#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kw9 n PRO 2 N 0.00 3.49 -2.39 0.00 -0.04 -1.26 -4.88 135.00 129.93 3kw9 n PRO 2 Ca 0.00 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 63.09 3kw9 n PRO 2 Cb 0.00 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.43 3kw9 n PRO 2 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 3kw9 s ASP 3 N -1.00 6.11 0.34 3.54 3.68 -1.26 -4.85 116.67 123.23 3kw9 s ASP 3 Ca 0.00 -1.76 -0.18 0.00 2.13 0.00 0.00 52.55 52.74 3kw9 s ASP 3 Cb 0.00 -2.58 0.05 0.00 -1.45 0.00 0.00 42.92 38.94 3kw9 s ASP 3 CO 0.00 -1.90 0.79 -0.94 0.13 0.00 0.00 175.17 173.25 3kw9 s SER 4 N 5.46 -0.07 -0.11 -0.34 1.04 -1.26 -4.65 113.70 113.77 3kw9 s SER 4 Ca 0.57 -0.95 -0.24 0.00 0.48 0.00 0.00 55.95 55.81 3kw9 s SER 4 Cb 0.00 0.79 0.06 0.00 0.10 0.00 0.00 66.02 66.97 3kw9 s SER 4 CO 0.03 -1.53 0.58 0.54 0.98 0.00 0.00 173.24 173.84 3kw9 s VAL 5 N -2.76 0.01 -0.29 5.02 0.11 -0.68 -4.99 120.40 116.82 3kw9 s VAL 5 Ca 0.15 -0.09 -0.04 0.00 -2.93 0.00 0.00 61.98 59.07 3kw9 s VAL 5 Cb -0.05 -0.87 0.10 0.00 -1.53 0.00 0.00 36.38 34.03 3kw9 s VAL 5 CO 0.10 -0.05 0.13 -0.62 -3.33 0.00 0.00 175.10 171.32 3kw9 s ASP 6 N -0.66 3.58 0.11 3.54 -1.08 -1.26 -0.93 116.67 119.96 3kw9 s ASP 6 Ca -0.07 -1.33 0.14 0.00 -0.52 0.00 0.00 52.55 50.77 3kw9 s ASP 6 Cb -0.03 -0.40 0.65 0.00 -1.46 0.00 0.00 42.92 41.68 3kw9 s ASP 6 CO 0.06 -0.44 1.45 -1.22 0.52 0.00 0.00 175.17 175.54 3kw9 n TYR 7 N 5.20 0.31 -0.01 -5.34 4.01 -0.32 -2.50 117.16 118.51 3kw9 n TYR 7 Ca -0.06 0.13 -0.00 0.00 -0.16 0.00 0.00 57.90 57.82 3kw9 n TYR 7 Cb 0.42 -0.71 0.29 0.00 -0.31 0.00 0.00 39.34 39.03 3kw9 n TYR 7 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3kw9 h ARG 8 N 0.00 0.54 -0.01 -0.72 3.08 -1.93 -1.94 114.38 113.39 3kw9 h ARG 8 Ca 0.00 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 59.94 3kw9 h ARG 8 Cb 0.19 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.16 3kw9 h ARG 8 CO 0.00 0.56 0.00 1.63 -1.07 0.00 0.00 179.97 181.09 3kw9 n LYS 9 N -4.28 1.19 -0.07 0.04 5.02 -1.04 -3.72 118.16 115.30 3kw9 n LYS 9 Ca 0.02 -0.27 0.04 0.00 -2.02 0.00 0.00 58.31 56.07 3kw9 n LYS 9 Cb 0.25 -1.46 0.08 0.00 -0.02 0.00 0.00 35.03 33.87 3kw9 n LYS 9 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3kw9 n LYS 10 N -0.64 1.70 -1.06 1.97 5.02 -0.74 -4.98 118.16 119.42 3kw9 n LYS 10 Ca 0.21 -1.50 -0.02 0.00 -2.02 0.00 0.00 58.31 54.98 3kw9 n LYS 10 Cb 0.17 -1.18 -0.01 0.00 -0.02 0.00 0.00 35.03 34.00 3kw9 n LYS 10 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3kw9 n GLY 11 N 0.33 0.55 0.48 0.72 0.00 -1.21 -4.90 105.19 101.15 3kw9 n GLY 11 Ca 0.07 -0.65 0.12 0.00 0.00 0.00 0.00 46.02 45.56 3kw9 n GLY 11 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3kw9 n TYR 12 N -2.90 0.00 -4.73 1.61 4.02 -1.14 -4.78 117.16 109.25 3kw9 n TYR 12 Ca -0.02 0.00 -0.26 0.00 -0.01 0.00 0.00 57.90 57.61 3kw9 n TYR 12 Cb 0.08 -0.04 -0.17 0.00 -0.02 0.00 0.00 39.34 39.20 3kw9 n TYR 12 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 3kw9 s VAL 13 N -2.36 1.34 0.70 -0.72 1.01 -1.25 -4.05 120.40 115.07 3kw9 s VAL 13 Ca 0.24 -0.60 -0.07 0.00 0.00 0.00 0.00 61.98 61.55 3kw9 s VAL 13 Cb 0.19 -1.20 0.05 0.00 0.00 0.00 0.00 36.38 35.42 3kw9 s VAL 13 CO 0.49 0.40 1.03 0.42 0.00 0.00 0.00 175.10 177.44 3kw9 s