#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k9a n ASP 2 N 0.00 1.87 -4.62 7.83 2.03 -1.26 -4.96 116.55 117.44 2k9a n ASP 2 Ca 0.00 -1.59 -0.36 0.00 0.52 0.00 0.00 54.79 53.36 2k9a n ASP 2 Cb 0.00 0.02 0.08 0.00 -0.72 0.00 0.00 41.12 40.50 2k9a n ASP 2 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2k9a n ALA 3 N 0.42 -0.05 -0.10 -1.67 0.00 -1.26 -4.96 120.51 112.88 2k9a n ALA 3 Ca 0.17 -0.14 -0.16 0.00 0.00 0.00 0.00 53.44 53.31 2k9a n ALA 3 Cb 0.42 -2.13 -0.13 0.00 0.00 0.00 0.00 19.45 17.61 2k9a n ALA 3 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2k9a n LEU 4 N -1.51 2.13 0.00 0.00 0.00 -1.26 -4.91 117.00 111.45 2k9a n LEU 4 Ca 0.13 -0.03 0.00 0.00 0.00 0.00 0.00 56.01 56.11 2k9a n LEU 4 Cb 0.49 -0.55 0.00 0.00 0.00 0.00 0.00 43.42 43.36 2k9a n LEU 4 CO 0.49 0.80 0.00 1.21 0.00 0.00 0.00 177.39 179.88 2k9a n GLU 5 N -3.16 0.00 -1.53 1.96 0.00 -1.26 -5.09 120.64 111.56 2k9a n GLU 5 Ca -0.40 0.00 -0.48 0.00 0.00 0.00 0.00 57.16 56.28 2k9a n GLU 5 Cb 1.04 -0.04 -0.06 0.00 0.00 0.00 0.00 31.44 32.38 2k9a n GLU 5 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2k9a n GLY 6 N -0.62 0.79 0.00 8.31 0.00 -1.26 -4.45 105.19 107.96 2k9a n GLY 6 Ca 0.00 0.88 0.00 0.00 0.00 0.00 0.00 46.02 46.90 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 8.07 0.00 -2.68 1.61 4.07 -1.26 -4.92 120.64 125.53 2k9a n GLU 7 Ca 0.35 0.00 -0.07 0.00 -0.06 0.00 0.00 57.16 57.38 2k9a n GLU 7 Cb 0.30 0.00 -0.02 0.00 -0.06 0.00 0.00 31.44 31.66 2k9a n GLU 7 CO 0.00 0.00 0.00 0.43 -0.06 0.00 0.00 177.13 177.50 2k9a n SER 8 N -0.39 1.22 -4.63 4.31 7.64 -1.26 -5.08 113.62 115.43 2k9a n SER 8 Ca 0.00 -1.60 -0.43 0.00 1.01 0.00 0.00 58.87 57.85 2k9a n SER 8 Cb 0.00 0.26 -0.03 0.00 -1.01 0.00 0.00 64.21 63.43 2k9a n SER 8 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 2k9a s PHE 9 N -1.89 1.29 0.00 1.43 0.08 -1.26 -4.69 117.98 112.94 2k9a s PHE 9 Ca 0.05 0.09 0.00 0.00 0.12 0.00 0.00 56.93 57.19 2k9a s PHE 9 Cb 0.00 -4.08 0.00 0.00 -0.57 0.00 0.00 43.02 38.38 2k9a s PHE 9 CO 0.03 -4.65 0.00 0.00 -0.10 0.00 0.00 175.22 170.50 2k9a n ALA 10 N 9.59 2.18 -2.56 5.36 0.00 -1.26 -5.03 120.51 128.79 2k9a n ALA 10 Ca 0.24 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.50 2k9a n ALA 10 Cb 0.43 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.88 2k9a n ALA 10 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2k9a n LEU 11 N -2.31 -1.75 0.00 0.00 4.77 -1.26 -4.91 117.00 111.53 2k9a n LEU 11 Ca 0.00 -0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2k9a n LEU 11 Cb 0.00 -2.63 0.00 0.00 -2.33 0.00 0.00 43.42 38.46 2k9a n LEU 11 CO 0.00 -0.10 0.29 -1.20 -1.33 0.00 0.00 177.39 175.04 2k9a n SER 12 N -2.03 0.00 -3.87 -1.43 7.64 -1.26 -4.95 113.62 107.71 2k9a n SER 12 Ca -0.18 0.74 -0.11 0.00 1.01 0.00 0.00 58.87 60.33 2k9a n SER 12 Cb 0.64 -0.44 -0.10 0.00 -1.01 0.00 0.00 64.21 63.31 2k9a n SER 12 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 2k9a s PHE 13 N -2.02 0.04 0.31 1.43 -0.71 -1.26 -5.17 117.98 110.59 2k9a s PHE 13 Ca 0.00 -0.12 -0.04 0.00 -1.04 0.00 0.00 56.93 55.73 2k9a s PHE 13 Cb 0.00 -0.05 0.02 0.00 -1.21 0.00 0.00 43.02 41.78 2k9a s PHE 13 CO 0.00 -0.27 0.47 0.43 -1.34 0.00 0.00 175.22 174.50 2k9a n SER 14 N 1.52 -1.32 0.00 1.98 7.64 -1.26 -4.94 113.62 117.24 2k9a n SER 14 Ca -0.22 -2.59 0.00 0.00 1.01 0.00 0.00 58.87 57.07 2k9a n SER 14 Cb 0.56 2.39 0.00 0.00 -1.01 0.00 0.00 64.21 66.15 2k9a n SER 14 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2k9a n SER 15 N -1.65 0.00 0.39 6.43 7.64 -1.26 -4.62 113.62 120.54 2k9a n SER 15 Ca -0.01 0.00 -0.18 0.00 1.01 0.00 0.00 58.87 59.70 2k9a n SER 15 Cb 0.51 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 63.62 2k9a n SER 15 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k9a h ALA 16 N 0.00 -0.97 -0.53 -0.43 0.00 -1.96 -1.38 119.26 113.99 2k9a h ALA 16 Ca 0.00 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 54.60 2k9a h ALA 16 Cb 0.00 0.38 -0.05 0.00 0.00 0.00 0.00 17.79 18.11 2k9a h ALA 16 CO 0.00 -1.00 0.11 -1.13 0.00 0.00 0.00 179.25 177.23 2k9a n SER 17 N -5.48 4.59 -3.40 0.00 3.41 -1.26 -4.49 113.62 107.00 2k9a n SER 17 Ca -0.14 -2.86 -0.15 0.00 -0.26 0.00 0.00 58.87 55.46 2k9a n SER 17 Cb 0.40 -0.68 -0.01 0.00 -0.26 0.00 0.00 64.21 63.66 2k9a n SER 17 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2k9a n ASP 18 N 0.23 2.25 0.28 4.04 9.92 -1.14 -5.01 116.55 127.12 2k9a n ASP 18 Ca 0.28 -2.03 0.16 0.00 -0.53 0.00 0.00 54.79 52.66 2k9a n ASP 18 Cb 1.11 0.07 0.84 0.00 -0.64 0.00 0.00 41.12 42.50 2k9a n ASP 18 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2k9a