#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 0.20 0.03 7.83 8.00 -1.26 -4.89 116.55 126.46 2k9a n ASP 2 Ca 0.00 -0.64 -0.02 0.00 0.71 0.00 0.00 54.79 54.84 2k9a n ASP 2 Cb 0.00 0.15 -0.01 0.00 -0.02 0.00 0.00 41.12 41.25 2k9a n ASP 2 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2k9a h ALA 3 N 0.00 -0.24 -3.29 2.24 0.00 -2.09 -3.45 119.26 112.43 2k9a h ALA 3 Ca 0.00 -0.02 -0.62 0.00 0.00 0.00 0.00 54.91 54.26 2k9a h ALA 3 Cb 0.18 0.04 -0.18 0.00 0.00 0.00 0.00 17.79 17.84 2k9a h ALA 3 CO 0.00 -0.24 -0.60 -1.17 0.00 0.00 0.00 179.25 177.25 2k9a s LEU 4 N -5.87 3.63 0.10 0.00 2.96 -1.26 -5.11 118.68 113.13 2k9a s LEU 4 Ca -0.02 0.02 0.04 0.00 -0.22 0.00 0.00 54.13 53.95 2k9a s LEU 4 Cb 0.00 -1.90 -0.04 0.00 0.50 0.00 0.00 46.19 44.75 2k9a s LEU 4 CO 0.05 0.18 0.08 -1.61 -1.32 0.00 0.00 176.35 173.73 2k9a s GLU 5 N 0.31 2.85 0.00 1.98 2.02 -1.26 -4.83 118.70 119.77 2k9a s GLU 5 Ca 0.01 -0.74 0.00 0.00 0.02 0.00 0.00 54.97 54.26 2k9a s GLU 5 Cb -0.13 -2.69 0.00 0.00 0.10 0.00 0.00 34.13 31.41 2k9a s GLU 5 CO 0.01 0.55 0.00 0.41 0.02 0.00 0.00 175.26 176.25 2k9a n GLY 6 N 0.31 2.12 3.89 -1.39 0.00 -1.26 -5.05 105.19 103.82 2k9a n GLY 6 Ca -0.09 -0.76 -0.32 0.00 0.00 0.00 0.00 46.02 44.85 2k9a n GLY 6 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2k9a s GLU 7 N 0.00 3.61 0.00 1.61 2.02 -1.26 -4.97 118.70 119.71 2k9a s GLU 7 Ca 0.00 -0.09 0.00 0.00 0.02 0.00 0.00 54.97 54.90 2k9a s GLU 7 Cb 0.00 -2.93 0.00 0.00 0.10 0.00 0.00 34.13 31.30 2k9a s GLU 7 CO 0.00 0.53 0.00 -1.13 0.02 0.00 0.00 175.26 174.68 2k9a n SER 8 N 0.41 0.00 0.14 -0.19 3.41 -1.26 -4.85 113.62 111.29 2k9a n SER 8 Ca -0.05 -0.64 0.00 0.00 -0.26 0.00 0.00 58.87 57.92 2k9a n SER 8 Cb 0.52 0.00 0.27 0.00 -0.26 0.00 0.00 64.21 64.74 2k9a n SER 8 CO 0.00 0.00 0.00 -0.26 -0.16 0.00 0.00 175.04 174.62 2k9a h PHE 9 N 0.00 0.12 -2.66 7.33 -1.00 -2.04 -3.49 116.94 115.20 2k9a h PHE 9 Ca 0.00 -0.03 0.24 0.00 2.81 0.00 0.00 57.97 60.99 2k9a h PHE 9 Cb 0.32 -0.03 -0.06 0.00 3.61 0.00 0.00 35.95 39.79 2k9a h PHE 9 CO 0.00 0.51 -0.32 0.00 -1.61 0.00 0.00 178.31 176.89 2k9a n ALA 10 N -2.46 -2.27 -2.25 2.45 0.00 -1.26 -4.78 120.51 109.94 2k9a n ALA 10 Ca -0.02 0.28 -0.39 0.00 0.00 0.00 0.00 53.44 53.31 2k9a n ALA 10 Cb 0.46 -0.78 -0.06 0.00 0.00 0.00 0.00 19.45 19.07 2k9a n ALA 10 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2k9a s LEU 11 N 0.00 4.52 -0.00 0.00 1.43 -1.26 -4.96 118.68 118.41 2k9a s LEU 11 Ca 0.00 1.29 0.00 0.00 -1.03 0.00 0.00 54.13 54.40 2k9a s LEU 11 Cb 0.00 -2.96 -0.00 0.00 0.03 0.00 0.00 46.19 43.26 2k9a s LEU 11 CO 0.00 0.26 0.00 -1.54 0.23 0.00 0.00 176.35 175.30 2k9a n SER 12 N 1.65 4.93 -4.90 2.29 3.41 -1.26 -5.05 113.62 114.69 2k9a n SER 12 Ca -0.10 0.00 -0.28 0.00 -0.26 0.00 0.00 58.87 58.24 2k9a n SER 12 Cb 0.51 0.61 0.02 0.00 -0.26 0.00 0.00 64.21 65.09 2k9a n SER 12 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 2k9a s PHE 13 N -2.01 3.40 0.00 7.33 -0.71 -1.26 -4.99 117.98 119.74 2k9a s PHE 13 Ca -0.00 0.82 0.00 0.00 -1.04 0.00 0.00 56.93 56.71 2k9a s PHE 13 Cb 0.00 -2.65 0.00 0.00 -1.21 0.00 0.00 43.02 39.16 2k9a s PHE 13 CO 0.01 -0.70 0.00 0.43 -1.34 0.00 0.00 175.22 173.63 2k9a n SER 14 N -2.56 0.00 0.00 1.98 7.64 -1.26 -4.99 113.62 114.42 2k9a n SER 14 Ca 0.04 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.92 2k9a n SER 14 Cb 0.56 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.76 2k9a n SER 14 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2k9a n SER 15 N -1.16 0.00 0.35 6.43 3.41 -1.26 -4.78 113.62 116.61 2k9a n SER 15 Ca 0.00 0.00 -0.18 0.00 -0.26 0.00 0.00 58.87 58.43 2k9a n SER 15 Cb 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 63.86 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 -1.00 -0.04 7.33 0.00 -1.96 -1.70 119.26 121.89 2k9a h ALA 16 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2k9a h ALA 16 Cb 0.00 0.50 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2k9a h ALA 16 CO 0.00 -1.08 0.00 0.45 0.00 0.00 0.00 179.25 178.62 2k9a n SER 17 N -5.53 0.44 -5.00 0.00 2.88 -1.26 -4.50 113.62 100.65 2k9a n SER 17 Ca -0.13 -1.50 -0.18 0.00 -1.33 0.00 0.00 58.87 55.73 2k9a n SER 17 Cb 0.42 -0.03 0.00 0.00 -0.75 0.00 0.00 64.21 63.86 2k9a n SER 17 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2k9a s ASP 18 N -1.57 5.71 0.62 -3.46 2.15 -0.81 -4.99 116.67 114.32 2k9a s ASP 18 Ca 0.29 -0.37 0.35 0.00 0.43 0.00 0.00 52.55 53.25 2k9a s ASP 18 Cb 0.14 -0.81 2.05 0.00 -0.30 0.00 0.00 42.92 44.00 2k9a s ASP 18 CO 0.22 -0.66 2.29 0.00 -0.17 0.00 0.00 175.17 176.85 2k9a h ALA 19 N 0.73 