THR 14 N 0.59 2.49 0.72 3.92 -4.23 -1.26 -4.95 115.64 112.91 3kw9 s THR 14 Ca -0.16 -0.16 -0.16 0.00 -1.18 0.00 0.00 61.69 60.04 3kw9 s THR 14 Cb -0.16 -3.09 0.02 0.00 1.34 0.00 0.00 72.50 70.61 3kw9 s THR 14 CO 0.05 -0.10 1.13 -2.65 -0.54 0.00 0.00 174.62 172.51 3kw9 n PRO 15 N -2.93 0.63 -2.07 3.99 -0.02 -1.26 -4.92 135.00 128.42 3kw9 n PRO 15 Ca 0.07 0.28 -0.41 0.00 -2.02 0.00 0.00 63.50 61.42 3kw9 n PRO 15 Cb 0.60 -2.37 -0.02 0.00 -0.02 0.00 0.00 33.50 31.68 3kw9 n PRO 15 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3kw9 s VAL 16 N -1.74 2.78 0.43 -1.45 1.01 -1.26 -5.03 120.40 115.14 3kw9 s VAL 16 Ca 0.76 0.67 0.07 0.00 0.00 0.00 0.00 61.98 63.49 3kw9 s VAL 16 Cb -0.35 -3.43 -0.02 0.00 0.00 0.00 0.00 36.38 32.58 3kw9 s VAL 16 CO 0.47 0.11 0.33 -0.54 0.00 0.00 0.00 175.10 175.47 3kw9 s LYS 17 N -0.52 2.42 -0.20 2.72 -0.14 -1.26 -4.48 119.74 118.27 3kw9 s LYS 17 Ca 0.57 -1.67 0.00 0.00 -1.36 0.00 0.00 55.97 53.52 3kw9 s LYS 17 Cb -0.40 -2.24 0.05 0.00 -1.68 0.00 0.00 37.83 33.55 3kw9 s LYS 17 CO 0.44 -0.22 -0.07 1.21 -0.76 0.00 0.00 175.35 175.95 3kw9 s ASN 18 N -4.08 3.43 0.47 2.83 3.84 -1.26 -1.10 114.94 119.06 3kw9 s ASN 18 Ca 0.45 -0.94 0.32 0.00 0.21 0.00 0.00 52.86 52.90 3kw9 s ASN 18 Cb -0.01 -1.14 1.45 0.00 -0.55 0.00 0.00 41.25 41.00 3kw9 s ASN 18 CO 0.26 -0.19 1.95 0.06 -2.79 0.00 0.00 177.10 176.39 3kw9 h GLN 19 N 8.00 0.00 0.00 0.43 3.07 -1.41 -3.47 115.11 121.73 3kw9 h GLN 19 Ca -0.23 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.51 3kw9 h GLN 19 Cb 1.09 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.65 3kw9 h GLN 19 CO 0.44 0.00 0.00 0.41 0.09 0.00 0.00 178.83 179.77 3kw9 n GLY 20 N -0.35 0.32 0.17 0.06 0.00 -1.26 -3.52 105.19 100.61 3kw9 n GLY 20 Ca 0.00 -0.91 0.01 0.00 0.00 0.00 0.00 46.02 45.12 3kw9 n GLY 20 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3kw9 h GLN 21 N 0.00 0.00 -6.72 1.61 1.08 -1.93 -3.45 115.11 105.69 3kw9 h GLN 21 Ca 0.00 0.00 -0.53 0.00 -1.45 0.00 0.00 58.65 56.67 3kw9 h GLN 21 Cb 0.00 0.00 0.07 0.00 -0.05 0.00 0.00 27.48 27.50 3kw9 h GLN 21 CO 0.00 0.47 0.88 0.00 -0.95 0.00 0.00 178.83 179.24 3kw9 n GLY 23 N 2.83 4.62 1.49 0.00 0.00 -0.16 -4.59 105.19 109.39 3kw9 n GLY 23 Ca 0.10 -1.75 0.02 0.00 0.00 0.00 0.00 46.02 44.39 3kw9 n GLY 23 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3kw9 n SER 24 N 3.60 4.42 -0.31 1.61 3.41 -1.26 -2.60 113.62 122.48 3kw9 n SER 24 Ca 0.64 -3.16 0.15 0.00 -0.26 0.00 0.00 58.87 56.24 3kw9 n SER 24 Cb 0.28 -0.65 0.39 0.00 -0.26 0.00 0.00 64.21 63.97 3kw9 n SER 24 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3kw9 h TRP 26 N 0.65 0.42 -0.15 0.00 5.08 -1.83 0.12 115.95 120.24 3kw9 h TRP 26 Ca 0.54 -0.03 -0.20 0.00 1.08 0.00 0.00 58.89 60.28 3kw9 h TRP 26 Cb 0.99 -0.13 0.01 0.00 -3.00 0.00 0.00 29.16 27.03 3kw9 h TRP 26 CO -0.00 0.40 -0.70 0.00 -1.28 0.00 0.00 178.44 176.86 3kw9 h ALA 27 N 1.63 0.29 -0.46 0.11 0.00 -1.31 -1.12 119.26 118.41 3kw9 h ALA 27 Ca 0.09 -0.57 -0.13 0.00 0.00 0.00 0.00 54.91 54.30 3kw9 h ALA 27 Cb 0.23 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 3kw9 h ALA 27 CO 0.00 0.61 -0.23 0.74 0.00 0.00 0.00 179.25 180.38 3kw9 h PHE 28 N 0.45 1.08 -0.20 0.00 0.04 -1.14 -0.83 116.94 116.34 3kw9 h PHE 28 Ca -0.04 -0.26 -0.01 0.00 2.80 0.00 0.00 57.97 60.46 