h ALA 19 N 0.90 1.22 -0.56 2.24 0.00 -1.92 -2.87 119.26 118.27 2k9a h ALA 19 Ca -0.19 -0.06 0.06 0.00 0.00 0.00 0.00 54.91 54.72 2k9a h ALA 19 Cb 0.64 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.37 2k9a h ALA 19 CO 0.31 0.08 0.26 1.49 0.00 0.00 0.00 179.25 181.39 2k9a h GLU 20 N 0.00 0.48 -0.15 0.00 4.57 -1.93 -1.34 114.58 116.21 2k9a h GLU 20 Ca -0.00 -0.03 0.02 0.00 -1.18 0.00 0.00 59.36 58.18 2k9a h GLU 20 Cb 0.25 -0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 28.71 2k9a h GLU 20 CO 0.01 0.32 -0.01 0.35 -1.18 0.00 0.00 179.01 178.49 2k9a h PHE 21 N 0.49 -0.03 -0.76 0.92 3.57 -1.01 -2.07 116.94 118.06 2k9a h PHE 21 Ca 0.26 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.81 2k9a h PHE 21 Cb 0.22 0.03 -0.04 0.00 2.79 0.00 0.00 35.95 38.95 2k9a h PHE 21 CO -0.12 -0.03 0.50 -0.44 -2.23 0.00 0.00 178.31 175.99 2k9a h ASP 22 N 0.03 0.79 -0.26 0.41 3.32 -1.57 -2.37 116.42 116.77 2k9a h ASP 22 Ca 0.07 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.11 2k9a h ASP 22 Cb 0.09 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 2k9a h ASP 22 CO -0.12 0.53 0.17 0.00 -1.72 0.00 0.00 179.24 178.10 2k9a h ALA 23 N 1.56 0.33 -0.55 3.45 0.00 -0.58 -2.54 119.26 120.93 2k9a h ALA 23 Ca 0.31 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.23 2k9a h ALA 23 Cb 0.08 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 2k9a h ALA 23 CO -0.09 -0.20 0.32 0.28 0.00 0.00 0.00 179.25 179.56 2k9a h VAL 24 N 0.35 1.04 -0.99 0.00 2.07 -0.93 -2.08 116.25 115.71 2k9a h VAL 24 Ca 0.10 -0.22 0.11 0.00 0.82 0.00 0.00 66.70 67.51 2k9a h VAL 24 Cb -0.04 0.35 -0.08 0.00 -1.52 0.00 0.00 31.29 30.00 2k9a h VAL 24 CO -0.02 0.12 0.62 0.58 0.02 0.00 0.00 177.57 178.88 2k9a h VAL 25 N 0.63 0.95 -0.38 2.57 2.07 -1.20 -1.58 116.25 119.30 2k9a h VAL 25 Ca 0.22 -0.35 -0.03 0.00 0.82 0.00 0.00 66.70 67.37 2k9a h VAL 25 Cb 0.05 -0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 29.65 2k9a h VAL 25 CO -0.11 0.18 0.14 1.23 0.02 0.00 0.00 177.57 179.04 2k9a h GLY 26 N 1.01 0.63 2.00 2.17 0.00 -0.98 -2.33 103.07 105.57 2k9a h GLY 26 Ca 0.48 -0.35 -0.03 0.00 0.00 0.00 0.00 47.33 47.43 2k9a h GLY 26 CO -0.25 0.33 -0.14 -0.97 0.00 0.00 0.00 176.54 175.52 2k9a h TYR 27 N 0.47 0.00 -0.10 5.60 0.05 -0.98 -2.55 116.97 119.47 2k9a h TYR 27 Ca 0.13 0.00 -0.05 0.00 0.05 0.00 0.00 58.73 58.85 2k9a h TYR 27 Cb 0.21 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.95 2k9a h TYR 27 CO 0.00 0.14 -0.15 -0.07 -1.05 0.00 0.00 178.16 177.03 2k9a h LEU 28 N 0.00 0.30 -1.58 3.88 3.38 -0.89 -3.08 115.31 117.32 2k9a h LEU 28 Ca -0.00 -0.53 -0.00 0.00 0.09 0.00 0.00 57.88 57.43 2k9a h LEU 28 Cb 0.27 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 2k9a h LEU 28 CO 0.02 0.77 0.24 -0.33 0.09 0.00 0.00 178.44 179.23 2k9a h GLU 29 N -0.17 0.52 -0.20 1.13 5.08 -1.12 -0.73 114.58 119.08 2k9a h GLU 29 Ca 0.01 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.28 2k9a h GLU 29 Cb 0.71 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 2k9a h GLU 29 CO 0.03 0.36 -0.10 0.22 -1.00 0.00 0.00 179.01 178.52 2k9a h ASP 30 N 0.53 0.30 0.18 1.42 3.58 -1.43 -2.23 116.42 118.77 2k9a h ASP 30 Ca 0.14 -0.06 -0.29 0.00 0.42 0.00 0.00 57.03 57.24 2k9a h ASP 30 Cb -0.03 -0.08 0.02 0.00 1.72 0.00 0.00 39.33 40.96 2k9a h ASP 30 CO -0.03 0.44 -1.38 0.40 -2.88 0.00 0.00 179.24 175.79 2k9a h ILE 31 N 0.30 1.18 -0.43 2.25 2.04 -1.19 -2.82 117.51 118.84 2k9a h ILE 31 Ca 0.06 -2.54 0.02 0.00 1.00 0.00 0.00 64.86 63.41 2k9a h ILE 31 Cb 0.37 2.93 -0.02 0.00 -0.74 0.00 0.00 36.82 39.36 2k9a h ILE 31 CO 0.02 0.77 0.29 0.40 0.00 0.00 0.00 178.15 179.63 2k9a h ILE 32 N -0.10 1.06 -0.42 -0.67 2.04 -1.08 -0.60 117.51 117.74 2k9a h ILE 32 Ca -0.27 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.42 2k9a h ILE 32 Cb 1.93 0.51 0.00 0.00 -0.74 0.00 0.00 36.82 38.52 2k9a h ILE 32 CO 0.17 0.09 0.00 0.23 0.00 0.00 0.00 178.15 178.64 2k9a n MET 33 N -4.48 2.43 -2.32 2.37 2.81 -0.85 -4.71 117.12 112.37 2k9a n MET 33 Ca 0.04 -2.17 -0.42 0.00 -1.81 0.00 0.00 57.70 53.34 2k9a n MET 33 Cb 0.13 -1.50 -0.03 0.00 -0.71 0.00 0.00 33.22 31.10 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 -1.41 7.00 0.13 7.83 -1.08 -0.24 -4.95 116.67 123.96 2k9a s ASP 34 Ca 0.39 2.20 -0.24 0.00 -0.52 0.00 0.00 52.55 54.39 2k9a s ASP 34 Cb 0.22 -2.59 -0.02 0.00 -1.46 0.00 0.00 42.92 39.07 2k9a s ASP 34 CO 0.31 -0.49 1.64 0.44 0.52 0.00 0.00 175.17 177.60 2k9a h ASP 35 N 6.11 -0.67 0.04 -0.34 3.32 -1.90 -0.65 116.42 122.33 2k9a h ASP 35 Ca -0.43 0.11 -0.00 0.00 0.02 0.00 0.00 57.03 56.72 2k9a h