1.34 -0.42 3.66 0.00 -1.89 -2.60 119.26 120.09 2k9a h ALA 19 Ca -0.42 -0.00 0.05 0.00 0.00 0.00 0.00 54.91 54.55 2k9a h ALA 19 Cb 1.27 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 19.02 2k9a h ALA 19 CO 0.48 -0.02 0.15 1.49 0.00 0.00 0.00 179.25 181.34 2k9a h GLU 20 N 0.00 0.30 0.08 0.00 4.57 -1.92 -1.26 114.58 116.35 2k9a h GLU 20 Ca 0.00 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 2k9a h GLU 20 Cb 0.04 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.55 2k9a h GLU 20 CO -0.00 0.20 -0.08 0.35 -1.18 0.00 0.00 179.01 178.30 2k9a h PHE 21 N 0.31 -0.21 -0.94 0.92 3.04 -0.92 -2.30 116.94 116.84 2k9a h PHE 21 Ca 0.20 0.00 0.13 0.00 3.98 0.00 0.00 57.97 62.28 2k9a h PHE 21 Cb 0.19 0.08 -0.08 0.00 2.56 0.00 0.00 35.95 38.71 2k9a h PHE 21 CO -0.15 -0.13 0.60 -0.44 -2.02 0.00 0.00 178.31 176.16 2k9a h ASP 22 N -0.18 0.78 -0.41 0.41 5.19 -1.57 -1.17 116.42 119.46 2k9a h ASP 22 Ca 0.01 0.05 0.02 0.00 -0.62 0.00 0.00 57.03 56.48 2k9a h ASP 22 Cb 0.18 -0.11 -0.03 0.00 0.18 0.00 0.00 39.33 39.55 2k9a h ASP 22 CO -0.03 0.40 0.23 0.00 -3.12 0.00 0.00 179.24 176.72 2k9a h ALA 23 N 1.58 0.52 -0.76 3.45 0.00 -0.69 -2.12 119.26 121.23 2k9a h ALA 23 Ca 0.47 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.38 2k9a h ALA 23 Cb 0.62 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 2k9a h ALA 23 CO -0.24 -0.10 0.47 0.28 0.00 0.00 0.00 179.25 179.66 2k9a h VAL 24 N 0.47 1.21 -0.77 0.00 2.07 -0.86 -2.28 116.25 116.08 2k9a h VAL 24 Ca 0.17 -0.44 0.03 0.00 0.82 0.00 0.00 66.70 67.27 2k9a h VAL 24 Cb 0.03 0.13 -0.05 0.00 -1.52 0.00 0.00 31.29 29.88 2k9a h VAL 24 CO -0.09 0.21 0.50 0.58 0.02 0.00 0.00 177.57 178.79 2k9a h VAL 25 N 1.04 1.13 -0.54 2.57 2.07 -0.86 -0.98 116.25 120.69 2k9a h VAL 25 Ca 0.27 -0.34 -0.03 0.00 0.82 0.00 0.00 66.70 67.43 2k9a h VAL 25 Cb -0.06 0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 29.75 2k9a h VAL 25 CO -0.05 0.18 0.21 1.23 0.02 0.00 0.00 177.57 179.16 2k9a h GLY 26 N 0.98 0.87 1.51 2.17 0.00 -1.01 -2.49 103.07 105.09 2k9a h GLY 26 Ca 0.30 -0.48 -0.05 0.00 0.00 0.00 0.00 47.33 47.10 2k9a h GLY 26 CO -0.10 0.45 0.01 -0.97 0.00 0.00 0.00 176.54 175.93 2k9a h TYR 27 N 0.73 0.63 -0.17 5.60 0.05 -1.13 -2.61 116.97 120.08 2k9a h TYR 27 Ca 0.18 -0.07 -0.00 0.00 0.05 0.00 0.00 58.73 58.89 2k9a h TYR 27 Cb 0.21 -0.18 -0.01 0.00 1.01 0.00 0.00 36.73 37.76 2k9a h TYR 27 CO 0.01 0.60 0.09 -0.07 -1.05 0.00 0.00 178.16 177.73 2k9a h LEU 28 N 0.58 0.21 -1.38 3.88 3.38 -0.84 -1.85 115.31 119.29 2k9a h LEU 28 Ca 0.12 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2k9a h LEU 28 Cb 0.35 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 2k9a h LEU 28 CO 0.01 0.25 0.40 -0.33 0.09 0.00 0.00 178.44 178.86 2k9a h GLU 29 N 0.16 0.82 -0.46 1.13 5.08 -1.26 -1.64 114.58 118.40 2k9a h GLU 29 Ca 0.06 -0.05 -0.09 0.00 -1.00 0.00 0.00 59.36 58.28 2k9a h GLU 29 Cb 0.09 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 2k9a h GLU 29 CO -0.01 0.55 -0.08 0.22 -1.00 0.00 0.00 179.01 178.69 2k9a h ASP 30 N 0.84 0.80 -0.35 1.42 3.58 -1.09 -2.29 116.42 119.33 2k9a h ASP 30 Ca 0.23 -0.23 -0.10 0.00 0.42 0.00 0.00 57.03 57.35 2k9a h ASP 30 Cb -0.09 -0.21 -0.01 0.00 1.72 0.00 0.00 39.33 40.74 2k9a h ASP 30 CO -0.05 0.91 -0.17 0.40 -2.88 0.00 0.00 179.24 177.46 2k9a h ILE 31 N 0.74 1.29 -0.05 2.25 2.04 -0.51 -0.77 117.51 122.50 2k9a h ILE 31 Ca 0.13 -1.28 -0.05 0.00 1.00 0.00 0.00 64.86 64.66 2k9a h ILE 31 Cb 0.56 1.37 -0.01 0.00 -0.74 0.00 0.00 36.82 38.01 2k9a h ILE 31 CO 0.03 0.42 -0.21 0.40 0.00 0.00 0.00 178.15 178.80 2k9a h ILE 32 N 0.51 1.18 -0.46 -0.67 2.04 -1.22 -1.76 117.51 117.13 2k9a h ILE 32 Ca 0.08 -0.83 0.00 0.00 1.00 0.00 0.00 64.86 65.11 2k9a h ILE 32 Cb 0.70 1.37 0.00 0.00 -0.74 0.00 0.00 36.82 38.16 2k9a h ILE 32 CO 0.05 0.24 0.00 0.23 0.00 0.00 0.00 178.15 178.67 2k9a n MET 33 N -4.26 2.39 -2.49 2.37 2.81 -0.87 -4.70 117.12 112.37 2k9a n MET 33 Ca -0.02 -2.13 -0.41 0.00 -1.81 0.00 0.00 57.70 53.34 2k9a n MET 33 Cb 0.29 -1.49 -0.04 0.00 -0.71 0.00 0.00 33.22 31.27 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 -1.30 7.23 0.19 7.83 -1.08 -0.31 -4.95 116.67 124.29 2k9a s ASP 34 Ca 0.39 2.10 -0.12 0.00 -0.52 0.00 0.00 52.55 54.41 2k9a s ASP 34 Cb 0.22 -2.60 0.20 0.00 -1.46 0.00 0.00 42.92 39.28 2k9a s ASP 34 CO 0.30 -0.25 1.75 -0.78 0.52 0.00 0.00 175.17 176.70 2k9a h ASP 35 N 5.21 0.19 -0.44 -0.34 3.58 -1.89 -0.92 116.42 121.81 2k9a h ASP 35 Ca -0.44 0.07 0.02 0.00 0.42 0.00 0.00 57.03 57.10 2k9a h ASP 35 Cb 1.21 0.05 -0.02 0.00 1.72 0.00 0.00 39.33 42.29 2k9a h ASP 35 CO 0.73 0.13 0.29 -0.33 -2.88 0.00 