177.80 2k9a h GLU 74 N -1.17 0.44 0.00 1.57 4.81 -1.57 0.14 114.58 118.80 2k9a h GLU 74 Ca -0.11 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.04 2k9a h GLU 74 Cb 0.81 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.08 2k9a h GLU 74 CO 0.18 0.29 -0.25 0.87 -0.73 0.00 0.00 179.01 179.36 2k9a h LYS 75 N 0.45 0.00 -0.02 1.92 1.79 -1.60 -2.83 116.57 116.28 2k9a h LYS 75 Ca 0.39 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.86 2k9a h LYS 75 Cb 0.55 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.20 2k9a h LYS 75 CO -0.37 0.25 0.01 -0.92 -1.08 0.00 0.00 179.45 177.34 2k9a h TYR 76 N 0.00 0.04 -0.32 -1.35 3.20 0.20 -0.39 116.97 118.34 2k9a h TYR 76 Ca -0.00 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 61.81 2k9a h TYR 76 Cb 0.80 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 39.04 2k9a h TYR 76 CO 0.00 0.23 -0.01 0.82 -1.64 0.00 0.00 178.16 177.56 2k9a h ILE 77 N -0.16 1.26 0.11 1.81 2.04 -1.44 -2.23 117.51 118.90 2k9a h ILE 77 Ca 0.01 -0.98 -0.01 0.00 1.00 0.00 0.00 64.86 64.88 2k9a h ILE 77 Cb 0.21 1.26 0.00 0.00 -0.74 0.00 0.00 36.82 37.55 2k9a h ILE 77 CO -0.00 0.32 -0.05 -0.08 0.00 0.00 0.00 178.15 178.33 2k9a h GLU 78 N 0.37 -0.15 -0.30 2.37 4.81 -1.47 -2.21 114.58 118.01 2k9a h GLU 78 Ca 0.09 0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.33 2k9a h GLU 78 Cb 0.46 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.86 2k9a h GLU 78 CO 0.02 -0.08 0.18 0.93 -0.73 0.00 0.00 179.01 179.33 2k9a h GLU 79 N -0.17 0.40 -0.36 1.92 5.08 -1.09 -1.56 114.58 118.81 2k9a h GLU 79 Ca -0.02 -0.04 0.05 0.00 -1.00 0.00 0.00 59.36 58.36 2k9a h GLU 79 Cb 0.13 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 2k9a h GLU 79 CO 0.03 0.31 0.24 1.96 -1.00 0.00 0.00 179.01 180.55 2k9a h GLN 80 N 0.39 0.28 0.13 2.33 1.08 -1.32 -1.92 115.11 116.07 2k9a h GLN 80 Ca 0.11 -0.02 -0.29 0.00 -1.45 0.00 0.00 58.65 57.01 2k9a h GLN 80 Cb 0.00 -0.06 0.02 0.00 -0.05 0.00 0.00 27.48 27.39 2k9a h GLN 80 CO -0.02 0.18 -1.23 -0.07 -0.95 0.00 0.00 178.83 176.74 2k9a h LEU 81 N 0.29 0.68 -1.62 1.46 3.38 -0.94 -3.25 115.31 115.30 2k9a h LEU 81 Ca 0.15 -0.65 -0.03 0.00 0.09 0.00 0.00 57.88 57.44 2k9a h LEU 81 Cb 0.26 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 2k9a h LEU 81 CO -0.03 1.48 -0.13 -0.07 0.09 0.00 0.00 178.44 179.78 2k9a h LEU 82 N 0.19 0.00 -1.94 1.67 -0.00 -0.60 -2.30 115.31 112.32 2k9a h LEU 82 Ca -0.17 0.00 0.06 0.00 -0.00 0.00 0.00 57.88 57.78 2k9a h LEU 82 Cb 1.92 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 42.57 2k9a h LEU 82 CO 0.22 0.13 0.41 1.56 -0.00 0.00 0.00 178.44 180.76 2k9a h GLN 83 N 0.00 0.00 0.00 1.13 1.08 -1.41 -2.12 115.11 113.79 2k9a h GLN 83 Ca -0.00 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.18 2k9a h GLN 83 Cb 0.49 