3kw9 h PHE 28 Cb 1.33 -0.25 -0.01 0.00 2.20 0.00 0.00 35.95 39.22 3kw9 h PHE 28 CO 0.09 1.07 0.10 1.03 -0.60 0.00 0.00 178.31 180.00 3kw9 h SER 29 N 0.81 0.25 -0.08 2.17 0.87 -0.96 0.26 113.55 116.87 3kw9 h SER 29 Ca 0.10 -0.10 -0.00 0.00 -1.23 0.00 0.00 61.79 60.56 3kw9 h SER 29 Cb 0.79 -0.07 -0.00 0.00 -0.44 0.00 0.00 62.40 62.68 3kw9 h SER 29 CO 0.07 0.28 0.05 0.28 -0.53 0.00 0.00 176.83 176.98 3kw9 h SER 30 N 0.21 0.10 -0.98 6.23 0.02 -1.09 -2.02 113.55 116.02 3kw9 h SER 30 Ca 0.07 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 3kw9 h SER 30 Cb 0.09 -0.02 -0.05 0.00 0.14 0.00 0.00 62.40 62.56 3kw9 h SER 30 CO -0.01 0.11 0.63 0.58 -1.14 0.00 0.00 176.83 177.00 3kw9 h VAL 31 N 0.08 1.26 -0.71 2.27 2.07 -1.03 -0.66 116.25 119.54 3kw9 h VAL 31 Ca 0.03 -0.50 0.03 0.00 0.82 0.00 0.00 66.70 67.09 3kw9 h VAL 31 Cb 0.03 -0.17 -0.05 0.00 -1.52 0.00 0.00 31.29 29.58 3kw9 h VAL 31 CO -0.01 0.26 0.44 1.23 0.02 0.00 0.00 177.57 179.51 3kw9 h GLY 32 N 1.34 1.02 1.08 2.17 0.00 -0.52 0.21 103.07 108.37 3kw9 h GLY 32 Ca 0.36 -0.33 -0.15 0.00 0.00 0.00 0.00 47.33 47.21 3kw9 h GLY 32 CO -0.07 0.27 -0.37 0.00 0.00 0.00 0.00 176.54 176.36 3kw9 h ALA 33 N 1.31 0.51 -0.52 3.60 0.00 -0.79 -2.27 119.26 121.10 3kw9 h ALA 33 Ca 0.29 -0.45 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 3kw9 h ALA 33 Cb 0.03 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 3kw9 h ALA 33 CO -0.12 0.60 0.28 -0.07 0.00 0.00 0.00 179.25 179.95 3kw9 h LEU 34 N 0.65 0.66 -0.68 0.00 3.38 -0.73 -2.26 115.31 116.34 3kw9 h LEU 34 Ca 0.05 -0.10 0.03 0.00 0.09 0.00 0.00 57.88 57.95 3kw9 h LEU 34 Cb 0.97 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 41.51 3kw9 h LEU 34 CO 0.09 0.57 0.42 -0.33 0.09 0.00 0.00 178.44 179.28 3kw9 h GLU 35 N 0.70 0.80 -0.93 1.13 5.08 -0.52 -0.84 114.58 120.00 3kw9 h GLU 35 Ca 0.18 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 3kw9 h GLU 35 Cb 0.06 -0.18 -0.05 0.00 0.50 0.00 0.00 28.75 29.09 3kw9 h GLU 35 CO -0.03 0.53 0.60 0.78 -1.00 0.00 0.00 179.01 179.89 3kw9 h GLY 36 N 0.83 1.33 2.00 -3.84 0.00 -1.05 -1.83 103.07 100.51 3kw9 h GLY 36 Ca 0.27 -0.52 -0.06 0.00 0.00 0.00 0.00 47.33 47.02 3kw9 h GLY 36 CO -0.11 0.51 -0.28 1.46 0.00 0.00 0.00 176.54 178.12 3kw9 h GLN 37 N 1.27 0.00 -0.40 4.80 1.08 -0.86 -1.54 115.11 119.46 3kw9 h GLN 37 Ca 0.34 0.00 -0.14 0.00 -1.45 0.00 0.00 58.65 57.40 3kw9 h GLN 37 Cb -0.11 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.31 3kw9 h GLN 37 CO -0.07 0.28 -0.29 1.25 -0.95 0.00 0.00 178.83 179.06 3kw9 h LEU 38 N 0.00 0.95 -0.39 1.46 5.85 -0.46 -0.88 115.31 121.84 3kw9 h LEU 38 Ca -0.00 -0.44 -0.10 0.00 0.84 0.00 0.00 57.88 58.18 3kw9 h LEU 38 Cb 0.96 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.71 3kw9 h LEU 38 CO 0.04 1.18 -0.14 0.50 -0.34 0.00 0.00 178.44 179.68 3kw9 h LYS 39 N 0.72 0.79 -0.55 1.25 1.63 -1.11 0.52 116.57 119.83 3kw9 h LYS 39 Ca 0.08 -0.33 -0.04 0.00 -0.85 0.00 0.00 60.65 59.51 3kw9 h LYS 39 Cb 0.87 -0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 32.44 3kw9 h LYS 39 CO 0.08 0.95 0.19 -0.22 -3.45 0.00 0.00 179.45 176.99 3kw9 h LYS 40 N 0.60 0.84 0.23 1.90 1.63 -1.16 0.13 116.57 120.74 3kw9 h LYS 40 Ca 0.09 -0.17 -0.30 0.00 -0.85 0.00 0.00 60.65 59.42 3kw9 h LYS 40 Cb 0.68 -0.13 0.03 0.00 -0.60 0.00 0.00 