0.00 179.24 177.18 2k9a h GLU 36 N 0.37 0.49 0.01 0.28 4.39 -1.93 -1.91 114.58 116.29 2k9a h GLU 36 Ca 0.26 -0.03 -0.21 0.00 0.34 0.00 0.00 59.36 59.72 2k9a h GLU 36 Cb 0.29 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 28.82 2k9a h GLU 36 CO -0.26 0.33 -0.91 0.35 -1.16 0.00 0.00 179.01 177.35 2k9a h PHE 37 N 0.51 0.37 -0.11 4.33 3.57 -1.47 -2.29 116.94 121.84 2k9a h PHE 37 Ca 0.17 -0.21 -0.02 0.00 3.53 0.00 0.00 57.97 61.44 2k9a h PHE 37 Cb 0.06 -0.04 -0.00 0.00 2.79 0.00 0.00 35.95 38.76 2k9a h PHE 37 CO -0.00 1.03 -0.02 1.96 -2.23 0.00 0.00 178.31 179.05 2k9a h GLN 38 N 0.13 0.21 -0.17 1.11 4.20 -0.47 -0.91 115.11 119.21 2k9a h GLN 38 Ca -0.06 -0.08 -0.06 0.00 0.06 0.00 0.00 58.65 58.52 2k9a h GLN 38 Cb 1.55 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 29.31 2k9a h GLN 38 CO 0.14 0.50 -0.12 1.25 -0.67 0.00 0.00 178.83 179.93 2k9a h LEU 39 N -0.10 0.40 -0.37 1.46 5.85 -1.49 -2.64 115.31 118.43 2k9a h LEU 39 Ca 0.03 -0.44 -0.00 0.00 0.84 0.00 0.00 57.88 58.31 2k9a h LEU 39 Cb 0.42 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 2k9a h LEU 39 CO 0.01 0.76 0.23 0.25 -0.34 0.00 0.00 178.44 179.34 2k9a h LEU 40 N 0.05 0.44 0.25 2.25 6.46 -1.46 0.02 115.31 123.33 2k9a h LEU 40 Ca 0.03 -0.05 -0.00 0.00 -0.12 0.00 0.00 57.88 57.74 2k9a h LEU 40 Cb 0.62 -0.11 -0.01 0.00 -0.73 0.00 0.00 40.66 40.43 2k9a h LEU 40 CO 0.03 0.36 -0.18 -0.61 -0.62 0.00 0.00 178.44 177.42 2k9a h GLN 41 N 0.49 -0.42 -0.19 1.25 4.15 -1.19 -2.54 115.11 116.66 2k9a h GLN 41 Ca 0.13 0.03 -0.05 0.00 0.77 0.00 0.00 58.65 59.54 2k9a h GLN 41 Cb -0.00 0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.77 2k9a h GLN 41 CO -0.03 -0.28 -0.09 -0.09 -1.93 0.00 0.00 178.83 176.42 2k9a h ARG 42 N -0.44 0.29 -0.28 1.69 2.43 -1.40 -1.11 114.38 115.58 2k9a h ARG 42 Ca -0.02 -0.06 0.02 0.00 -0.81 0.00 0.00 59.98 59.11 2k9a h ARG 42 Cb 0.38 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.87 2k9a h ARG 42 CO -0.00 0.40 0.14 -0.97 -1.51 0.00 0.00 179.97 178.02 2k9a h ASN 43 N 0.28 0.21 0.14 -3.80 -0.73 -0.59 -1.60 115.58 109.50 2k9a h ASN 43 Ca 0.06 0.01 -0.28 0.00 1.87 0.00 0.00 56.30 57.96 2k9a h ASN 43 Cb 0.34 -0.03 0.03 0.00 0.27 0.00 0.00 38.32 38.92 2k9a h ASN 43 CO 0.02 0.16 -1.19 -0.26 -0.37 0.00 0.00 177.43 175.79 2k9a h PHE 44 N 0.30 0.94 -0.13 0.67 0.04 -1.30 -3.23 116.94 114.22 2k9a h PHE 44 Ca 0.11 -0.61 0.04 0.00 2.80 0.00 0.00 57.97 60.31 2k9a h PHE 44 Cb 0.03 -0.07 -0.01 0.00 2.20 0.00 0.00 35.95 38.10 2k9a h PHE 44 CO -0.09 1.45 0.16 0.52 -0.60 0.00 0.00 178.31 179.75 2k9a h MET 45 N 0.15 0.00 -0.08 1.51 2.86 -1.12 -0.15 114.93 118.10 2k9a h MET 45 Ca -0.19 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.42 2k9a h MET 45 Cb 1.89 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.54 2k9a h MET 45 CO 0.23 0.00 -0.10 0.22 1.06 0.00 0.00 176.91 178.32 2k9a h ASP 46 N 0.00 0.11 0.03 1.22 3.58 -1.31 -1.53 116.42 118.52 2k9a h ASP 46 Ca 0.06 -0.02 -0.38 0.00 0.42 0.00 0.00 57.03 57.11 2k9a h ASP 46 Cb 0.38 -0.03 -0.05 0.00 1.72 0.00 0.00 39.33 41.35 2k9a h ASP 46 CO -0.00 0.23 -2.20 1.17 -2.88 0.00 0.00 179.24 175.56 2k9a n LYS 47 N -4.36 0.65 -0.01 0.28 3.00 -0.18 -4.31 118.16 113.23 2k9a n LYS 47 Ca -0.02 0.27 -0.09 0.00 -0.00 0.00 0.00 58.31 58.47 2k9a n LYS 47 Cb 0.21 -1.59 -0.03 0.00 0.00 0.00 0.00 35.03 33.62 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 -0.37 -0.31 0.00 5.64 -1.99 -1.23 -0.78 116.97 117.93 2k9a h TYR 48 Ca -0.54 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.21 2k9a h TYR 48 Cb 1.78 0.16 0.00 0.00 2.00 0.00 0.00 36.73 40.67 2k9a h TYR 48 CO 0.02 -0.19 0.13 0.10 -0.00 0.00 0.00 178.16 178.23 2k9a h TYR 49 N -0.15 0.00 0.11 4.88 -0.00 -1.51 -1.04 116.97 119.26 2k9a h TYR 49 Ca 0.09 0.00 -0.16 0.00 -0.00 0.00 0.00 58.73 58.66 2k9a h TYR 49 Cb 0.28 0.00 0.01 0.00 -0.00 0.00 0.00 36.73 37.02 2k9a h TYR 49 CO -0.25 0.00 -0.73 -0.07 -0.00 0.00 0.00 178.16 177.11 2k9a h LEU 50 N 0.00 0.35 -1.11 0.10 3.38 -1.34 -3.33 115.31 113.36 2k9a h LEU 50 Ca 0.00 -0.94 -0.08 0.00 0.09 0.00 0.00 57.88 56.95 2k9a h LEU 50 Cb 0.27 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2k9a h LEU 50 CO 0.00 1.34 -0.25 -0.33 0.09 0.00 0.00 178.44 179.29 2k9a h GLU 51 N -0.51 0.32 -5.25 1.13 4.39 -0.83 -3.35 114.58 110.47 2k9a h GLU 51 Ca -0.14 -0.11 -0.71 0.00 0.34 0.00 0.00 59.36 58.74 2k9a h GLU 51 Cb 1.51 -0.02 -0.13 0.00 -0.10 0.00 0.00 28.75 30.00 2k9a h GLU 51 CO 0.10 0.55 1.70 -0.06 -1.16 0.00 0.00 179.01 180.14 2k9a s PHE 52 N -4.48 3.17 0.71 4.33 0.40 -0.57 -4.98 117.98 116.55 2k9a s PHE 52 Ca -0.06 -1.87 -0.08 0.00 -0.60 