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.92 2k9a h GLN 83 CO 0.02 0.00 -1.09 -2.13 -0.95 0.00 0.00 178.83 174.67 2k9a n ARG 84 N -3.29 2.32 -3.87 1.46 0.63 -1.05 -4.92 116.66 107.95 2k9a n ARG 84 Ca 0.03 -0.01 -0.33 0.00 -0.92 0.00 0.00 57.85 56.62 2k9a n ARG 84 Cb 0.52 -1.04 -0.13 0.00 0.45 0.00 0.00 32.46 32.26 2k9a n ARG 84 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 2k9a s ILE 85 N -2.07 2.95 -1.19 5.15 1.01 -0.80 -4.94 121.20 121.32 2k9a s ILE 85 Ca -0.01 -2.67 0.23 0.00 0.00 0.00 0.00 60.65 58.20 2k9a s ILE 85 Cb 0.01 -3.03 0.29 0.00 0.01 0.00 0.00 42.46 39.73 2k9a s ILE 85 CO 0.06 -0.74 1.75 -0.81 0.00 0.00 0.00 174.94 175.20 2k9a n PRO 86 N 3.86 0.15 -0.23 2.79 -0.04 -1.23 -2.72 135.00 137.57 2k9a n PRO 86 Ca 0.04 0.09 0.07 0.00 -0.04 0.00 0.00 63.50 63.65 2k9a n PRO 86 Cb 0.38 -1.50 0.17 0.00 -0.04 0.00 0.00 33.50 32.51 2k9a n PRO 86 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2k9a n GLU 87 N -1.40 2.64 -1.96 0.54 1.02 -1.26 -5.04 120.64 115.17 2k9a n GLU 87 Ca 0.08 -2.36 -0.37 0.00 -0.02 0.00 0.00 57.16 54.48 2k9a n GLU 87 Cb 0.23 -1.49 0.03 0.00 -0.02 0.00 0.00 31.44 30.19 2k9a n GLU 87 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 2k9a s PHE 88 N -2.02 2.43 -0.37 -0.32 5.36 -1.10 -5.02 117.98 116.94 2k9a s PHE 88 Ca 0.29 1.47 0.00 0.00 -0.96 0.00 0.00 56.93 57.73 2k9a s PHE 88 Cb 0.21 -3.59 0.12 0.00 -0.34 0.00 0.00 43.02 39.42 2k9a s PHE 88 CO 0.09 -2.36 0.17 -0.80 -1.46 0.00 0.00 175.22 170.85 2k9a s ASN 89 N -1.30 3.77 0.57 6.13 0.02 -1.26 -4.97 114.94 117.90 2k9a s ASN 89 Ca 0.73 -2.09 0.31 0.00 -1.02 0.00 0.00 52.86 50.79 2k9a s ASN 89 Cb -0.34 -0.88 1.75 0.00 0.02 0.00 0.00 41.25 41.79 2k9a s ASN 89 CO 0.39 -0.35 2.19 -0.03 0.02 0.00 0.00 177.10 179.32 2k9a h MET 90 N 7.43 0.00 0.38 -0.60 4.05 -1.98 -0.62 114.93 123.59 2k9a h MET 90 Ca -0.06 0.00 -0.02 0.00 -0.28 0.00 0.00 59.70 59.34 2k9a h MET 90 Cb 0.98 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.78 2k9a h MET 90 CO 0.45 0.05 -0.18 0.00 0.23 0.00 0.00 176.91 177.46 2k9a h ALA 91 N 1.95 -0.51 0.00 0.39 0.00 -2.00 -2.12 119.26 116.98 2k9a h ALA 91 Ca -0.00 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 2k9a h ALA 91 Cb 0.16 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2k9a h ALA 91 CO 0.01 -0.52 -0.32 0.00 0.00 0.00 0.00 179.25 178.42 2k9a h ALA 92 N -0.83 1.19 0.20 0.00 0.00 -1.97 -2.64 119.26 115.21 2k9a h ALA 92 Ca -0.05 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 2k9a h ALA 92 Cb 0.50 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2k9a h ALA 92 CO 0.08 0.40 -0.10 0.35 0.00 0.00 0.00 179.25 179.99 2k9a h PHE 93 N 0.00 -0.25 -0.95 0.00 3.57 -1.17 -2.29 116.94 115.85 2k9a h PHE 93 Ca -0.00 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.50 2k9a h PHE 93 Cb 0.69 0.08 -0.05 0.00 2.79 0.00 0.00 35.95 39.47 2k9a h PHE 93 CO 0.00 0.13 0.62 1.79 -2.23 0.00 0.00 178.31 178.62 2k9a h THR 94 N -0.71 1.25 0.30 4.41 1.35 -1.37 0.87 112.91 119.01 2k9a h THR 94 Ca -0.03 -0.47 -0.01 0.00 -0.55 0.00 0.00 66.41 65.34 2k9a h THR 94 Cb 0.49 -0.14 0.00 0.00 -1.73 0.00 0.00 68.15 66.78 2k9a h THR 94 CO 0.04 0.24 -0.14 0.74 -0.25 0.00 0.00 175.52 176.15 2k9a h THR 95 N 1.29 0.72 0.00 6.82 2.02 -1.50 -2.03 112.91 120.24 2k9a h THR 95 Ca 0.35 -0.09 -0.06 0.00 0.77 0.00 0.00 66.41 67.38 2k9a h THR 95 Cb -0.13 0.77 -0.01 0.00 -1.74 0.00 0.00 68.15 67.04 2k9a h THR 95 CO -0.07 0.02 -0.27 0.74 0.37 0.00 0.00 175.52 176.31 2k9a h THR 96 N -0.45 1.09 -0.06 3.16 2.02 -1.21 -3.02 112.91 114.44 2k9a h THR 96 Ca -0.04 -0.95 -0.00 0.00 0.77 0.00 0.00 66.41 66.18 2k9a h THR 96 Cb 0.34 1.53 -0.00 0.00 -1.74 0.00 0.00 68.15 68.28 2k9a h THR 96 CO 0.07 0.26 0.02 0.25 0.37 0.00 0.00 175.52 176.49 2k9a h LEU 97 N 0.00 0.08 -1.89 2.58 6.46 -0.48 0.21 115.31 122.28 2k9a h LEU 97 Ca -0.00 -0.19 0.23 0.00 -0.12 0.00 0.00 57.88 57.80 2k9a h LEU 97 Cb 0.51 -0.02 -0.04 0.00 -0.73 0.00 0.00 40.66 40.37 2k9a h LEU 97 CO 0.03 0.25 0.59 1.56 -0.62 0.00 0.00 178.44 180.25 2k9a h GLN 98 N -0.09 0.09 0.16 1.25 4.20 -1.24 0.13 115.11 119.60 2k9a h GLN 98 Ca 0.02 -0.01 -0.34 0.00 0.06 0.00 0.00 58.65 58.38 2k9a h GLN 98 Cb 0.19 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 27.95 2k9a h GLN 98 CO -0.00 0.06 -1.75 1.25 -0.67 0.00 0.00 178.83 177.72 2k9a h HIS 99 N 0.09 0.60 0.00 2.96 2.76 -1.51 -3.29 115.15 116.76 2k9a h HIS 99 Ca 0.41 -0.44 0.00 0.00 -2.20 0.00 0.00 60.37 58.14 2k9a h HIS 99 Cb 1.48 -0.02 0.00 0.00 1.55 0.00 0.00 27.41 30.42 2k9a h HIS 99 CO -0.00 1.61 0.00 1.58 -1.30 0.00 0.00 177.93 179.82 2k9a n HIS 100 N -3.52 0.00 0.32 5.26 -0.00 0.71 -2.65 115.22 115.34 2k9a n HIS 100 Ca -0.24 0.00 0.20 0.00 -0.00 0.00 0.00 57.72 57.68 2k9a n HIS 100 Cb 1.06 -0.29 1.04 0.00 -0.00 0.00 0.00 29.99 31.80 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 -1.08 0.98 116.57 119.62 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 0.11 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.42 2k9a h LYS 101 CO 0.00 0.00 0.00 -3.47 -0.57 0.00 0.00 179.45 175.41 2k9a n ASP 102 N -3.11 0.00 0.10 0.86 2.03 -1.08 -4.00 116.55 111.35 2k9a n ASP 102 Ca -0.02 -0.15 0.00 0.00 0.52 0.00 0.00 54.79 55.14 2k9a n ASP 102 Cb 0.21 -0.16 0.00 0.00 -0.72 0.00 0.00 41.12 40.45 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 -1.16 0.00 -0.68 -0.67 4.07 0.26 -5.10 120.64 117.36 2k9a n GLU 103 Ca 0.08 0.00 -0.31 0.00 -0.06 0.00 0.00 57.16 56.88 2k9a n GLU 103 Cb 0.08 -0.22 0.17 0.00 -0.06 0.00 0.00 31.44 31.42 2k9a n GLU 103 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 2k9a s VAL 104 N -2.00 2.06 -0.35 6.31 0.11 -0.72 -4.84 120.40 120.97 2k9a s VAL 104 Ca 0.00 0.02 -0.28 0.00 -2.93 0.00 0.00 61.98 58.79 2k9a s VAL 104 Cb 0.00 -2.05 -0.04 0.00 -1.53 0.00 0.00 36.38 32.76 2k9a s VAL 104 CO 0.00 -0.03 2.07 0.00 -3.33 0.00 0.00 175.10 173.81 2k9a s ALA 105 N -2.63 2.52 0.45 1.54 0.00 -1.26 -4.76 121.76 117.62 2k9a s ALA 105 Ca 0.67 0.31 0.13 0.00 0.00 0.00 0.00 51.96 53.07 2k9a s ALA 105 Cb -0.23 -4.13 1.03 0.00 0.00 0.00 0.00 23.12 19.79 2k9a s ALA 105 CO 0.59 -3.16 2.03 0.78 0.00 0.00 0.00 175.76 176.00 2k9a h GLY 106 N 15.56 0.09 1.75 0.00 0.00 -1.88 -1.97 103.07 116.62 2k9a h GLY 106 Ca -0.34 -0.05 -0.07 0.00 0.00 0.00 0.00 47.33 46.88 2k9a h GLY 106 CO 1.05 0.04 -0.20 1.29 0.00 0.00 0.00 176.54 178.73 2k9a h ASP 107 N 0.09 0.29 -0.00 0.19 3.04 -1.97 0.17 116.42 118.23 2k9a h ASP 107 Ca 0.02 -0.08 -0.00 0.00 -3.24 0.00 0.00 57.03 53.73 2k9a h ASP 107 Cb 0.21 -0.08 0.00 0.00 -1.04 0.00 0.00 39.33 38.42 2k9a h ASP 107 CO 0.01 0.51 -0.01 0.40 -2.04 0.00 0.00 179.24 178.11 2k9a h ILE 108 N 0.28 1.53 0.00 4.15 2.04 -1.76 -3.23 117.51 120.53 2k9a h ILE 108 Ca 0.05 -1.58 -0.06 0.00 1.00 0.00 0.00 64.86 64.27 2k9a h ILE 108 Cb 0.51 2.60 -0.01 0.00 -0.74 0.00 0.00 36.82 39.19 2k9a h ILE 108 CO 0.03 0.41 -0.28 0.15 0.00 0.00 0.00 178.15 178.47 2k9a h PHE 109 N -0.66 0.00 -0.94 1.37 3.57 -1.45 -2.69 116.94 116.14 2k9a h PHE 109 Ca -0.00 0.00 0.27 0.00 3.53 0.00 0.00 57.97 61.77 2k9a h PHE 109 Cb 0.68 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 0.78 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 3.58 -0.97 0.47 116.42 119.99 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 0.53 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.58 2k9a h ASP 110 CO 0.04 0.00 -0.04 -0.03 -2.88 0.00 0.00 179.24 176.33 2k9a h MET 111 N 0.00 -0.10 0.00 0.28 4.05 -1.61 -3.19 114.93 114.35 2k9a h MET 111 Ca 0.44 0.01 -0.02 0.00 -0.28 0.00 0.00 59.70 59.85 2k9a h MET 111 Cb 2.00 0.02 -0.00 0.00 -0.80 0.00 0.00 31.60 32.82 2k9a h MET 111 CO -0.00 0.43 -0.10 -0.07 0.23 0.00 0.00 176.91 177.40 2k9a h LEU 112 N -0.73 0.00 -1.88 3.39 3.38 -0.73 -2.80 115.31 115.94 2k9a h LEU 112 Ca -0.01 0.00 0.20 0.00 0.09 0.00 0.00 57.88 58.15 2k9a h LEU 112 Cb 0.58 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.30 2k9a h LEU 112 CO 0.02 0.10 0.62 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 -0.23 0.64 115.31 123.24 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 0.39 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.42 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 -3.84 0.00 0.29 1.05 -2.24 -1.06 -2.35 114.28 106.13 2k9a n THR 114 Ca 0.14 0.00 0.16 0.00 -2.27 0.00 0.00 64.05 62.08 2k9a n THR 114 Cb 0.87 -0.95 0.77 0.00 -2.10 0.00 0.00 70.33 68.92 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 -1.14 -3.36 116.94 