ASP 35 Cb 1.21 0.30 -0.00 0.00 0.22 0.00 0.00 39.33 41.06 2k9a h ASP 35 CO 0.80 -0.28 -0.02 1.05 -1.72 0.00 0.00 179.24 179.07 2k9a h GLU 36 N -0.30 0.00 0.01 3.56 4.11 -1.94 -1.80 114.58 118.22 2k9a h GLU 36 Ca 0.09 0.00 -0.26 0.00 0.07 0.00 0.00 59.36 59.26 2k9a h GLU 36 Cb 0.43 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.69 2k9a h GLU 36 CO -0.27 0.02 -1.03 0.35 0.07 0.00 0.00 179.01 178.15 2k9a h PHE 37 N 0.00 0.90 -0.21 2.06 3.57 -1.49 -2.38 116.94 119.39 2k9a h PHE 37 Ca -0.00 -0.50 -0.05 0.00 3.53 0.00 0.00 57.97 60.96 2k9a h PHE 37 Cb 0.04 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.68 2k9a h PHE 37 CO 0.00 1.33 -0.05 1.96 -2.23 0.00 0.00 178.31 179.32 2k9a h GLN 38 N 0.33 0.41 0.13 1.11 4.20 -0.47 -1.26 115.11 119.55 2k9a h GLN 38 Ca -0.12 -0.16 -0.01 0.00 0.06 0.00 0.00 58.65 58.43 2k9a h GLN 38 Cb 1.68 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 29.44 2k9a h GLN 38 CO 0.19 0.65 -0.06 1.25 -0.67 0.00 0.00 178.83 180.20 2k9a h LEU 39 N 0.13 -0.15 -0.20 1.46 5.85 -1.44 -1.71 115.31 119.25 2k9a h LEU 39 Ca 0.05 -0.10 0.03 0.00 0.84 0.00 0.00 57.88 58.70 2k9a h LEU 39 Cb 0.50 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.54 2k9a h LEU 39 CO 0.02 0.01 0.02 0.25 -0.34 0.00 0.00 178.44 178.40 2k9a h LEU 40 N -0.29 -0.02 -0.27 2.25 6.46 -1.46 0.48 115.31 122.45 2k9a h LEU 40 Ca -0.02 0.04 0.04 0.00 -0.12 0.00 0.00 57.88 57.82 2k9a h LEU 40 Cb 0.24 0.05 -0.04 0.00 -0.73 0.00 0.00 40.66 40.19 2k9a h LEU 40 CO 0.03 0.02 0.04 -0.61 -0.62 0.00 0.00 178.44 177.30 2k9a h GLN 41 N 0.10 0.13 -0.13 1.25 4.15 -1.17 -2.18 115.11 117.25 2k9a h GLN 41 Ca 0.09 -0.01 -0.09 0.00 0.77 0.00 0.00 58.65 59.42 2k9a h GLN 41 Cb 0.10 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 27.75 2k9a h GLN 41 CO -0.14 0.09 -0.30 0.00 -1.93 0.00 0.00 178.83 176.55 2k9a h ARG 42 N 0.13 0.25 -0.26 1.69 3.08 -1.06 -1.38 114.38 116.83 2k9a h ARG 42 Ca 0.13 -0.09 -0.00 0.00 0.07 0.00 0.00 59.98 60.08 2k9a h ARG 42 Cb 0.14 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 2k9a h ARG 42 CO -0.18 0.53 0.16 -0.91 -1.07 0.00 0.00 179.97 178.50 2k9a h ASN 43 N 0.22 0.32 0.02 7.04 2.35 -0.29 -1.72 115.58 123.52 2k9a h ASN 43 Ca 0.03 -0.06 -0.20 0.00 -0.55 0.00 0.00 56.30 55.53 2k9a h ASN 43 Cb 0.65 -0.08 0.02 0.00 0.05 0.00 0.00 38.32 38.96 2k9a h ASN 43 CO 0.05 0.28 -0.79 -0.26 -1.65 0.00 0.00 177.43 175.06 2k9a h PHE 44 N 0.33 0.75 -0.08 1.19 -1.00 -1.38 -3.20 116.94 113.55 2k9a h PHE 44 Ca 0.09 -0.43 0.02 0.00 2.81 0.00 0.00 57.97 60.47 2k9a h PHE 44 Cb 0.02 -0.08 -0.00 0.00 3.61 0.00 0.00 35.95 39.50 2k9a h PHE 44 CO -0.04 1.26 0.10 0.52 -1.61 0.00 0.00 178.31 178.54 2k9a h MET 45 N 0.03 0.00 -0.08 1.51 2.86 -1.22 0.09 114.93 118.12 2k9a h MET 45 Ca -0.10 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.49 2k9a h MET 45 Cb 1.49 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.14 2k9a h MET 45 CO 0.15 0.00 -0.18 0.22 1.06 0.00 0.00 176.91 178.17 2k9a h ASP 46 N 0.00 0.12 0.09 1.22 1.82 -1.30 -1.35 116.42 117.02 2k9a h ASP 46 Ca 0.04 -0.03 -0.37 0.00 -0.39 0.00 0.00 57.03 56.28 2k9a h ASP 46 Cb 0.24 -0.03 -0.03 0.00 0.68 0.00 0.00 39.33 40.19 2k9a h ASP 46 CO -0.00 0.31 -2.13 1.17 -1.61 0.00 0.00 179.24 176.98 2k9a n LYS 47 N -4.27 0.73 0.14 0.28 0.00 -0.10 -4.15 118.16 110.78 2k9a n LYS 47 Ca -0.01 0.23 -0.14 0.00 0.00 0.00 0.00 58.31 58.39 2k9a n LYS 47 Cb 0.28 -1.65 -0.07 0.00 0.00 0.00 0.00 35.03 33.58 2k9a n LYS 47 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.40 179.28 2k9a h TYR 48 N 0.04 -0.29 0.00 5.64 -1.99 -1.18 -1.90 116.97 117.28 2k9a h TYR 48 Ca -0.47 -0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.26 2k9a h TYR 48 Cb 1.99 0.10 0.00 0.00 2.00 0.00 0.00 36.73 40.82 2k9a h TYR 48 CO 0.06 -0.18 0.03 0.10 -0.00 0.00 0.00 178.16 178.17 2k9a h TYR 49 N -0.29 0.00 0.07 4.88 -0.00 -1.46 -1.55 116.97 118.61 2k9a h TYR 49 Ca -0.02 0.00 -0.10 0.00 -0.00 0.00 0.00 58.73 58.61 2k9a h TYR 49 Cb 0.24 0.00 0.01 0.00 -0.00 0.00 0.00 36.73 36.98 2k9a h TYR 49 CO -0.08 0.00 -0.43 -0.07 -0.00 0.00 0.00 178.16 177.57 2k9a h LEU 50 N 0.00 0.26 -0.77 0.10 3.38 -1.51 -3.33 115.31 113.44 2k9a h LEU 50 Ca 0.00 -0.95 -0.12 0.00 0.09 0.00 0.00 57.88 56.91 2k9a h LEU 50 Cb 0.06 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 2k9a h LEU 50 CO 0.00 1.19 -0.31 -0.33 0.09 0.00 0.00 178.44 179.08 2k9a h GLU 51 N -0.62 0.58 -5.82 1.13 5.08 -1.05 -3.39 114.58 110.50 2k9a h GLU 51 Ca -0.07 -0.25 -0.37 0.00 -1.00 0.00 0.00 59.36 57.66 2k9a h GLU 51 Cb 1.32 -0.02 -0.06 0.00 0.50 0.00 0.00 28.75 30.49 2k9a h GLU 51 CO 0.08 0.82 0.92 -0.06 -1.00 0.00 0.00 179.01 179.78 2k9a s PHE 52 N -4.41 1.94 0.15 4.33 0.40 -0.66 -4.96 117.98 114.77 2k9a s PHE 52 Ca -0.08 0.36 -0.24 0.00 -0.60 0.00 0.00 56.93 56.36 2k9a s PHE 52 Cb 0.13 -4.18 -0.08 0.00 0.51 0.00 0.00 43.02 39.40 2k9a s PHE 52 CO 0.81 -1.83 0.75 -1.21 0.70 0.00 0.00 175.22 174.45 2k9a s GLU 53 N 6.61 4.52 -1.25 0.44 0.41 -1.26 -4.84 118.70 123.33 2k9a s GLU 53 Ca 0.65 1.10 -0.19 0.00 -0.41 0.00 0.00 54.97 56.11 2k9a s GLU 53 Cb -0.06 -3.26 0.01 0.00 -1.78 0.00 0.00 34.13 29.03 2k9a s GLU 53 CO -0.01 0.57 1.86 -0.40 -0.49 0.00 0.00 175.26 176.79 2k9a n ASP 54 N 1.66 4.13 -3.26 -0.19 5.75 -1.26 -4.86 116.55 118.52 2k9a n ASP 54 Ca -0.06 -2.83 -0.17 0.00 -0.01 0.00 0.00 54.79 51.72 2k9a n ASP 54 Cb 0.49 -1.70 -0.06 0.00 -1.03 0.00 0.00 41.12 38.83 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 6.15 0.00 -0.10 2.12 -4.23 -1.26 -5.06 115.64 113.26 2k9a s THR 55 Ca 0.58 -1.76 0.16 0.00 -1.18 0.00 0.00 61.69 59.48 2k9a s THR 55 Cb 0.04 -2.60 -0.18 0.00 1.34 0.00 0.00 72.50 71.11 2k9a s THR 55 CO 0.08 0.00 0.71 -0.62 -0.54 0.00 0.00 174.62 174.25 2k9a n GLU 56 N -0.60 0.63 -1.83 3.99 -0.58 -1.26 -4.93 120.64 116.06 2k9a n GLU 56 Ca 0.04 0.22 -0.34 0.00 -0.42 0.00 0.00 57.16 56.66 2k9a n GLU 56 Cb 0.62 -1.77 0.04 0.00 -0.57 0.00 0.00 31.44 29.76 2k9a n GLU 56 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 2k9a s GLU 57 N -2.80 2.82 0.14 3.49 2.02 -1.26 -5.06 118.70 118.05 2k9a s GLU 57 Ca -0.04 1.55 -0.00 0.00 0.02 0.00 0.00 54.97 56.50 2k9a s GLU 57 Cb 0.08 -1.94 -0.04 0.00 0.10 0.00 0.00 34.13 32.33 2k9a s GLU 57 CO 0.82 -1.27 0.03 0.54 0.02 0.00 0.00 175.26 175.40 2k9a s ASN 58 N -2.19 0.64 0.26 -0.19 2.20 -1.26 -5.05 114.94 109.35 2k9a s ASN 58 Ca 0.71 -1.18 0.01 0.00 -0.94 0.00 0.00 52.86 51.46 2k9a s ASN 58 Cb -0.24 0.23 -0.05 0.00 -2.00 0.00 0.00 41.25 39.19 2k9a s ASN 58 CO 0.38 -0.66 0.10 -0.54 -2.94 0.00 0.00 177.10 173.44 2k9a s LYS 59 N -3.99 1.43 0.19 3.55 1.02 -1.26 -5.04 119.74 115.64 2k9a s LYS 59 Ca 0.23 -1.78 0.26 0.00 0.02 0.00 0.00 55.97 54.71 2k9a s LYS 59 Cb 0.07 -0.23 0.83 0.00 -0.52 0.00 0.00 37.83 37.99 2k9a s LYS 59 CO 0.02 -0.32 1.78 -0.11 -0.92 0.00 0.00 175.35 175.80 2k9a n LEU 60 N -0.47 0.76 0.11 3.17 7.94 -1.26 -3.30 117.00 123.94 2k9a n LEU 60 Ca 0.00 0.57 0.10 0.00 -1.11 0.00 0.00 56.01 55.56 2k9a n LEU 60 Cb 0.66 -0.33 0.44 0.00 0.53 0.00 0.00 43.42 44.73 2k9a n LEU 60 CO 0.37 -0.17 0.79 0.00 -1.11 0.00 0.00 177.39 177.28 2k9a n ILE 61 N -2.21 1.04 0.31 1.96 0.13 -1.26 -1.75 119.36 117.58 2k9a n ILE 61 Ca 0.06 0.42 0.15 0.00 -1.10 0.00 0.00 62.75 62.28 2k9a n ILE 61 Cb 0.42 -1.35 0.55 0.00 -0.84 0.00 0.00 39.64 38.42 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 0.09 9.51 -1.99 -1.99 -2.82 116.97 119.77 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 0.20 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.93 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 1.13 -0.53 -2.88 2.02 -1.60 -2.51 112.91 108.53 2k9a h THR 63 Ca 0.00 -1.36 -0.09 0.00 0.77 0.00 0.00 66.41 65.73 2k9a h THR 63 Cb 0.59 1.93 -0.02 0.00 -1.74 0.00 0.00 68.15 68.91 2k9a h THR 63 CO 0.00 0.31 -0.02 1.55 0.37 0.00 0.00 175.52 177.73 2k9a h PRO 64 N -0.81 0.95 -0.60 6.66 0.13 -1.73 -2.40 132.00 134.22 2k9a h PRO 64 Ca -0.01 -0.31 -0.00 0.00 -0.87 0.00 0.00 66.00 64.81 2k9a h PRO 64 Cb 0.59 -0.08 -0.03 0.00 0.13 0.00 0.00 31.00 31.61 2k9a h PRO 64 CO 0.02 0.97 0.37 0.82 -0.23 0.00 0.00 178.00 179.96 2k9a h ILE 65 N 0.83 1.17 -0.63 -3.56 2.04 -1.62 -0.89 117.51 114.85 2k9a h ILE 65 Ca 0.15 -0.36 -0.02 0.00 1.00 0.00 0.00 64.86 65.63 2k9a h ILE 65 Cb 0.55 0.33 -0.03 0.00 -0.74 0.00 0.00 36.82 36.94 2k9a h ILE 65 CO 0.03 0.17 0.31 0.15 0.00 0.00 0.00 178.15 178.81 2k9a h PHE 66 N 0.81 0.90 0.00 1.37 3.57 -1.35 -1.81 116.94 120.42 2k9a h PHE 66 Ca 0.22 -0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.63 2k9a h PHE 66 Cb -0.04 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 38.41 2k9a h PHE 66 CO -0.02 0.67 -0.21 -0.91 -2.23 0.00 0.00 178.31 175.61 2k9a h ASN 67 N 0.86 0.00 0.35 0.41 2.35 -1.05 -2.32 115.58 116.19 2k9a h ASN 67 Ca 0.22 0.00 -0.17 0.00 -0.55 0.00 0.00 56.30 55.79 2k9a h ASN 67 Cb 0.10 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.47 2k9a h ASN 67 CO -0.03 0.21 -0.72 -0.08 -1.65 0.00 0.00 177.43 175.16 2k9a h GLU 68 N 0.00 0.31 -0.34 0.81 4.81 -0.36 -1.33 114.58 118.48 2k9a h GLU 68 Ca -0.00 -0.25 -0.16 0.00 -0.13 0.00 0.00 59.36 58.81 2k9a h GLU 68 Cb 0.46 0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.89 2k9a h GLU 68 CO 0.03 0.90 -0.42 -0.92 -0.73 0.00 