0.00 0.00 56.93 54.32 2k9a s PHE 52 Cb 0.14 -4.51 0.05 0.00 0.51 0.00 0.00 43.02 39.21 2k9a s PHE 52 CO 0.76 -1.58 1.04 -1.21 0.70 0.00 0.00 175.22 174.93 2k9a s GLU 53 N 2.79 2.35 0.00 0.44 2.02 -1.26 -4.74 118.70 120.30 2k9a s GLU 53 Ca 0.47 -0.05 0.00 0.00 0.02 0.00 0.00 54.97 55.41 2k9a s GLU 53 Cb 0.00 -2.12 0.00 0.00 0.10 0.00 0.00 34.13 32.11 2k9a s GLU 53 CO 0.03 -1.19 0.60 -0.40 0.02 0.00 0.00 175.26 174.31 2k9a n ASP 54 N -2.95 1.62 -4.75 -0.19 5.75 -1.26 -4.86 116.55 109.90 2k9a n ASP 54 Ca 0.07 -1.55 -0.30 0.00 -0.01 0.00 0.00 54.79 53.00 2k9a n ASP 54 Cb 0.60 -0.39 0.11 0.00 -1.03 0.00 0.00 41.12 40.41 2k9a n ASP 54 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 2k9a s THR 55 N -0.32 3.05 -0.17 2.12 -4.23 -1.26 -5.00 115.64 109.83 2k9a s THR 55 Ca 0.00 0.34 0.05 0.00 -1.18 0.00 0.00 61.69 60.90 2k9a s THR 55 Cb 0.00 -2.86 -0.13 0.00 1.34 0.00 0.00 72.50 70.84 2k9a s THR 55 CO 0.00 -0.44 -0.09 -0.62 -0.54 0.00 0.00 174.62 172.92 2k9a n GLU 56 N -3.65 0.84 -2.08 3.99 1.02 -1.26 -4.97 120.64 114.53 2k9a n GLU 56 Ca 0.08 0.07 -0.42 0.00 -0.02 0.00 0.00 57.16 56.87 2k9a n GLU 56 Cb 0.54 -1.36 -0.03 0.00 -0.02 0.00 0.00 31.44 30.58 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 -2.35 4.27 0.43 3.49 2.12 -1.26 -4.99 118.70 120.40 2k9a s GLU 57 Ca -0.19 2.17 -0.20 0.00 0.36 0.00 0.00 54.97 57.12 2k9a s GLU 57 Cb 0.06 -3.33 -0.10 0.00 0.26 0.00 0.00 34.13 31.01 2k9a s GLU 57 CO 0.46 -0.55 0.93 0.54 -0.54 0.00 0.00 175.26 176.10 2k9a s ASN 58 N 1.44 6.87 0.21 -1.70 4.22 -1.26 -5.08 114.94 119.63 2k9a s ASN 58 Ca 0.67 1.62 0.06 0.00 -2.14 0.00 0.00 52.86 53.07 2k9a s ASN 58 Cb -0.38 -2.51 -0.05 0.00 1.28 0.00 0.00 41.25 39.59 2k9a s ASN 58 CO 0.30 -0.37 -0.08 -0.54 -2.04 0.00 0.00 177.10 174.36 2k9a s LYS 59 N -3.29 1.29 0.08 3.55 1.02 -1.26 -5.03 119.74 116.09 2k9a s LYS 59 Ca 0.60 -1.60 0.28 0.00 0.02 0.00 0.00 55.97 55.27 2k9a s LYS 59 Cb -0.09 -0.86 1.06 0.00 -0.52 0.00 0.00 37.83 37.41 2k9a s LYS 59 CO 0.16 0.06 1.86 1.28 -0.92 0.00 0.00 175.35 177.79 2k9a n LEU 60 N -0.37 0.32 0.17 3.17 7.99 -1.26 -3.27 117.00 123.76 2k9a n LEU 60 Ca -0.08 0.51 0.14 0.00 -0.01 0.00 0.00 56.01 56.58 2k9a n LEU 60 Cb 0.62 -0.42 0.54 0.00 -0.11 0.00 0.00 43.42 44.04 2k9a n LEU 60 CO 0.35 -0.06 0.90 -0.29 -1.51 0.00 0.00 177.39 176.78 2k9a h ILE 61 N 0.00 0.00 0.00 -0.08 6.09 -2.02 -2.66 117.51 118.84 2k9a h ILE 61 Ca 0.00 -0.34 0.00 0.00 -1.37 0.00 0.00 64.86 63.15 2k9a h ILE 61 Cb 0.59 1.17 0.00 0.00 0.47 0.00 0.00 36.82 39.05 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 0.06 2.19 -1.99 -1.99 -2.86 116.97 112.38 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 0.44 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.17 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 -0.63 -2.88 2.02 -1.72 -2.46 112.91 108.46 2k9a h THR 63 Ca 0.00 -1.57 -0.04 0.00 0.77 0.00 0.00 66.41 65.57 2k9a h THR 63 Cb 0.59 2.15 -0.03 0.00 -1.74 0.00 0.00 68.15 69.12 2k9a h THR 63 CO 0.00 0.36 0.24 -0.65 0.37 0.00 0.00 175.52 175.84 2k9a h PRO 64 N -0.86 0.94 -0.47 6.66 0.11 -1.71 -1.66 132.00 135.01 2k9a h PRO 64 Ca -0.01 -0.18 -0.01 0.00 0.11 0.00 0.00 66.00 65.91 2k9a h PRO 64 Cb 0.64 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 31.58 2k9a h PRO 64 CO 0.01 0.81 0.24 0.82 -0.21 0.00 0.00 178.00 179.67 2k9a h ILE 65 N 0.88 1.18 -0.44 4.15 2.04 -1.63 -2.08 117.51 121.61 2k9a h ILE 65 Ca 0.21 -0.50 -0.01 0.00 1.00 0.00 0.00 64.86 65.56 2k9a h ILE 65 Cb 0.22 0.64 -0.02 0.00 -0.74 0.00 0.00 36.82 36.92 2k9a h ILE 65 CO -0.01 0.20 0.22 0.15 0.00 0.00 0.00 178.15 178.70 2k9a h PHE 66 N 0.62 0.62 -0.46 1.37 3.57 -1.28 -2.26 116.94 119.13 2k9a h PHE 66 Ca 0.16 -0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.68 2k9a h PHE 66 Cb 0.10 -0.19 -0.03 0.00 2.79 0.00 0.00 35.95 38.62 2k9a h PHE 66 CO -0.01 0.49 0.31 -0.91 -2.23 0.00 0.00 178.31 175.96 2k9a h ASN 67 N 0.57 0.40 -0.40 0.41 2.35 -1.09 -1.38 115.58 116.43 2k9a h ASN 67 Ca 0.15 -0.00 -0.13 0.00 -0.55 0.00 0.00 56.30 55.77 2k9a h ASN 67 Cb 0.09 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 38.36 2k9a h ASN 67 CO -0.02 0.27 -0.25 -0.08 -1.65 0.00 0.00 177.43 175.70 2k9a h GLU 68 N 0.46 0.91 -0.34 0.81 4.81 -0.82 -1.60 114.58 118.81 2k9a h GLU 68 Ca 0.19 -0.40 -0.05 0.00 -0.13 0.00 0.00 59.36 58.97 2k9a h GLU 68 Cb 0.18 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.52 2k9a h GLU 68 CO -0.05 1.05 0.00 -0.92 -0.73 0.00 0.00 179.01 178.37 2k9a h TYR 69 N 0.78 0.55 -0.01 0.92 3.20 -0.80 -0.46 116.97 121.15 2k9a h TYR 69 Ca 0.10 -0.05 -0.01 0.00 3.14 0.00 0.00 58.73 61.90 2k9a