32.23 32.22 3kw9 h LYS 40 CO 0.05 0.75 -1.32 0.87 -3.45 0.00 0.00 179.45 176.35 3kw9 h LYS 41 N 0.76 0.48 0.00 1.90 1.79 -1.12 -3.40 116.57 116.98 3kw9 h LYS 41 Ca 0.18 -0.82 0.00 0.00 -2.18 0.00 0.00 60.65 57.83 3kw9 h LYS 41 Cb 0.25 0.30 0.00 0.00 -1.58 0.00 0.00 32.23 31.21 3kw9 h LYS 41 CO -0.01 1.39 -1.30 0.25 -1.08 0.00 0.00 179.45 178.70 3kw9 n THR 42 N -3.82 0.00 -0.10 -0.16 -2.24 0.17 -4.99 114.28 103.13 3kw9 n THR 42 Ca -0.16 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.35 3kw9 n THR 42 Cb 1.03 0.49 0.00 0.00 -2.10 0.00 0.00 70.33 69.75 3kw9 n THR 42 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kw9 n GLY 43 N 1.52 1.23 3.16 3.38 0.00 0.45 -5.02 105.19 109.91 3kw9 n GLY 43 Ca -0.01 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.85 3kw9 n GLY 43 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kw9 s LYS 44 N -0.55 0.79 0.20 1.61 1.02 -1.26 -4.94 119.74 116.62 3kw9 s LYS 44 Ca 0.00 -1.01 0.03 0.00 0.02 0.00 0.00 55.97 55.01 3kw9 s LYS 44 Cb 0.00 -0.64 -0.05 0.00 -0.52 0.00 0.00 37.83 36.62 3kw9 s LYS 44 CO 0.00 0.12 -0.01 -1.17 -0.92 0.00 0.00 175.35 173.37 3kw9 s LEU 45 N -2.01 2.20 -0.10 3.17 0.20 -1.26 -3.00 118.68 117.88 3kw9 s LEU 45 Ca 0.00 -1.18 -0.21 0.00 0.69 0.00 0.00 54.13 53.43 3kw9 s LEU 45 Cb -0.07 -0.21 0.05 0.00 -0.43 0.00 0.00 46.19 45.53 3kw9 s LEU 45 CO 0.01 -0.51 0.51 -0.22 -0.29 0.00 0.00 176.35 175.86 3kw9 s LEU 46 N -3.25 0.03 -0.03 -0.68 2.96 -1.26 -5.04 118.68 111.41 3kw9 s LEU 46 Ca 0.26 0.67 -0.31 0.00 -0.22 0.00 0.00 54.13 54.53 3kw9 s LEU 46 Cb 0.05 1.89 -0.09 0.00 0.50 0.00 0.00 46.19 48.54 3kw9 s LEU 46 CO 0.06 -0.40 2.00 0.59 -1.32 0.00 0.00 176.35 177.29 3kw9 n ASN 47 N 1.75 3.86 -4.95 3.68 5.03 -1.26 -4.85 115.26 118.52 3kw9 n ASN 47 Ca -0.18 0.80 -0.23 0.00 0.87 0.00 0.00 54.58 55.85 3kw9 n ASN 47 Cb 0.56 -1.50 0.02 0.00 -1.02 0.00 0.00 39.78 37.85 3kw9 n ASN 47 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 3kw9 s LEU 48 N 5.02 3.47 -0.49 3.41 1.43 -1.26 0.02 118.68 130.28 3kw9 s LEU 48 Ca 0.92 0.29 -0.24 0.00 -1.03 0.00 0.00 54.13 54.07 3kw9 s LEU 48 Cb -0.48 -3.15 0.03 0.00 0.03 0.00 0.00 46.19 42.62 3kw9 s LEU 48 CO 0.43 -0.89 0.87 -0.55 0.23 0.00 0.00 176.35 176.44 3kw9 s SER 49 N -4.29 6.41 0.23 2.29 0.15 0.56 -3.96 113.70 115.09 3kw9 s SER 49 Ca 0.52 -0.15 0.00 0.00 0.70 0.00 0.00 55.95 57.02 3kw9 s SER 49 Cb -0.10 -2.42 0.24 0.00 -1.71 0.00 0.00 66.02 62.03 3kw9 s SER 49 CO 0.39 -1.05 1.59 -0.65 1.20 0.00 0.00 173.24 174.73 3kw9 h PRO 50 N 9.11 0.48 -0.87 5.44 0.11 -1.85 -2.96 132.00 141.46 3kw9 h PRO 50 Ca -0.25 -0.26 -0.03 0.00 0.11 0.00 0.00 66.00 65.58 3kw9 h PRO 50 Cb 1.08 0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.16 3kw9 h PRO 50 CO 1.02 0.83 0.44 0.37 -0.21 0.00 0.00 178.00 180.45 3kw9 h GLN 51 N 0.39 1.24 -0.72 1.05 5.75 -1.85 -0.17 115.11 120.80 3kw9 h GLN 51 Ca 0.03 -0.17 0.09 0.00 -0.15 0.00 0.00 58.65 58.45 3kw9 h GLN 51 Cb 0.93 -0.23 -0.07 0.00 1.07 0.00 0.00 27.48 29.18 3kw9 h GLN 51 CO 0.08 0.94 0.36 -0.97 -2.65 0.00 0.00 178.83 176.59 3kw9 h ASN 52 N 1.23 0.47 -0.16 -0.69 -0.00 -1.75 0.14 115.58 114.82 3kw9 h ASN 52 Ca 0.30 0.06 -0.09 0.00 -0.00 0.00 0.00 56.30 56.57 3kw9 h ASN 52 Cb 0.09 -0.02 -0.00 0.00 -0.00 0.00 0.00 38.32 38.39 3kw9 h ASN 52 CO -0.04 0.27 -0.26 -0.07 -0.00 0.00 0.00 177.43 177.33 3kw9 h LEU 53 N 0.61 0.51 -0.41 0.34 3.38 -1.34 -1.16 115.31 117.24 3kw9 h LEU 53 Ca 0.35 -0.53 0.05 0.00 0.09 0.00 0.00 57.88 57.84 3kw9 h LEU 53 Cb 0.37 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.93 3kw9 h LEU 53 CO -0.27 0.94 0.15 0.58 0.09 0.00 0.00 178.44 179.93 3kw9 h VAL 54 N 0.09 0.89 0.00 1.22 2.07 -0.43 -0.79 116.25 119.30 3kw9 h VAL 54 Ca 0.01 -0.11 -0.08 0.00 0.82 0.00 0.00 66.70 67.34 3kw9 h VAL 54 Cb 0.83 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 3kw9 h VAL 54 CO 0.06 0.06 -0.40 0.44 0.02 0.00 0.00 177.57 177.75 3kw9 h ASP 55 N 0.32 0.00 0.00 0.57 3.32 -0.77 -3.39 116.42 116.46 3kw9 h ASP 55 Ca 0.19 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.24 3kw9 h ASP 55 Cb 0.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.71 3kw9 h ASP 55 CO -0.18 0.40 -0.45 0.00 -1.72 0.00 0.00 179.24 177.29 3kw9 s VAL 57 N -1.64 4.58 0.56 0.00 1.01 -0.32 -4.84 120.40 119.75 3kw9 s VAL 57 Ca 0.01 -1.68 0.24 0.00 0.00 0.00 0.00 61.98 60.55 3kw9 s VAL 57 Cb 0.03 -4.90 0.33 0.00 0.00 0.00 0.00 36.38 31.84 3kw9 s VAL 57 CO 0.19 -1.67 2.16 0.28 0.00 0.00 0.00 175.10 176.06 3kw9 h SER 58 N 8.54 0.00 0.83 3.32 0.02 -1.88 -0.74 113.55 123.64 3kw9 h SER 58 Ca 0.23 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.18 3kw9 h SER 58 Cb 0.97 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.51 3kw9 h SER 58 CO 1.24 0.00 0.00 -0.33 -1.14 0.00 0.00 176.83 176.60 3kw9 h GLU 59 N 0.00 0.00 -6.76 3.45 5.08 -1.95 -3.44 114.58 110.96 3kw9 h GLU 59 Ca 0.04 0.00 -0.47 0.00 -1.00 0.00 0.00 59.36 57.93 3kw9 h GLU 59 Cb 0.19 0.00 0.04 0.00 0.50 0.00 0.00 28.75 29.49 3kw9 h GLU 59 CO -0.00 0.00 -0.06 -0.80 -1.00 0.00 0.00 179.01 177.15 3kw9 s ASN 60 N -5.22 4.98 -0.26 1.42 0.02 -0.28 -4.93 114.94 110.66 3kw9 s ASN 60 Ca 0.01 -0.59 0.13 0.00 -1.02 0.00 0.00 52.86 51.39 3kw9 s ASN 60 Cb 0.09 -0.01 0.63 0.00 0.02 0.00 0.00 41.25 41.98 3kw9 s ASN 60 CO 0.48 -1.39 1.61 -0.67 0.02 0.00 0.00 177.10 177.14 3kw9 n ASP 61 N -2.36 4.17 0.00 -1.22 2.03 0.22 -4.99 116.55 114.40 3kw9 n ASP 61 Ca 0.14 -3.22 0.00 0.00 0.52 0.00 0.00 54.79 52.23 3kw9 n ASP 61 Cb 0.61 -0.65 0.00 0.00 -0.72 0.00 0.00 41.12 40.36 3kw9 n ASP 61 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3kw9 n GLY 62 N -0.39 4.03 0.00 0.27 0.00 -1.22 -0.93 105.19 106.94 3kw9 n GLY 62 Ca 0.31 0.04 0.06 0.00 0.00 0.00 0.00 46.02 46.43 3kw9 n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kw9 n GLY 64 N 0.49 3.08 0.00 0.00 0.00 -0.11 -0.99 105.19 107.67 3kw9 n GLY 64 Ca 0.09 -0.81 0.00 0.00 0.00 0.00 0.00 46.02 45.29 3kw9 n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kw9 n GLY 65 N 0.58 1.58 0.00 -0.02 0.00 -1.07 -4.80 105.19 101.47 3kw9 n GLY 65 Ca 0.22 -2.06 0.00 0.00 0.00 0.00 0.00 46.02 44.19 3kw9 n GLY 65 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kw9 n GLY 66 N 1.01 0.78 3.74 -0.02 0.00 -1.26 -0.61 105.19 108.83 3kw9 n GLY 66 Ca 0.00 -0.97 -0.33 0.00 0.00 0.00 0.00 46.02 44.71 3kw9 n GLY 66 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3kw9 s TYR 67 N -2.00 3.21 0.15 1.61 1.51 -1.26 -4.68 117.35 115.90 3kw9 s TYR 67 Ca 0.00 0.18 -0.11 0.00 -1.01 0.00 0.00 57.07 56.13 3kw9 s TYR 67 Cb 0.00 -1.74 0.00 0.00 -0.11 0.00 0.00 41.96 40.12 3kw9 s TYR 67 CO 0.00 0.52 