117.26 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 -2.67 0.00 -2.25 -1.55 5.66 -0.99 -5.03 114.28 107.45 2k9a n THR 116 Ca -0.01 0.00 -0.33 0.00 -3.05 0.00 0.00 64.05 60.67 2k9a n THR 116 Cb 0.15 0.00 -0.04 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 -0.68 5.68 0.54 1.09 2.15 -0.99 -4.78 116.67 119.69 2k9a s ASP 117 Ca 0.00 -1.23 0.21 0.00 0.43 0.00 0.00 52.55 51.96 2k9a s ASP 117 Cb 0.00 -2.57 1.45 0.00 -0.30 0.00 0.00 42.92 41.50 2k9a s ASP 117 CO 0.00 -2.29 2.17 0.15 -0.17 0.00 0.00 175.17 175.04 2k9a h PHE 118 N 10.25 0.00 -0.63 -5.34 3.57 -1.90 -1.66 116.94 121.24 2k9a h PHE 118 Ca 0.18 0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.61 2k9a h PHE 118 Cb 0.98 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.70 2k9a h PHE 118 CO 1.26 0.00 0.13 -0.07 -2.23 0.00 0.00 178.31 177.39 2k9a h LEU 119 N 0.00 0.95 -0.37 0.59 -0.00 -1.99 -2.44 115.31 112.06 2k9a h LEU 119 Ca 0.01 -0.20 -0.18 0.00 -0.00 0.00 0.00 57.88 57.51 2k9a h LEU 119 Cb 0.05 -0.25 -0.02 0.00 -0.00 0.00 0.00 40.66 40.44 2k9a h LEU 119 CO -0.00 0.94 -0.82 0.00 -0.00 0.00 0.00 178.44 178.56 2k9a h ALA 120 N 1.18 0.63 0.43 1.53 0.00 -1.72 -2.43 119.26 118.89 2k9a h ALA 120 Ca 0.20 -0.73 -0.02 0.00 0.00 0.00 0.00 54.91 54.36 2k9a h ALA 120 Cb 0.38 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2k9a h ALA 120 CO 0.01 0.98 -0.21 0.35 0.00 0.00 0.00 179.25 180.38 2k9a h PHE 121 N 0.03 -0.54 0.01 0.00 3.57 -1.11 0.11 116.94 119.02 2k9a h PHE 121 Ca -0.02 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.47 2k9a h PHE 121 Cb 1.44 0.18 0.00 0.00 2.79 0.00 0.00 35.95 40.36 2k9a h PHE 121 CO 0.01 -0.29 -0.01 -0.22 -2.23 0.00 0.00 178.31 175.58 2k9a h LYS 122 N -0.67 -0.02 -0.23 1.11 3.64 -1.53 -2.67 116.57 116.20 2k9a h LYS 122 Ca -0.06 0.00 0.07 0.00 -1.27 0.00 0.00 60.65 59.39 2k9a h LYS 122 Cb 0.49 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.30 2k9a h LYS 122 CO 0.10 0.23 0.18 1.49 -2.27 0.00 0.00 179.45 179.18 2k9a h GLU 123 N -0.27 0.00 -0.12 1.90 4.81 -1.44 -1.74 114.58 117.72 2k9a h GLU 123 Ca -0.00 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 2k9a h GLU 123 Cb 0.26 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.64 2k9a h GLU 123 CO 0.00 0.00 -0.04 1.98 -0.73 0.00 0.00 179.01 180.23 2k9a h MET 124 N 0.00 0.24 -0.40 1.92 4.05 -0.44 -1.85 114.93 118.45 2k9a h MET 124 Ca 0.11 -0.10 -0.03 0.00 -0.28 0.00 0.00 59.70 59.40 2k9a h MET 124 Cb 0.47 -0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 31.24 2k9a h MET 124 CO -0.00 0.55 0.13 0.74 0.23 0.00 0.00 176.91 178.56 2k9a h PHE 125 N -0.08 0.64 -0.84 1.39 0.04 -1.10 -1.97 116.94 115.02 2k9a h PHE 125 Ca 0.03 -0.06 0.01 0.00 2.80 0.00 0.00 57.97 60.75 2k9a h PHE 125 Cb 0.46 -0.19 -0.04 0.00 2.20 0.00 0.00 35.95 38.38 2k9a h PHE 125 CO 