h TYR 69 Cb 0.81 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 38.92 2k9a h TYR 69 CO 0.05 0.54 -0.04 0.82 -1.64 0.00 0.00 178.16 177.89 2k9a h ILE 70 N 0.51 1.54 -0.01 1.81 1.08 -1.20 0.87 117.51 122.11 2k9a h ILE 70 Ca 0.11 -1.65 -0.07 0.00 -0.39 0.00 0.00 64.86 62.87 2k9a h ILE 70 Cb 0.33 2.64 -0.01 0.00 -3.07 0.00 0.00 36.82 36.71 2k9a h ILE 70 CO 0.01 0.43 -0.31 0.77 -0.69 0.00 0.00 178.15 178.36 2k9a h SER 71 N -0.64 0.02 0.00 1.72 4.64 -1.22 -1.64 113.55 116.43 2k9a h SER 71 Ca -0.00 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2k9a h SER 71 Cb 0.73 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.81 2k9a h SER 71 CO 0.01 0.34 -0.37 -0.11 -0.87 0.00 0.00 176.83 175.83 2k9a n LEU 72 N -4.16 1.30 0.14 5.97 -0.00 -0.19 -4.16 117.00 115.89 2k9a n LEU 72 Ca -0.02 0.53 -0.07 0.00 -0.00 0.00 0.00 56.01 56.45 2k9a n LEU 72 Cb 0.36 -0.77 -0.03 0.00 -0.00 0.00 0.00 43.42 42.99 2k9a n LEU 72 CO 0.38 -0.48 0.18 0.58 -0.00 0.00 0.00 177.39 178.05 2k9a h VAL 73 N -0.72 0.00 -1.00 1.96 2.07 -0.96 -2.02 116.25 115.59 2k9a h VAL 73 Ca 0.00 -0.60 0.17 0.00 0.82 0.00 0.00 66.70 67.09 2k9a h VAL 73 Cb 0.37 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 30.04 2k9a h VAL 73 CO 0.00 0.00 0.62 -0.08 0.02 0.00 0.00 177.57 178.13 2k9a h GLU 74 N -1.03 0.78 -0.03 1.57 4.81 -1.14 0.11 114.58 119.65 2k9a h GLU 74 Ca -0.04 -0.05 -0.15 0.00 -0.13 0.00 0.00 59.36 58.99 2k9a h GLU 74 Cb 0.33 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.52 2k9a h GLU 74 CO 0.07 0.52 -0.68 0.87 -0.73 0.00 0.00 179.01 179.06 2k9a h LYS 75 N 0.80 0.14 -0.99 1.92 1.57 -1.42 -2.81 116.57 115.78 2k9a h LYS 75 Ca 0.55 -0.11 0.04 0.00 -1.87 0.00 0.00 60.65 59.26 2k9a h LYS 75 Cb 0.81 0.02 -0.06 0.00 0.08 0.00 0.00 32.23 33.08 2k9a h LYS 75 CO -0.33 0.77 0.65 -0.92 -0.57 0.00 0.00 179.45 179.04 2k9a h TYR 76 N 0.10 1.20 0.08 -1.35 3.20 -0.01 -0.07 116.97 120.12 2k9a h TYR 76 Ca -0.01 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.88 2k9a h TYR 76 Cb 1.21 -0.40 0.00 0.00 1.54 0.00 0.00 36.73 39.08 2k9a h TYR 76 CO 0.02 0.68 -0.04 0.82 -1.64 0.00 0.00 178.16 178.00 2k9a h ILE 77 N 1.23 1.19 -0.49 1.81 2.04 -1.38 -2.76 117.51 119.14 2k9a h ILE 77 Ca 0.40 -1.22 0.07 0.00 1.00 0.00 0.00 64.86 65.11 2k9a h ILE 77 Cb 0.04 1.94 -0.06 0.00 -0.74 0.00 0.00 36.82 38.00 2k9a h ILE 77 CO -0.13 0.29 0.14 -0.08 0.00 0.00 0.00 178.15 178.37 2k9a h GLU 78 N -0.69 0.29 -0.08 2.37 4.81 -1.31 -1.66 114.58 118.30 2k9a h GLU 78 Ca -0.01 -0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.21 2k9a h GLU 78 Cb 0.56 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.86 2k9a h GLU 78 CO 0.02 0.19 0.02 0.93 -0.73 0.00 0.00 179.01 179.44 2k9a h GLU 79 N 0.30 0.05 -0.14 1.92 5.08 -1.09 -0.48 114.58 120.22 2k9a h GLU 79 Ca 0.24 -0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.64 2k9a h GLU 79 Cb 0.28 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 2k9a h GLU 79 CO -0.27 0.03 0.10 1.96 -1.00 0.00 0.00 179.01 179.83 2k9a h GLN 80 N 0.05 0.00 0.08 2.33 1.08 -1.15 -1.52 115.11 115.98 2k9a h GLN 80 Ca 0.03 0.00 -0.26 0.00 -1.45 0.00 0.00 58.65 56.98 2k9a h GLN 80 Cb 0.03 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.47 2k9a h GLN 80 CO -0.05 0.00 -1.13 -0.07 -0.95 0.00 0.00 178.83 176.63 2k9a h LEU 81 N 0.00 0.54 -1.20 1.46 3.38 -0.54 -3.26 115.31 115.69 2k9a h LEU 81 Ca 0.07 -0.51 -0.07 0.00 0.09 0.00 0.00 57.88 57.46 2k9a h LEU 81 Cb 0.27 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 2k9a h LEU 81 CO -0.00 1.35 -0.35 -0.07 0.09 0.00 0.00 178.44 179.46 2k9a h LEU 82 N 0.16 0.00 -2.38 1.67 3.38 -0.13 -0.19 115.31 117.82 2k9a h LEU 82 Ca -0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2k9a h LEU 82 Cb 1.81 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.56 2k9a h LEU 82 CO 0.19 0.35 0.00 1.56 0.09 0.00 0.00 178.44 180.63 2k9a h GLN 83 N 0.00 0.00 0.00 1.13 4.20 -1.43 -2.95 115.11 116.06 2k9a h GLN 83 Ca -0.00 0.00 -0.10 0.00 0.06 0.00 0.00 58.65 58.61 2k9a h GLN 83 Cb 0.74 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.50 2k9a h GLN 83 CO 0.05 0.00 -1.37 -2.13 -0.67 0.00 0.00 178.83 174.70 2k9a n ARG 84 N -2.85 2.14 -3.88 1.46 3.00 -0.99 -4.93 116.66 110.62 2k9a n ARG 84 Ca -0.02 0.01 -0.30 0.00 -0.00 0.00 0.00 57.85 57.54 2k9a n ARG 84 Cb 0.09 -1.14 -0.15 0.00 0.00 0.00 0.00 32.46 31.27 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 -2.13 1.74 -1.47 5.15 1.01 -0.12 -4.96 121.20 120.42 2k9a s ILE 85 Ca -0.05 -2.17 0.19 0.00 0.00 0.00 0.00 60.65 58.62 2k9a s ILE 85 Cb 0.02 -2.27 0.35 0.00 0.01 0.00 0.00 42.46 40.56 2k9a s