1.56 0.52 -1.11 0.00 0.00 175.55 177.03 3kw9 h MET 68 N 4.42 0.94 -0.87 -0.62 2.86 -1.97 -2.94 114.93 116.76 3kw9 h MET 68 Ca -0.50 -0.38 0.04 0.00 -2.06 0.00 0.00 59.70 56.80 3kw9 h MET 68 Cb 1.18 -0.05 -0.05 0.00 0.06 0.00 0.00 31.60 32.75 3kw9 h MET 68 CO 0.59 1.04 0.57 1.79 1.06 0.00 0.00 176.91 181.96 3kw9 h THR 69 N 0.79 1.14 -0.59 2.22 1.35 -1.96 -0.24 112.91 115.64 3kw9 h THR 69 Ca 0.12 -0.37 -0.01 0.00 -0.55 0.00 0.00 66.41 65.59 3kw9 h THR 69 Cb 0.71 -0.03 -0.03 0.00 -1.73 0.00 0.00 68.15 67.07 3kw9 h THR 69 CO 0.05 0.20 0.31 0.78 -0.25 0.00 0.00 175.52 176.61 3kw9 h ASN 70 N 1.08 0.72 -0.29 5.36 -0.26 -1.95 -0.89 115.58 119.35 3kw9 h ASN 70 Ca 0.34 -0.06 -0.06 0.00 -0.56 0.00 0.00 56.30 55.96 3kw9 h ASN 70 Cb 0.03 -0.18 -0.01 0.00 -1.06 0.00 0.00 38.32 37.10 3kw9 h ASN 70 CO -0.10 0.59 -0.07 0.00 -1.06 0.00 0.00 177.43 176.79 3kw9 h ALA 71 N 1.52 0.39 -0.86 -0.83 0.00 -0.93 -1.93 119.26 116.63 3kw9 h ALA 71 Ca 0.21 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 3kw9 h ALA 71 Cb 0.04 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 3kw9 h ALA 71 CO -0.03 0.21 0.49 0.74 0.00 0.00 0.00 179.25 180.66 3kw9 h PHE 72 N 0.31 1.16 -0.66 0.00 0.04 -0.63 -1.65 116.94 115.51 3kw9 h PHE 72 Ca 0.07 -0.02 -0.06 0.00 2.80 0.00 0.00 57.97 60.77 3kw9 h PHE 72 Cb 0.55 -0.37 -0.03 0.00 2.20 0.00 0.00 35.95 38.30 3kw9 h PHE 72 CO 0.05 0.79 0.18 1.96 -0.60 0.00 0.00 178.31 180.69 3kw9 h GLN 73 N 1.19 1.03 0.10 1.51 4.20 -1.03 -2.16 115.11 119.96 3kw9 h GLN 73 Ca 0.30 -0.22 -0.01 0.00 0.06 0.00 0.00 58.65 58.79 3kw9 h GLN 73 Cb -0.00 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 27.63 3kw9 h GLN 73 CO -0.05 0.90 -0.05 -0.92 -0.67 0.00 0.00 178.83 178.04 3kw9 h TYR 74 N 0.99 -0.13 -0.89 2.96 3.20 -0.80 -0.61 116.97 121.70 3kw9 h TYR 74 Ca 0.21 -0.00 0.11 0.00 3.14 0.00 0.00 58.73 62.19 3kw9 h TYR 74 Cb 0.32 0.04 -0.08 0.00 1.54 0.00 0.00 36.73 38.55 3kw9 h TYR 74 CO 0.02 0.06 0.52 0.28 -1.64 0.00 0.00 178.16 177.41 3kw9 h VAL 75 N -0.30 0.88 0.17 1.81 2.07 -1.14 0.46 116.25 120.20 3kw9 h VAL 75 Ca -0.01 -0.29 -0.01 0.00 0.82 0.00 0.00 66.70 67.21 3kw9 h VAL 75 Cb 0.25 -0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.00 3kw9 h VAL 75 CO 0.02 0.15 -0.08 -0.61 0.02 0.00 0.00 177.57 177.07 3kw9 h GLN 76 N 0.83 -0.22 -0.11 1.57 4.15 -1.16 -0.09 115.11 120.08 3kw9 h GLN 76 Ca 0.44 0.02 -0.10 0.00 0.77 0.00 0.00 58.65 59.78 3kw9 h GLN 76 Cb 0.45 0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.18 3kw9 h GLN 76 CO -0.27 -0.02 -0.37 -0.22 -1.93 0.00 0.00 178.83 176.01 3kw9 h LYS 77 N -0.39 0.22 0.00 1.69 3.64 -0.58 -2.51 116.57 118.65 3kw9 h LYS 77 Ca -0.02 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.26 3kw9 h LYS 77 Cb 0.30 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.11 3kw9 h LYS 77 CO 0.04 0.57 0.00 -1.71 -2.27 0.00 0.00 179.45 176.08 3kw9 n ASN 78 N -4.06 0.34 -2.33 4.20 5.15 0.16 -4.91 115.26 113.81 3kw9 n ASN 78 Ca -0.01 0.54 -0.17 0.00 -0.60 0.00 0.00 54.58 54.33 3kw9 n ASN 78 Cb 0.45 -0.63 0.03 0.00 -0.53 0.00 0.00 39.78 39.10 3kw9 n ASN 78 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 3kw9 n ARG 79 N -1.82 -3.72 0.00 1.20 1.74 -0.42 -4.93 116.66 108.71 3kw9 n ARG 79 Ca 0.06 0.69 0.00 0.00 -0.77 0.00 0.00 57.85 57.83 3kw9 n ARG 79 Cb 0.36 -5.08 0.00 0.00 -1.02 0.00 0.00 32.46 26.71 3kw9 n ARG 79 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3kw9 n GLY 80 N -1.34 4.03 2.98 -0.13 0.00 -0.18 -4.91 105.19 105.63 3kw9 n GLY 80 Ca -0.09 -1.37 -0.17 0.00 0.00 0.00 0.00 46.02 44.40 3kw9 n GLY 80 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3kw9 s ILE 81 N -2.00 0.52 0.71 -0.61 2.07 -0.49 -4.69 121.20 116.71 3kw9 s ILE 81 Ca 0.00 -0.27 -0.11 0.00 -1.41 0.00 0.00 60.65 58.86 3kw9 s ILE 81 Cb 0.00 -0.45 0.02 0.00 0.13 0.00 0.00 42.46 42.16 3kw9 s ILE 81 CO 0.00 0.15 1.07 -1.81 -1.91 0.00 0.00 174.94 172.44 3kw9 s ASP 82 N -0.09 5.18 0.70 4.50 1.01 -1.26 -1.10 116.67 125.60 3kw9 s ASP 82 Ca 0.02 1.70 -0.11 0.00 0.71 0.00 0.00 52.55 54.86 3kw9 s ASP 82 Cb -0.03 -2.51 0.01 0.00 1.01 0.00 0.00 42.92 41.40 3kw9 s ASP 82 CO -0.00 -1.58 1.09 -0.94 0.21 0.00 0.00 175.17 173.95 3kw9 s SER 83 N -3.58 5.51 0.22 0.27 1.04 -1.00 -0.32 113.70 115.85 3kw9 s SER 83 Ca 0.59 1.14 -0.08 0.00 0.48 0.00 0.00 55.95 58.08 3kw9 s SER 83 Cb -0.15 -1.96 0.19 0.00 0.10 0.00 0.00 66.02 64.20 3kw9 s SER 83 CO 0.53 -1.30 1.88 -0.08 0.98 0.00 0.00 173.24 175.25 3kw9 h GLU 84 N -0.62 1.15 -0.74 4.02 4.57 -0.54 -1.66 114.58 120.76 3kw9 h GLU 84 Ca -0.45 -0.09 -0.04 0.00 -1.18 0.00 0.00 59.36 57.60 3kw9 h GLU 84 Cb 1.25 -0.25 -0.03 0.00 -0.16 0.00 0.00 28.75 29.56 3kw9 h GLU 84 CO 0.64 0.79 0.29 -0.44 -1.18 0.00 0.00 179.01 179.11 3kw9 h ASP 85 N 1.17 1.02 1.46 1.04 3.32 -1.93 -0.97 116.42 121.51 3kw9 h ASP 85 Ca 0.31 -0.15 -0.07 0.00 0.02 0.00 0.00 57.03 57.14 3kw9 h ASP 85 Cb -0.08 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.20 3kw9 h ASP 85 CO -0.06 0.90 -0.34 0.00 -1.72 0.00 0.00 179.24 178.02 3kw9 h ALA 86 N 1.24 0.82 -1.89 3.45 0.00 -1.82 -3.38 119.26 117.67 3kw9 h ALA 86 Ca 0.25 -0.31 -0.50 0.00 0.00 0.00 0.00 54.91 54.36 3kw9 h ALA 86 Cb 0.21 -0.05 -0.34 0.00 0.00 0.00 0.00 17.79 17.61 3kw9 h ALA 86 CO -0.02 0.42 -0.92 0.98 0.00 0.00 0.00 179.25 179.71 3kw9 n TYR 87 N -3.24 -1.33 -1.62 0.00 4.19 -0.65 -4.96 117.16 109.54 3kw9 n TYR 87 Ca 0.02 -3.01 -0.39 0.00 3.31 0.00 0.00 57.90 57.83 3kw9 n TYR 87 Cb 0.62 0.34 0.04 0.00 0.49 0.00 0.00 39.34 40.83 3kw9 n TYR 87 CO 0.00 0.00 0.00 -2.30 0.91 0.00 0.00 176.86 175.47 3kw9 n PRO 88 N 2.33 1.14 -2.80 2.98 -0.02 -0.39 -4.52 135.00 133.72 3kw9 n PRO 88 Ca 0.24 0.43 -0.42 0.00 -2.02 0.00 0.00 63.50 61.73 3kw9 n PRO 88 Cb 0.52 -2.15 -0.03 0.00 -0.02 0.00 0.00 33.50 31.81 3kw9 n PRO 88 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 3kw9 s TYR 89 N -1.42 3.48 -0.71 6.00 5.04 -1.26 -4.75 117.35 123.73 3kw9 s TYR 89 Ca 0.70 1.43 0.06 0.00 -2.44 0.00 0.00 57.07 56.82 3kw9 s TYR 89 Cb -0.46 -3.08 0.04 0.00 0.35 0.00 0.00 41.96 38.80 3kw9 s TYR 89 CO 0.51 -0.20 0.65 1.33 -1.34 0.00 0.00 175.55 176.50 3kw9 n VAL 90 N 4.56 0.00 -1.95 3.14 0.24 -1.26 -5.02 118.33 118.04 3kw9 n VAL 90 Ca 0.06 -0.49 -0.14 0.00 -2.04 0.00 0.00 64.34 61.73 3kw9 n VAL 90 Cb 0.49 1.11 -0.03 0.00 -1.47 0.00 0.00 33.84 33.95 3kw9 n VAL 90 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3kw9 n GLY 91 N 0.41 0.42 3.63 7.63 0.00 -1.26 -4.99 105.19 111.04 3kw9 n GLY 91 Ca 0.03 -0.31 -0.11 0.00 0.00 0.00 0.00 46.02 45.63 3kw9 n GLY 91 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3kw9 s GLN 92 N -4.14 0.69 0.29 