0.00 179.01 177.87 2k9a h TYR 69 N 0.21 1.07 0.00 0.92 3.20 -0.86 0.13 116.97 121.63 2k9a h TYR 69 Ca -0.03 -0.34 -0.13 0.00 3.14 0.00 0.00 58.73 61.37 2k9a h TYR 69 Cb 1.28 -0.22 -0.02 0.00 1.54 0.00 0.00 36.73 39.31 2k9a h TYR 69 CO 0.03 1.16 -0.63 0.82 -1.64 0.00 0.00 178.16 177.90 2k9a h ILE 70 N 0.67 1.39 0.00 1.81 1.08 -1.44 0.66 117.51 121.69 2k9a h ILE 70 Ca 0.04 -2.21 -0.23 0.00 -0.39 0.00 0.00 64.86 62.07 2k9a h ILE 70 Cb 1.01 2.21 -0.04 0.00 -3.07 0.00 0.00 36.82 36.94 2k9a h ILE 70 CO 0.10 0.62 -1.24 -1.28 -0.69 0.00 0.00 178.15 175.66 2k9a h SER 71 N 0.00 0.00 0.00 1.72 0.87 -1.15 -1.07 113.55 113.92 2k9a h SER 71 Ca -0.01 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 2k9a h SER 71 Cb 1.16 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.12 2k9a h SER 71 CO 0.08 0.97 -0.35 -0.11 -0.53 0.00 0.00 176.83 176.89 2k9a n LEU 72 N -3.23 1.16 0.10 2.23 -0.00 0.43 -4.17 117.00 113.52 2k9a n LEU 72 Ca -0.06 0.47 -0.05 0.00 -0.00 0.00 0.00 56.01 56.37 2k9a n LEU 72 Cb 0.97 -0.73 -0.02 0.00 -0.00 0.00 0.00 43.42 43.64 2k9a n LEU 72 CO 0.46 -0.47 0.16 0.58 -0.00 0.00 0.00 177.39 178.11 2k9a h VAL 73 N -0.64 0.00 -0.79 1.96 2.07 -1.07 -2.17 116.25 115.61 2k9a h VAL 73 Ca 0.00 -0.56 0.12 0.00 0.82 0.00 0.00 66.70 67.09 2k9a h VAL 73 Cb 0.35 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.04 2k9a h VAL 73 CO 0.00 0.00 0.39 -0.08 0.02 0.00 0.00 177.57 177.90 2k9a h GLU 74 N -0.87 0.59 -0.29 1.57 4.57 -1.48 -0.03 114.58 118.63 2k9a h GLU 74 Ca -0.03 -0.04 -0.10 0.00 -1.18 0.00 0.00 59.36 58.01 2k9a h GLU 74 Cb 0.24 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 28.69 2k9a h GLU 74 CO 0.05 0.39 -0.24 -0.22 -1.18 0.00 0.00 179.01 177.81 2k9a h LYS 75 N 0.60 0.56 -0.15 1.92 3.64 -1.32 -2.66 116.57 119.17 2k9a h LYS 75 Ca 0.41 -0.22 0.02 0.00 -1.27 0.00 0.00 60.65 59.60 2k9a h LYS 75 Cb 0.53 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.30 2k9a h LYS 75 CO -0.33 0.76 0.00 -0.92 -2.27 0.00 0.00 179.45 176.69 2k9a h TYR 76 N 0.50 -0.00 -0.79 1.91 3.20 -0.33 -0.62 116.97 120.84 2k9a h TYR 76 Ca 0.07 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.93 2k9a h TYR 76 Cb 0.68 0.02 -0.04 0.00 1.54 0.00 0.00 36.73 38.94 2k9a h TYR 76 CO 0.03 -0.01 0.41 0.82 -1.64 0.00 0.00 178.16 177.76 2k9a h ILE 77 N 0.05 1.24 -0.03 1.81 2.04 -1.32 -2.15 117.51 119.16 2k9a h ILE 77 Ca 0.07 -0.64 -0.00 0.00 1.00 0.00 0.00 64.86 65.28 2k9a h ILE 77 Cb 0.08 0.21 -0.00 0.00 -0.74 0.00 0.00 36.82 36.37 2k9a h ILE 77 CO -0.11 0.28 0.02 -0.08 0.00 0.00 0.00 178.15 178.25 2k9a h GLU 78 N 1.11 0.04 -0.27 2.37 4.81 -1.10 -2.27 114.58 119.26 2k9a h GLU 78 Ca 0.28 -0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.51 2k9a h GLU 78 Cb 0.07 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.43 2k9a h GLU 78 CO -0.04 0.10 0.17 0.93 -0.73 0.00 0.00 179.01 179.43 2k9a h GLU 79 N -0.03 0.33 -0.47 1.92 4.39 -0.99 -1.02 114.58 118.70 2k9a h GLU 79 Ca 0.01 -0.02 0.04 0.00 0.34 0.00 0.00 59.36 59.73 2k9a h GLU 79 Cb 0.07 -0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 28.62 2k9a h GLU 79 CO -0.00 0.22 0.32 1.96 -1.16 0.00 0.00 179.01 180.34 2k9a h GLN 80 N 0.34 0.47 0.04 2.33 1.08 -1.31 -1.81 115.11 116.25 2k9a h GLN 80 Ca 0.10 -0.03 -0.23 0.00 -1.45 0.00 0.00 58.65 57.04 2k9a h GLN 80 Cb -0.02 -0.11 -0.00 0.00 -0.05 0.00 0.00 27.48 27.30 2k9a h GLN 80 CO -0.04 0.31 -1.03 -0.07 -0.95 0.00 0.00 178.83 177.06 2k9a h LEU 81 N 0.48 0.41 -1.31 1.46 3.38 -0.88 -3.20 115.31 115.65 2k9a h LEU 81 Ca 0.20 -0.37 -0.04 0.00 0.09 0.00 0.00 57.88 57.76 2k9a h LEU 81 Cb 0.17 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 2k9a h LEU 81 CO -0.05 1.21 -0.19 -0.07 0.09 0.00 0.00 178.44 179.43 2k9a h LEU 82 N 0.14 0.00 -2.17 1.67 3.38 -0.40 0.28 115.31 118.21 2k9a h LEU 82 Ca -0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.88 2k9a h LEU 82 Cb 1.69 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.44 2k9a h LEU 82 CO 0.17 0.19 0.00 1.56 0.09 0.00 0.00 178.44 180.45 2k9a h GLN 83 N 0.00 0.00 0.00 1.13 4.20 -1.37 -3.06 115.11 116.01 2k9a h GLN 83 Ca -0.00 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.63 2k9a h GLN 83 Cb 0.65 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.41 2k9a h GLN 83 CO 0.02 0.00 -1.30 -2.13 -0.67 0.00 0.00 178.83 174.76 2k9a n ARG 84 N -2.95 3.02 -3.75 1.46 3.00 -0.98 -4.91 116.66 111.55 2k9a n ARG 84 Ca -0.01 0.00 -0.30 0.00 -0.00 0.00 0.00 57.85 57.54 2k9a n ARG 84 Cb 0.16 -1.11 -0.13 0.00 0.00 0.00 0.00 32.46 31.38 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 -2.10 1.50 -1.56 5.15 1.01 0.05 -4.96 