ILE 85 CO 0.20 -0.69 1.58 -0.81 0.00 0.00 0.00 174.94 175.22 2k9a n PRO 86 N 4.23 0.29 -0.26 2.79 -0.04 -1.22 -2.27 135.00 138.52 2k9a n PRO 86 Ca 0.03 0.10 0.07 0.00 -0.04 0.00 0.00 63.50 63.66 2k9a n PRO 86 Cb 0.40 -1.50 0.18 0.00 -0.04 0.00 0.00 33.50 32.54 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 -1.27 2.64 -2.65 0.54 1.02 -1.26 -5.02 120.64 114.63 2k9a n GLU 87 Ca 0.09 -2.44 -0.38 0.00 -0.02 0.00 0.00 57.16 54.42 2k9a n GLU 87 Cb 0.15 -1.54 -0.05 0.00 -0.02 0.00 0.00 31.44 29.97 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 -2.15 3.57 -0.30 -0.32 5.36 -0.96 -5.04 117.98 118.14 2k9a s PHE 88 Ca 0.31 1.74 0.00 0.00 -0.96 0.00 0.00 56.93 58.02 2k9a s PHE 88 Cb 0.23 -3.05 0.09 0.00 -0.34 0.00 0.00 43.02 39.95 2k9a s PHE 88 CO 0.09 -0.15 0.06 1.21 -1.46 0.00 0.00 175.22 174.97 2k9a s ASN 89 N -1.43 4.08 0.65 6.13 2.47 -1.26 -4.98 114.94 120.61 2k9a s ASN 89 Ca 0.51 -1.63 0.41 0.00 0.42 0.00 0.00 52.86 52.57 2k9a s ASN 89 Cb -0.23 -1.05 2.28 0.00 -1.45 0.00 0.00 41.25 40.80 2k9a s ASN 89 CO 0.29 -0.37 2.33 -0.03 -3.72 0.00 0.00 177.10 175.59 2k9a h MET 90 N 7.98 0.00 0.19 0.43 1.85 -1.97 -0.72 114.93 122.69 2k9a h MET 90 Ca -0.12 0.00 -0.01 0.00 -0.61 0.00 0.00 59.70 58.96 2k9a h MET 90 Cb 1.03 0.00 0.00 0.00 0.43 0.00 0.00 31.60 33.06 2k9a h MET 90 CO 0.46 0.00 -0.09 0.00 -0.40 0.00 0.00 176.91 176.88 2k9a h ALA 91 N 1.96 -0.26 0.00 0.39 0.00 -2.00 -2.71 119.26 116.65 2k9a h ALA 91 Ca 0.00 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.70 2k9a h ALA 91 Cb 0.04 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2k9a h ALA 91 CO -0.00 -0.28 -0.23 0.00 0.00 0.00 0.00 179.25 178.74 2k9a h ALA 92 N -0.71 1.19 0.28 0.00 0.00 -1.94 -2.62 119.26 115.46 2k9a h ALA 92 Ca -0.03 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 2k9a h ALA 92 Cb 0.41 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2k9a h ALA 92 CO 0.04 0.29 -0.13 0.35 0.00 0.00 0.00 179.25 179.80 2k9a h PHE 93 N 0.00 -0.35 -0.36 0.00 3.57 -1.22 -2.43 116.94 116.15 2k9a h PHE 93 Ca -0.00 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.51 2k9a h PHE 93 Cb 0.58 0.11 -0.03 0.00 2.79 0.00 0.00 35.95 39.41 2k9a h PHE 93 CO 0.00 0.01 0.18 1.79 -2.23 0.00 0.00 178.31 178.06 2k9a h THR 94 N -0.88 0.99 -0.17 4.41 1.35 -1.47 0.12 112.91 117.26 2k9a h THR 94 Ca -0.04 -0.13 0.03 0.00 -0.55 0.00 0.00 66.41 65.73 2k9a h THR 94 Cb 0.51 0.58 -0.03 0.00 -1.73 0.00 0.00 68.15 67.48 2k9a h THR 94 CO 0.06 0.07 -0.04 0.74 -0.25 0.00 0.00 175.52 176.10 2k9a h THR 95 N 0.38 0.83 0.00 6.82 2.02 -1.56 -1.94 112.91 119.46 2k9a h THR 95 Ca 0.15 -0.00 -0.09 0.00 0.77 0.00 0.00 66.41 67.24 2k9a h THR 95 Cb 0.05 0.83 -0.01 0.00 -1.74 0.00 0.00 68.15 67.27 2k9a h THR 95 CO -0.10 0.00 -0.42 0.74 0.37 0.00 0.00 175.52 176.12 2k9a h THR 96 N 0.00 1.25 -0.54 3.16 2.02 -1.22 -2.92 112.91 114.66 2k9a h THR 96 Ca 0.08 -1.45 -0.05 0.00 0.77 0.00 0.00 66.41 65.76 2k9a h THR 96 Cb 0.12 1.79 -0.03 0.00 -1.74 0.00 0.00 68.15 68.30 2k9a h THR 96 CO -0.18 0.41 0.14 0.25 0.37 0.00 0.00 175.52 176.51 2k9a h LEU 97 N 0.00 0.77 -0.96 2.58 6.46 -0.04 -0.14 115.31 123.98 2k9a h LEU 97 Ca -0.00 -0.13 0.18 0.00 -0.12 0.00 0.00 57.88 57.80 2k9a h LEU 97 Cb 0.76 -0.20 -0.10 0.00 -0.73 0.00 0.00 40.66 40.38 2k9a h LEU 97 CO 0.05 0.75 0.56 1.56 -0.62 0.00 0.00 178.44 180.75 2k9a h GLN 98 N 0.80 0.69 0.05 1.25 4.20 -1.19 0.20 115.11 121.11 2k9a h GLN 98 Ca 0.18 -0.04 -0.33 0.00 0.06 0.00 0.00 58.65 58.52 2k9a h GLN 98 Cb 0.28 -0.16 -0.04 0.00 0.30 0.00 0.00 27.48 27.87 2k9a h GLN 98 CO -0.00 0.46 -1.91 0.72 -0.67 0.00 0.00 178.83 177.42 2k9a n HIS 99 N -4.81 0.95 0.70 2.96 8.25 -1.09 -3.89 115.22 118.30 2k9a n HIS 99 Ca 0.22 0.28 0.07 0.00 -0.26 0.00 0.00 57.72 58.03 2k9a n HIS 99 Cb 0.54 -1.15 0.37 0.00 1.12 0.00 0.00 29.99 30.87 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 -3.19 0.00 0.23 4.41 -0.00 -0.08 -2.64 115.22 113.95 2k9a n HIS 100 Ca -0.25 0.00 0.15 0.00 -0.00 0.00 0.00 57.72 57.62 2k9a n HIS 100 Cb 1.06 -0.27 0.82 0.00 -0.00 0.00 0.00 29.99 31.60 2k9a n HIS 100 CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 176.34 176.12 2k9a h LYS 101 N 0.00 0.00 0.00 1.57 3.64 -0.73 -1.75 116.57 119.30 2k9a h LYS 101 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2k9a h LYS 101 Cb 0.13 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 2k9a h LYS 101 CO 0.00 0.00 0.19 0.38 -2.27 0.00 0.00 179.45 177.75 2k9a h ASP 102 N 0.00 0.00 0.00 4.20 3.04 -1.80 -3.15 116.42 118.71 2k9a h ASP 102 Ca 0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 2k9a h ASP 102 Cb 0.02 