0.05 0.59 0.55 -0.07 -0.60 0.00 0.00 178.31 178.83 2k9a h LEU 126 N 0.50 0.97 -0.68 1.54 4.07 -1.38 -1.91 115.31 118.43 2k9a h LEU 126 Ca 0.13 -0.03 -0.07 0.00 0.08 0.00 0.00 57.88 57.99 2k9a h LEU 126 Cb 0.24 -0.24 -0.03 0.00 1.08 0.00 0.00 40.66 41.71 2k9a h LEU 126 CO -0.01 0.71 0.14 -0.78 -1.08 0.00 0.00 178.44 177.42 2k9a h ASP 127 N 1.14 1.05 -0.92 -0.43 1.82 -1.05 -2.58 116.42 115.45 2k9a h ASP 127 Ca 0.31 -0.25 -0.01 0.00 -0.39 0.00 0.00 57.03 56.69 2k9a h ASP 127 Cb -0.12 -0.28 -0.04 0.00 0.68 0.00 0.00 39.33 39.56 2k9a h ASP 127 CO -0.07 1.03 0.55 0.22 -1.61 0.00 0.00 179.24 179.36 2k9a h TYR 128 N 1.03 1.22 -0.59 0.28 3.20 -0.63 -2.28 116.97 119.19 2k9a h TYR 128 Ca 0.21 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.07 2k9a h TYR 128 Cb 0.41 -0.40 -0.03 0.00 1.54 0.00 0.00 36.73 38.25 2k9a h TYR 128 CO 0.03 0.81 0.36 -0.09 -1.64 0.00 0.00 178.16 177.63 2k9a h ARG 129 N 1.27 0.80 -0.24 1.82 1.12 -1.07 -1.70 114.38 116.37 2k9a h ARG 129 Ca 0.33 -0.07 -0.02 0.00 -1.11 0.00 0.00 59.98 59.11 2k9a h ARG 129 Cb -0.04 -0.17 -0.01 0.00 -0.01 0.00 0.00 29.97 29.74 2k9a h ARG 129 CO -0.06 0.57 0.06 0.00 -3.11 0.00 0.00 179.97 177.43 2k9a h ALA 130 N 1.18 1.65 0.00 2.80 0.00 -1.07 -1.38 119.26 122.45 2k9a h ALA 130 Ca 0.21 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 2k9a h ALA 130 Cb -0.02 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2k9a h ALA 130 CO -0.04 0.27 -0.26 1.49 0.00 0.00 0.00 179.25 180.70 2k9a h GLU 131 N 0.34 0.00 0.00 0.00 4.81 -0.83 -2.94 114.58 115.96 2k9a h GLU 131 Ca 0.08 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.31 2k9a h GLU 131 Cb 0.14 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.52 2k9a h GLU 131 CO -0.00 0.26 0.00 1.63 -0.73 0.00 0.00 179.01 180.17 2k9a n LYS 132 N -3.27 0.77 0.02 1.92 4.76 -0.52 -2.51 118.16 119.32 2k9a n LYS 132 Ca 0.01 0.00 0.12 0.00 -2.87 0.00 0.00 58.31 55.58 2k9a n LYS 132 Cb 0.54 -1.46 0.28 0.00 -1.84 0.00 0.00 35.03 32.55 2k9a n LYS 132 CO 0.00 0.00 0.00 -0.85 -1.37 0.00 0.00 177.40 175.18 2k9a n GLU 133 N -0.96 0.08 0.00 1.97 0.28 -1.11 -4.99 120.64 115.91 2k9a n GLU 133 Ca 0.17 0.03 0.00 0.00 -0.16 0.00 0.00 57.16 57.19 2k9a n GLU 133 Cb 0.08 -1.55 0.00 0.00 1.43 0.00 0.00 31.44 31.39 2k9a n GLU 133 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2k9a n GLY 134 N 1.45 2.50 3.59 -1.84 0.00 -1.04 -5.03 105.19 104.82 2k9a n GLY 134 Ca 0.05 -0.77 -0.13 0.00 0.00 0.00 0.00 46.02 45.18 2k9a n GLY 134 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2k9a s ARG 135 N 0.00 0.72 0.00 1.61 1.70 -1.26 -5.03 118.95 116.69 2k9a s ARG 135 Ca 0.00 0.41 0.11 0.00 -0.47 0.00 0.00 55.73 55.78 2k9a s ARG 135 Cb 0.00 0.35 0.09 0.00 -0.57 0.00 0.00 34.95 34.82 2k9a s ARG 135 CO 0.00 -0.18 0.86 0.41 -1.08 0.00 0.00 175.30 175.31