121.20 120.29 2k9a s ILE 85 Ca -0.03 -2.51 0.15 0.00 0.00 0.00 0.00 60.65 58.27 2k9a s ILE 85 Cb 0.01 -2.06 0.31 0.00 0.01 0.00 0.00 42.46 40.73 2k9a s ILE 85 CO 0.17 -0.85 1.41 -0.81 0.00 0.00 0.00 174.94 174.86 2k9a n PRO 86 N 3.66 0.28 -0.28 2.79 -0.04 -1.19 -1.91 135.00 138.32 2k9a n PRO 86 Ca 0.07 0.11 0.07 0.00 -0.04 0.00 0.00 63.50 63.70 2k9a n PRO 86 Cb 0.35 -1.50 0.19 0.00 -0.04 0.00 0.00 33.50 32.50 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 -1.22 2.88 -2.76 0.54 1.02 -1.26 -5.01 120.64 114.82 2k9a n GLU 87 Ca 0.08 -2.35 -0.35 0.00 -0.02 0.00 0.00 57.16 54.52 2k9a n GLU 87 Cb 0.11 -1.49 -0.06 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 -1.76 3.48 -0.36 -0.32 5.36 -0.80 -5.04 117.98 118.54 2k9a s PHE 88 Ca 0.30 1.70 0.02 0.00 -0.96 0.00 0.00 56.93 57.98 2k9a s PHE 88 Cb 0.21 -2.93 0.11 0.00 -0.34 0.00 0.00 43.02 40.07 2k9a s PHE 88 CO 0.12 -0.05 0.12 -0.80 -1.46 0.00 0.00 175.22 173.16 2k9a s ASN 89 N -1.83 4.20 0.48 6.13 -0.87 -1.26 -4.98 114.94 116.81 2k9a s ASN 89 Ca 0.56 -2.08 0.14 0.00 -1.57 0.00 0.00 52.86 49.91 2k9a s ASN 89 Cb -0.15 -1.18 1.13 0.00 -0.02 0.00 0.00 41.25 41.03 2k9a s ASN 89 CO 0.20 -0.36 2.08 -0.03 -2.57 0.00 0.00 177.10 176.42 2k9a h MET 90 N 7.57 0.21 -0.00 -0.60 4.05 -1.96 0.14 114.93 124.33 2k9a h MET 90 Ca -0.08 -0.01 -0.00 0.00 -0.28 0.00 0.00 59.70 59.33 2k9a h MET 90 Cb 0.99 -0.05 0.00 0.00 -0.80 0.00 0.00 31.60 31.74 2k9a h MET 90 CO 0.50 0.14 -0.01 0.00 0.23 0.00 0.00 176.91 177.77 2k9a h ALA 91 N 1.86 0.00 0.00 0.39 0.00 -2.00 -2.57 119.26 116.94 2k9a h ALA 91 Ca 0.11 -0.33 -0.05 0.00 0.00 0.00 0.00 54.91 54.64 2k9a h ALA 91 Cb 0.16 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 2k9a h ALA 91 CO -0.02 -0.17 -0.26 0.00 0.00 0.00 0.00 179.25 178.80 2k9a h ALA 92 N 0.35 1.21 -0.11 0.00 0.00 -1.91 -2.69 119.26 116.12 2k9a h ALA 92 Ca -0.00 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.61 2k9a h ALA 92 Cb 0.66 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 2k9a h ALA 92 CO 0.00 0.33 -0.17 0.35 0.00 0.00 0.00 179.25 179.76 2k9a h PHE 93 N 0.00 0.39 -0.69 0.00 3.57 -0.75 -2.73 116.94 116.73 2k9a h PHE 93 Ca -0.00 -0.13 -0.04 0.00 3.53 0.00 0.00 57.97 61.33 2k9a h PHE 93 Cb 0.61 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 39.24 2k9a h PHE 93 CO 0.00 0.78 0.28 1.79 -2.23 0.00 0.00 178.31 178.92 2k9a h THR 94 N -0.11 1.24 -0.21 4.41 1.35 -1.35 0.73 112.91 118.97 2k9a h THR 94 Ca 0.01 -0.76 0.02 0.00 -0.55 0.00 0.00 66.41 65.13 2k9a h THR 94 Cb 0.74 0.46 -0.02 0.00 -1.73 0.00 0.00 68.15 67.60 2k9a h THR 94 CO 0.04 0.30 0.07 0.74 -0.25 0.00 0.00 175.52 176.43 2k9a h THR 95 N 0.98 0.96 0.00 6.82 2.02 -1.51 -2.07 112.91 120.10 2k9a h THR 95 Ca 0.23 -0.06 -0.11 0.00 0.77 0.00 0.00 66.41 67.24 2k9a h THR 95 Cb 0.20 0.77 -0.02 0.00 -1.74 0.00 0.00 68.15 67.37 2k9a h THR 95 CO -0.02 0.03 -0.51 0.74 0.37 0.00 0.00 175.52 176.14 2k9a h THR 96 N 0.17 1.34 -0.65 3.16 2.02 -1.32 -3.00 112.91 114.63 2k9a h THR 96 Ca 0.09 -1.74 -0.00 0.00 0.77 0.00 0.00 66.41 65.52 2k9a h THR 96 Cb 0.05 1.95 -0.03 0.00 -1.74 0.00 0.00 68.15 68.38 2k9a h THR 96 CO -0.09 0.49 0.40 0.25 0.37 0.00 0.00 175.52 176.95 2k9a h LEU 97 N 0.00 0.77 -1.47 2.58 6.46 -0.19 -2.19 115.31 121.28 2k9a h LEU 97 Ca -0.01 -0.04 0.22 0.00 -0.12 0.00 0.00 57.88 57.94 2k9a h LEU 97 Cb 0.91 -0.19 -0.07 0.00 -0.73 0.00 0.00 40.66 40.57 2k9a h LEU 97 CO 0.07 0.59 0.63 1.56 -0.62 0.00 0.00 178.44 180.66 2k9a h GLN 98 N 0.90 0.40 0.19 1.25 4.20 -1.27 0.37 115.11 121.14 2k9a h GLN 98 Ca 0.24 -0.02 -0.29 0.00 0.06 0.00 0.00 58.65 58.63 2k9a h GLN 98 Cb -0.04 -0.09 0.02 0.00 0.30 0.00 0.00 27.48 27.67 2k9a h GLN 98 CO -0.05 0.26 -1.36 0.45 -0.67 0.00 0.00 178.83 177.47 2k9a h HIS 99 N 0.41 0.71 0.00 2.96 3.86 -1.57 -3.25 115.15 118.26 2k9a h HIS 99 Ca 0.51 -0.52 0.00 0.00 -1.16 0.00 0.00 60.37 59.20 2k9a h HIS 99 Cb 1.28 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 29.72 2k9a h HIS 99 CO -0.00 1.52 0.00 0.72 0.86 0.00 0.00 177.93 181.03 2k9a n HIS 100 N -3.84 0.00 0.30 2.45 8.25 -0.25 -2.67 115.22 119.47 2k9a n HIS 100 Ca -0.19 0.00 0.18 0.00 -0.26 0.00 0.00 57.72 57.44 2k9a n HIS 100 Cb 0.99 -0.04 0.82 0.00 1.12 0.00 0.00 29.99 32.88 2k9a n HIS 100 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 2k9a h LYS 101 N 0.00 0.00 -0.00 -0.41 3.64 -0.38 -0.16 116.57 119.26 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 0.03 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.85 2k9a h LYS 101 CO 0.00 0.00 -0.02 -0.25 -2.27 0.00 0.00 179.45 176.91 2k9a n ASP 102 N -2.91 0.07 0.04 4.20 9.92 -1.09 -4.31 