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.31 2k9a h ASP 102 CO 0.00 0.00 -0.99 1.21 -2.04 0.00 0.00 179.24 177.42 2k9a n GLU 103 N -2.94 0.00 -1.65 4.15 0.00 -0.68 -5.06 120.64 114.46 2k9a n GLU 103 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 57.16 56.73 2k9a n GLU 103 Cb 0.24 -0.69 0.02 0.00 0.00 0.00 0.00 31.44 31.01 2k9a n GLU 103 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 2k9a n VAL 104 N -2.79 2.73 -1.59 6.31 0.31 -1.06 -4.81 118.33 117.43 2k9a n VAL 104 Ca 0.00 -0.50 -0.41 0.00 -0.01 0.00 0.00 64.34 63.42 2k9a n VAL 104 Cb 0.49 -1.33 -0.03 0.00 -0.91 0.00 0.00 33.84 32.06 2k9a n VAL 104 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2k9a s ALA 105 N -1.28 2.43 0.46 3.52 0.00 -1.26 -4.81 121.76 120.82 2k9a s ALA 105 Ca 0.65 0.58 0.14 0.00 0.00 0.00 0.00 51.96 53.32 2k9a s ALA 105 Cb -0.51 -4.15 1.06 0.00 0.00 0.00 0.00 23.12 19.52 2k9a s ALA 105 CO 0.55 -3.25 2.04 0.78 0.00 0.00 0.00 175.76 175.88 2k9a h GLY 106 N 16.33 0.06 1.30 0.00 0.00 -1.87 -2.35 103.07 116.54 2k9a h GLY 106 Ca -0.36 -0.03 -0.05 0.00 0.00 0.00 0.00 47.33 46.89 2k9a h GLY 106 CO 1.01 0.03 0.17 -1.80 0.00 0.00 0.00 176.54 175.95 2k9a h ASP 107 N 0.06 0.82 -0.00 0.19 3.58 -1.99 0.89 116.42 119.97 2k9a h ASP 107 Ca 0.01 -0.14 -0.00 0.00 0.42 0.00 0.00 57.03 57.32 2k9a h ASP 107 Cb 0.19 -0.21 0.00 0.00 1.72 0.00 0.00 39.33 41.03 2k9a h ASP 107 CO 0.01 0.78 -0.00 0.40 -2.88 0.00 0.00 179.24 177.55 2k9a h ILE 108 N 0.86 1.58 0.00 2.25 1.08 -1.83 -3.27 117.51 118.17 2k9a h ILE 108 Ca 0.19 -1.69 -0.06 0.00 -0.39 0.00 0.00 64.86 62.91 2k9a h ILE 108 Cb 0.27 2.73 -0.01 0.00 -3.07 0.00 0.00 36.82 36.74 2k9a h ILE 108 CO -0.01 0.44 -0.27 0.15 -0.69 0.00 0.00 178.15 177.77 2k9a h PHE 109 N -0.72 0.00 -1.10 1.37 3.57 -1.45 -2.69 116.94 115.92 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 0.72 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 39.41 2k9a h PHE 109 CO 0.18 0.27 0.78 0.22 -2.23 0.00 0.00 178.31 177.54 2k9a h ASP 110 N 0.00 0.03 -0.02 0.41 3.58 -0.87 0.69 116.42 120.24 2k9a h ASP 110 Ca -0.00 0.01 -0.02 0.00 0.42 0.00 0.00 57.03 57.43 2k9a h ASP 110 Cb 0.51 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.56 2k9a h ASP 110 CO 0.04 0.01 -0.07 -0.03 -2.88 0.00 0.00 179.24 176.31 2k9a h MET 111 N 0.03 0.08 0.00 0.28 4.05 -1.63 -3.11 114.93 114.63 2k9a h MET 111 Ca 0.53 -0.06 -0.02 0.00 -0.28 0.00 0.00 59.70 59.87 2k9a h MET 111 Cb 2.06 0.01 -0.00 0.00 -0.80 0.00 0.00 31.60 32.86 2k9a h MET 111 CO -0.03 0.68 -0.09 -0.07 0.23 0.00 0.00 176.91 177.63 2k9a h LEU 112 N -0.50 0.00 -1.90 3.39 3.38 -0.67 -2.81 115.31 116.20 2k9a h LEU 112 Ca -0.00 0.00 0.20 0.00 0.09 0.00 0.00 57.88 58.17 2k9a h LEU 112 Cb 0.69 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.41 2k9a h LEU 112 CO 0.01 0.09 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 0.26 0.91 115.31 124.00 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 0.41 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.44 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 0.08 1.05 -2.24 -1.06 -2.43 114.28 105.79 2k9a n THR 114 Ca 0.14 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.93 2k9a n THR 114 Cb 0.88 -0.85 0.35 0.00 -2.10 0.00 0.00 70.33 68.61 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 0.35 0.00 4.78 0.04 -1.08 -3.38 116.94 117.64 2k9a h PHE 115 Ca 0.00 -0.04 0.00 0.00 2.80 0.00 0.00 57.97 60.73 2k9a h PHE 115 Cb 0.00 -0.10 0.00 0.00 2.20 0.00 0.00 35.95 38.05 2k9a h PHE 115 CO 0.00 0.44 -0.30 0.25 -0.60 0.00 0.00 178.31 178.10 2k9a n THR 116 N -4.26 0.00 -2.09 -1.55 -2.24 -1.06 -4.97 114.28 98.11 2k9a n THR 116 Ca -0.00 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.50 2k9a n THR 116 Cb 0.28 -0.28 -0.05 0.00 -2.10 0.00 0.00 70.33 68.17 2k9a n THR 116 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2k9a s ASP 117 N -1.81 5.19 0.60 3.42 2.15 -1.02 -4.75 116.67 120.44 2k9a s ASP 117 Ca 0.00 -1.11 0.33 0.00 0.43 0.00 0.00 52.55 52.20 2k9a s ASP 117 Cb 0.00 -2.57 1.90 0.00 -0.30 0.00 0.00 42.92 41.94 2k9a s ASP 117 CO 0.00 -2.79 2.25 0.15 -0.17 0.00 0.00 175.17 174.61 2k9a h PHE 118 N 10.58 0.00 -0.56 -5.34 3.57 -1.89 -1.58 116.94 121.72 2k9a h PHE 118 Ca 0.15 0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.57 2k9a h PHE 118 Cb 0.98 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.70 2k9a h PHE 118 CO 1.22 0.02 0.01 -0.07 -2.23 0.00 0.00 178.31 177.26 2k9a h LEU 119 N 0.00 0.96 -0.24 0.59 -0.00 -1.98 -1.15 115.31 113.49 2k9a h LEU 119 Ca -0.00 -0.30 -0.20 0.00 -0.00 0.00 0.00 57.88 57.37 2k9a h LEU 119 Cb 0.06 -0.26 -0.01 0.00 -0.00 0.00 0.00 40.66 40.45 2k9a h LEU 119 CO 0.00 1.03 -0.91 0.00 -0.00 0.00 0.00 178.44 178.56 2k9a h ALA 120 N 0.96 0.47 0.32 1.53 0.00 -1.71 -2.62 119.26 118.22 2k9a h ALA 120 Ca 0.16 -0.74 -0.02 0.00 0.00 0.00 0.00 54.91 54.31 2k9a h ALA 120 Cb 0.53 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2k9a h ALA 120 CO 0.03 0.92 -0.15 0.35 0.00 0.00 0.00 179.25 180.40 2k9a h PHE 121 N 0.11 -0.40 0.20 0.00 3.57 -1.24 -0.05 116.94 119.14 2k9a h PHE 121 Ca -0.05 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.43 2k9a h PHE 121 Cb 1.55 0.13 0.00 0.00 2.79 0.00 0.00 35.95 40.42 2k9a h PHE 121 CO 0.03 -0.10 -0.09 0.87 -2.23 0.00 0.00 178.31 176.79 2k9a h LYS 122 N -0.69 -0.26 -0.35 1.11 1.79 -1.31 -2.47 116.57 114.39 2k9a h LYS 122 Ca -0.04 0.02 0.03 0.00 -2.18 0.00 0.00 60.65 58.47 2k9a h LYS 122 Cb 0.48 0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 31.17 2k9a h LYS 122 CO 0.07 -0.15 0.23 1.49 -1.08 0.00 0.00 179.45 180.01 2k9a h GLU 123 N -0.29 0.35 -0.24 3.15 4.81 -1.52 -2.26 114.58 118.59 2k9a h GLU 123 Ca -0.03 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 2k9a h GLU 123 Cb 0.22 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.51 2k9a h GLU 123 CO 0.04 0.23 0.15 1.98 -0.73 0.00 0.00 179.01 180.69 2k9a h MET 124 N 0.36 0.31 -0.30 1.92 4.05 -0.54 -1.12 114.93 119.61 2k9a h MET 124 Ca 0.14 -0.02 -0.03 0.00 -0.28 0.00 0.00 59.70 59.51 2k9a h MET 124 Cb 0.11 -0.07 -0.01 0.00 -0.80 0.00 0.00 31.60 30.83 2k9a h MET 124 CO -0.03 0.20 0.08 0.74 0.23 0.00 0.00 176.91 178.13 2k9a h PHE 125 N 0.31 0.50 -0.08 1.39 0.04 -1.17 -2.15 116.94 115.79 2k9a h PHE 125 Ca 0.09 -0.06 0.02 0.00 2.80 0.00 0.00 57.97 60.83 2k9a h PHE 125 Cb -0.03 -0.14 -0.00 0.00 2.20 0.00 0.00 35.95 37.98 2k9a h PHE 125 CO -0.07 0.53 0.06 -0.07 -0.60 0.00 0.00 178.31 178.16 2k9a h LEU 126 N 0.33 0.01 -0.00 1.54 3.38 -1.25 -1.62 115.31 117.69 2k9a h LEU 126 Ca 0.10 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 2k9a h LEU 126 Cb 0.27 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.02 2k9a h LEU 126 CO -0.00 0.01 -0.01 -0.78 0.09 0.00 0.00 178.44 177.74 2k9a h ASP 127 N 0.01 0.02 -0.79 -0.43 1.82 -0.83 -2.23 116.42 113.98 2k9a h ASP 127 Ca 0.04 -0.63 0.09 0.00 -0.39 0.00 0.00 57.03 56.13 2k9a h ASP 127 Cb 0.14 -0.01 -0.05 0.00 0.68 0.00 0.00 39.33 40.09 2k9a h ASP 127 CO -0.00 0.65 0.51 0.22 -1.61 0.00 0.00 179.24 179.01 2k9a h TYR 128 N -0.61 0.80 -0.22 0.28 3.20 -0.92 -1.11 116.97 118.40 2k9a h TYR 128 Ca -0.00 0.02 -0.16 0.00 3.14 0.00 0.00 58.73 61.73 2k9a h TYR 128 Cb 0.64 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.65 2k9a h TYR 128 CO 0.15 0.39 -0.53 -0.09 -1.64 0.00 0.00 178.16 176.44 2k9a h ARG 129 N 0.76 0.62 -0.38 1.82 2.43 -1.32 -3.04 114.38 115.27 2k9a h ARG 129 Ca 0.36 -0.38 -0.01 0.00 -0.81 0.00 0.00 59.98 59.13 2k9a h ARG 129 Cb 0.38 0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.95 2k9a h ARG 129 CO -0.13 1.00 0.19 0.00 -1.51 0.00 0.00 179.97 179.51 2k9a h ALA 130 N 0.93 1.62 0.00 2.80 0.00 -0.57 -0.97 119.26 123.06 2k9a h ALA 130 Ca 0.01 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 2k9a h ALA 130 Cb 1.08 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.71 2k9a h ALA 130 CO 0.10 0.31 -0.17 0.93 0.00 0.00 0.00 179.25 180.43 2k9a h GLU 131 N 0.53 0.00 0.00 0.00 4.39 -1.33 -2.29 114.58 115.88 2k9a h GLU 131 Ca 0.14 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.84 2k9a h GLU 131 Cb 0.05 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.70 2k9a h GLU 131 CO -0.02 0.17 0.00 0.87 -1.16 0.00 0.00 179.01 178.87 2k9a h LYS 132 N 0.00 0.00 -0.37 2.33 1.79 -1.18 -2.59 116.57 116.55 2k9a h LYS 132 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2k9a h LYS 132 Cb 0.58 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.23 2k9a h LYS 132 CO 0.02 0.00 0.00 0.39 -1.08 0.00 0.00 179.45 178.78 2k9a n GLU 133 N -2.81 2.68 0.13 3.15 1.02 -0.87 -4.64 120.64 119.29 2k9a n GLU 133 Ca 0.02 -2.07 -0.13 0.00 -0.02 0.00 0.00 57.16 54.96 2k9a n GLU 133 Cb 0.31 -1.31 -0.08 0.00 -0.02 0.00 0.00 31.44 30.34 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 2.37 -0.36 -2.32 0.62 0.00 -1.31 -3.45 103.07 98.63 2k9a h GLY 134 Ca 0.00 0.13 -0.44 0.00 0.00 0.00 0.00 47.33 47.02 2k9a h GLY 134 CO 0.00 -0.13 -0.18 0.50 0.00 0.00 0.00 176.54 176.73 2k9a s ARG 135 N -4.61 2.87 0.00 4.80 0.52 -1.26 -5.13 118.95 116.14 2k9a s ARG 135 Ca -0.14 -0.89 0.00 0.00 -0.52 0.00 0.00 55.73 54.18 2k9a s ARG 135 Cb 0.02 -2.65 0.00 0.00 0.52 0.00 0.00 34.95 32.84 2k9a s ARG 135 CO 0.56 -0.31 0.00 0.41 0.02 0.00 0.00 175.30 175.98