116.55 122.47 2k9a n ASP 102 Ca -0.00 -0.12 -0.00 0.00 -0.53 0.00 0.00 54.79 54.13 2k9a n ASP 102 Cb 0.20 -0.27 -0.00 0.00 -0.64 0.00 0.00 41.12 40.41 2k9a n ASP 102 CO 0.00 0.00 0.00 1.21 0.13 0.00 0.00 177.20 178.54 2k9a n GLU 103 N -1.28 0.01 -0.75 -1.24 2.13 -0.42 -5.07 120.64 114.04 2k9a n GLU 103 Ca 0.13 0.01 -0.32 0.00 0.66 0.00 0.00 57.16 57.64 2k9a n GLU 103 Cb 0.26 -0.51 0.14 0.00 0.27 0.00 0.00 31.44 31.60 2k9a n GLU 103 CO 0.00 0.00 0.00 1.55 -0.41 0.00 0.00 177.13 178.27 2k9a n VAL 104 N -3.49 0.05 -1.60 6.31 3.14 -0.21 -4.79 118.33 117.74 2k9a n VAL 104 Ca -0.00 -0.10 -0.41 0.00 -2.96 0.00 0.00 64.34 60.86 2k9a n VAL 104 Cb 0.01 -0.81 -0.03 0.00 -1.06 0.00 0.00 33.84 31.95 2k9a n VAL 104 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2k9a s ALA 105 N -2.50 2.39 0.40 1.55 0.00 -1.26 -4.82 121.76 117.52 2k9a s ALA 105 Ca 0.62 0.53 0.13 0.00 0.00 0.00 0.00 51.96 53.23 2k9a s ALA 105 Cb -0.22 -4.16 0.84 0.00 0.00 0.00 0.00 23.12 19.58 2k9a s ALA 105 CO 0.63 -3.31 1.90 0.78 0.00 0.00 0.00 175.76 175.76 2k9a h GLY 106 N 16.45 0.05 1.36 0.00 0.00 -1.87 -2.65 103.07 116.42 2k9a h GLY 106 Ca -0.36 -0.03 -0.04 0.00 0.00 0.00 0.00 47.33 46.90 2k9a h GLY 106 CO 1.02 0.03 0.16 -1.80 0.00 0.00 0.00 176.54 175.96 2k9a h ASP 107 N 0.04 0.75 0.00 0.19 3.58 -1.97 0.84 116.42 119.86 2k9a h ASP 107 Ca 0.01 -0.12 -0.00 0.00 0.42 0.00 0.00 57.03 57.34 2k9a h ASP 107 Cb 0.48 -0.19 0.00 0.00 1.72 0.00 0.00 39.33 41.33 2k9a h ASP 107 CO 0.03 0.72 -0.00 0.40 -2.88 0.00 0.00 179.24 177.51 2k9a h ILE 108 N 0.79 1.55 0.00 2.25 2.04 -1.88 -3.25 117.51 119.02 2k9a h ILE 108 Ca 0.18 -1.66 -0.04 0.00 1.00 0.00 0.00 64.86 64.34 2k9a h ILE 108 Cb 0.24 2.67 -0.01 0.00 -0.74 0.00 0.00 36.82 38.99 2k9a h ILE 108 CO -0.01 0.43 -0.19 0.15 0.00 0.00 0.00 178.15 178.53 2k9a h PHE 109 N -0.72 0.00 -1.09 1.37 3.57 -1.45 -2.66 116.94 115.96 2k9a h PHE 109 Ca -0.00 0.00 0.31 0.00 3.53 0.00 0.00 57.97 61.80 2k9a h PHE 109 Cb 0.71 0.00 -0.06 0.00 2.79 0.00 0.00 35.95 39.38 2k9a h PHE 109 CO 0.17 0.19 0.76 0.22 -2.23 0.00 0.00 178.31 177.43 2k9a h ASP 110 N 0.00 0.16 -0.05 0.41 3.58 -0.85 0.32 116.42 120.00 2k9a h ASP 110 Ca -0.00 0.03 -0.05 0.00 0.42 0.00 0.00 57.03 57.43 2k9a h ASP 110 Cb 0.38 0.01 0.00 0.00 1.72 0.00 0.00 39.33 41.43 2k9a h ASP 110 CO 0.03 0.03 -0.16 -0.03 -2.88 0.00 0.00 179.24 176.23 2k9a h MET 111 N 0.14 0.20 0.00 0.28 4.05 -1.62 -3.14 114.93 114.85 2k9a h MET 111 Ca 0.56 -0.14 -0.02 0.00 -0.28 0.00 0.00 59.70 59.82 2k9a h MET 111 Cb 1.92 0.02 -0.00 0.00 -0.80 0.00 0.00 31.60 32.74 2k9a h MET 111 CO -0.12 0.76 -0.08 -0.07 0.23 0.00 0.00 176.91 177.64 2k9a h LEU 112 N -0.33 0.00 -1.86 3.39 3.38 -0.73 -2.80 115.31 116.35 2k9a h LEU 112 Ca -0.00 0.00 0.18 0.00 0.09 0.00 0.00 57.88 58.15 2k9a h LEU 112 Cb 0.78 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.50 2k9a h LEU 112 CO 0.03 0.08 0.61 -0.07 0.09 0.00 0.00 178.44 179.18 2k9a h LEU 113 N 0.00 0.00 0.00 1.67 3.38 -0.48 0.10 115.31 119.98 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 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 2k9a h LEU 113 CO 0.01 0.00 0.08 0.35 0.09 0.00 0.00 178.44 178.97 2k9a n THR 114 N -3.76 0.94 0.09 0.22 -2.24 -1.06 -1.70 114.28 106.77 2k9a n THR 114 Ca 0.13 0.31 0.01 0.00 -2.27 0.00 0.00 64.05 62.23 2k9a n THR 114 Cb 0.85 -1.31 0.34 0.00 -2.10 0.00 0.00 70.33 68.10 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 0.32 0.00 4.78 0.04 -1.25 -3.40 116.94 117.43 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 0.15 -0.09 0.00 0.00 2.20 0.00 0.00 35.95 38.22 2k9a h PHE 115 CO 0.00 0.45 -0.26 0.25 -0.60 0.00 0.00 178.31 178.15 2k9a n THR 116 N -4.23 0.00 -1.73 -1.55 -2.24 -0.69 -5.00 114.28 98.84 2k9a n THR 116 Ca -0.00 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.55 2k9a n THR 116 Cb 0.30 -0.33 -0.06 0.00 -2.10 0.00 0.00 70.33 68.15 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 -3.80 4.40 0.58 3.42 2.15 -0.69 -4.76 116.67 117.97 2k9a s ASP 117 Ca 0.00 0.05 0.30 0.00 0.43 0.00 0.00 52.55 53.33 2k9a s ASP 117 Cb 0.00 -2.54 1.80 0.00 -0.30 0.00 0.00 42.92 41.88 2k9a s ASP 117 CO 0.00 -3.32 2.23 0.15 -0.17 0.00 0.00 175.17 174.07 2k9a h PHE 118 N 13.62 0.00 -0.45 -5.34 3.57 -1.87 -1.80 116.94 124.68 2k9a h PHE 118 Ca -0.03 0.00 -0.12 0.00 3.53 0.00 0.00 57.97 61.35 2k9a h PHE 118 Cb 1.06 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.78 2k9a h PHE 118 CO 1.13 0.02 -0.18 -0.07 -2.23 0.00 0.00 178.31 176.99 2k9a h LEU 119 N 0.00 0.89 -0.32 0.59 -0.00 -1.97 -2.49 115.31 112.01 2k9a h LEU 119 Ca -0.00 -0.31 -0.18 0.00 -0.00 0.00 0.00 57.88 57.39 2k9a h LEU 119 Cb 0.06 -0.24 -0.02 0.00 -0.00 0.00 0.00 40.66 40.46 2k9a h LEU 119 CO 0.00 1.05 -0.85 0.00 -0.00 0.00 0.00 178.44 178.65 2k9a h ALA 120 N 1.02 0.60 0.38 1.53 0.00 -1.71 -2.55 119.26 118.53 2k9a h ALA 120 Ca 0.11 -0.75 -0.02 0.00 0.00 0.00 0.00 54.91 54.25 2k9a h ALA 120 Cb 0.71 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.39 2k9a h ALA 120 CO 0.05 1.01 -0.18 0.35 0.00 0.00 0.00 179.25 180.48 2k9a h PHE 121 N 0.03 -0.48 0.05 0.00 3.57 -1.30 -1.01 116.94 117.80 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 1.48 0.16 0.00 0.00 2.79 0.00 0.00 35.95 40.38 2k9a h PHE 121 CO 0.01 -0.19 -0.02 -0.22 -2.23 0.00 0.00 178.31 175.65 2k9a h LYS 122 N -0.70 -0.07 -0.55 1.11 3.64 -1.54 -2.78 116.57 115.68 2k9a h LYS 122 Ca -0.05 0.00 0.12 0.00 -1.27 0.00 0.00 60.65 59.45 2k9a h LYS 122 Cb 0.49 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.30 2k9a h LYS 122 CO 0.09 0.18 0.38 1.49 -2.27 0.00 0.00 179.45 179.31 2k9a h GLU 123 N -0.31 0.23 -0.15 1.90 4.81 -1.51 -1.58 114.58 117.97 2k9a h GLU 123 Ca -0.01 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.19 2k9a h GLU 123 Cb 0.28 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.60 2k9a h GLU 123 CO 0.01 0.15 0.02 1.98 -0.73 0.00 0.00 179.01 180.45 2k9a h MET 124 N 0.24 0.26 -0.10 1.92 4.05 -0.91 -1.73 114.93 118.65 2k9a h MET 124 Ca 0.26 -0.07 -0.00 0.00 -0.28 0.00 0.00 59.70 59.60 2k9a h MET 124 Cb 0.70 -0.03 -0.00 0.00 -0.80 0.00 0.00 31.60 31.47 2k9a h MET 124 CO -0.05 0.45 0.04 0.74 0.23 0.00 0.00 176.91 178.32 2k9a h PHE 125 N 0.03 0.15 -0.99 1.39 0.04 -1.09 -1.90 116.94 114.58 2k9a h PHE 125 Ca 0.05 -0.01 0.07 0.00 2.80 0.00 0.00 57.97 60.87 2k9a h PHE 125 Cb 0.31 -0.05 -0.07 0.00 2.20 0.00 0.00 35.95 38.35 2k9a h PHE 125 CO 0.02 0.24 0.64 -0.07 -0.60 0.00 0.00 178.31 178.54 2k9a h LEU 126 N 0.02 1.02 -1.14 1.54 4.07 -1.36 -0.63 115.31 118.83 2k9a h LEU 126 Ca 0.03 0.01 -0.08 0.00 0.08 0.00 0.00 57.88 57.92 2k9a h LEU 126 Cb 0.14 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 41.67 2k9a h LEU 126 CO -0.00 0.65 -0.30 -0.78 -1.08 0.00 0.00 178.44 176.92 2k9a h ASP 127 N 1.15 0.21 -0.46 -0.43 3.58 -1.11 -2.07 116.42 117.30 2k9a h ASP 127 Ca 0.43 -0.07 -0.04 0.00 0.42 0.00 0.00 57.03 57.76 2k9a h ASP 127 Cb 0.18 -0.06 -0.02 0.00 1.72 0.00 0.00 39.33 41.15 2k9a h ASP 127 CO -0.17 0.52 0.13 0.22 -2.88 0.00 0.00 179.24 177.06 2k9a h TYR 128 N 0.19 0.75 -0.16 0.28 3.20 -0.30 -2.42 116.97 118.51 2k9a h TYR 128 Ca 0.03 -0.08 -0.13 0.00 3.14 0.00 0.00 58.73 61.68 2k9a h TYR 128 Cb 0.64 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.68 2k9a h TYR 128 CO 0.01 0.68 -0.45 -0.09 -1.64 0.00 0.00 178.16 176.67 2k9a h ARG 129 N 0.61 0.39 -0.51 1.82 2.43 -1.25 -2.97 114.38 114.90 2k9a h ARG 129 Ca 0.15 -0.21 -0.02 0.00 -0.81 0.00 0.00 59.98 59.08 2k9a h ARG 129 Cb 0.30 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.83 2k9a h ARG 129 CO -0.00 0.77 0.23 0.00 -1.51 0.00 0.00 179.97 179.46 2k9a h ALA 130 N 1.20 1.44 0.00 2.80 0.00 -1.13 -1.39 119.26 122.18 2k9a h ALA 130 Ca 0.02 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 2k9a h ALA 130 Cb 0.93 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 2k9a h ALA 130 CO 0.08 0.44 -0.14 0.93 0.00 0.00 0.00 179.25 180.55 2k9a h GLU 131 N 0.72 0.00 0.00 0.00 4.39 -1.28 -2.48 114.58 115.94 2k9a h GLU 131 Ca 0.18 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.88 2k9a h GLU 131 Cb 0.10 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.75 2k9a h GLU 131 CO -0.02 0.14 0.00 0.87 -1.16 0.00 0.00 179.01 178.84 2k9a h LYS 132 N 0.00 0.00 -0.01 2.33 1.79 -1.23 -1.88 116.57 117.57 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 0.61 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.26 2k9a h LYS 132 CO 0.02 0.00 -0.50 0.39 -1.08 0.00 0.00 179.45 178.28 2k9a n GLU 133 N -2.69 1.28 -1.25 3.15 1.02 -0.94 -4.36 120.64 116.84 2k9a n GLU 133 Ca 0.01 -0.79 -0.25 0.00 -0.02 0.00 0.00 57.16 56.11 2k9a n GLU 133 Cb 0.23 -1.40 0.14 0.00 -0.02 0.00 0.00 31.44 30.39 2k9a n GLU 133 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2k9a n GLY 134 N 1.34 5.14 0.10 0.62 0.00 -0.71 -4.48 105.19 107.20 2k9a n GLY 134 Ca 0.08 -1.62 -0.07 0.00 0.00 0.00 0.00 46.02 44.40 2k9a n GLY 134 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2k9a h ARG 135 N 1.41 0.08 0.00 1.61 3.08 -1.76 -3.50 114.38 115.30 2k9a h ARG 135 Ca 0.56 -0.10 0.00 0.00 0.07 0.00 0.00 59.98 60.51 2k9a h ARG 135 Cb 1.92 0.03 0.00 0.00 0.08 0.00 0.00 29.97 32.01 2k9a h ARG 135 CO 1.16 0.93 0.00 0.41 -1.07 0.00 0.00 179.97 181.39