1.61 -2.07 -1.26 -4.14 119.66 110.64 3kw9 s GLN 92 Ca 0.00 0.90 -0.29 0.00 -1.82 0.00 0.00 55.36 54.14 3kw9 s GLN 92 Cb 0.00 0.30 -0.10 0.00 -1.09 0.00 0.00 33.01 32.12 3kw9 s GLN 92 CO 0.00 -0.09 1.37 -2.00 -1.32 0.00 0.00 175.29 173.24 3kw9 s GLU 93 N 0.59 4.31 0.26 9.60 2.12 -1.26 -4.99 118.70 129.32 3kw9 s GLU 93 Ca -0.01 2.26 0.02 0.00 0.36 0.00 0.00 54.97 57.59 3kw9 s GLU 93 Cb -0.05 -3.09 -0.04 0.00 0.26 0.00 0.00 34.13 31.21 3kw9 s GLU 93 CO -0.05 -0.30 0.14 -1.83 -0.54 0.00 0.00 175.26 172.68 3kw9 s GLU 94 N -1.16 1.42 0.51 4.30 -1.05 -1.26 -5.08 118.70 116.38 3kw9 s GLU 94 Ca 0.54 -1.78 -0.23 0.00 -0.15 0.00 0.00 54.97 53.35 3kw9 s GLU 94 Cb -0.41 0.04 -0.06 0.00 -0.44 0.00 0.00 34.13 33.26 3kw9 s GLU 94 CO 0.49 -0.41 1.30 0.43 0.95 0.00 0.00 175.26 178.01 3kw9 n SER 95 N -0.63 2.47 -4.67 0.83 7.64 -1.26 -4.59 113.62 113.42 3kw9 n SER 95 Ca 0.02 1.00 -0.45 0.00 1.01 0.00 0.00 58.87 60.45 3kw9 n SER 95 Cb 0.65 -1.54 -0.04 0.00 -1.01 0.00 0.00 64.21 62.28 3kw9 n SER 95 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3kw9 n MET 97 N 6.97 1.94 -1.65 0.00 2.00 -1.26 -5.04 117.12 120.08 3kw9 n MET 97 Ca 0.21 -3.02 -0.45 0.00 0.00 0.00 0.00 57.70 54.44 3kw9 n MET 97 Cb 0.35 -1.73 -0.03 0.00 0.00 0.00 0.00 33.22 31.82 3kw9 n MET 97 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 175.97 176.95 3kw9 n TYR 98 N -1.04 2.00 -3.80 2.03 9.36 -1.26 -4.98 117.16 119.47 3kw9 n TYR 98 Ca 0.25 0.48 -0.27 0.00 3.32 0.00 0.00 57.90 61.68 3kw9 n TYR 98 Cb 0.87 -2.42 -0.17 0.00 -0.63 0.00 0.00 39.34 36.99 3kw9 n TYR 98 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 3kw9 s ASN 99 N 0.20 2.68 0.61 2.98 3.84 -1.26 -5.03 114.94 118.97 3kw9 s ASN 99 Ca 0.68 -0.65 0.31 0.00 0.21 0.00 0.00 52.86 53.42 3kw9 s ASN 99 Cb -0.68 -0.69 1.76 0.00 -0.55 0.00 0.00 41.25 41.09 3kw9 s ASN 99 CO 0.51 -0.24 2.10 1.55 -2.79 0.00 0.00 177.10 178.22 3kw9 h PRO 100 N 8.21 0.00 0.00 0.43 0.13 -1.99 -0.72 132.00 138.06 3kw9 h PRO 100 Ca -0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.94 3kw9 h PRO 100 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 3kw9 h PRO 100 CO 0.34 0.00 0.00 1.79 -0.23 0.00 0.00 178.00 179.90 3kw9 h THR 101 N 0.00 0.00 -0.72 1.56 1.35 -2.02 -2.42 112.91 110.67 3kw9 h THR 101 Ca 0.06 -0.44 0.00 0.00 -0.55 0.00 0.00 66.41 65.49 3kw9 h THR 101 Cb 0.48 1.41 0.00 0.00 -1.73 0.00 0.00 68.15 68.31 3kw9 h THR 101 CO -0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 3kw9 n GLY 102 N -0.10 2.45 3.65 5.82 0.00 -0.28 -4.98 105.19 111.76 3kw9 n GLY 102 Ca 0.00 -0.80 -0.47 0.00 0.00 0.00 0.00 46.02 44.75 3kw9 n GLY 102 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3kw9 n LYS 103 N 1.56 1.91 0.00 1.61 4.81 -0.91 -2.37 118.16 124.77 3kw9 n LYS 103 Ca 0.25 0.69 0.00 0.00 -0.87 0.00 0.00 58.31 58.37 3kw9 n LYS 103 Cb 0.66 -2.42 0.00 0.00 0.02 0.00 0.00 35.03 33.29 3kw9 n LYS 103 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3kw9 n ALA 104 N 3.12 1.67 -3.60 3.14 0.00 -0.26 -4.84 120.51 119.74 3kw9 n ALA 104 Ca 0.17 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.30 3kw9 n ALA 104 Cb 0.27 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.71 3kw9 n ALA 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3kw9 s ALA 105 N -0.05 -2.32 0.28 0.00 0.00 -1.21 -4.97 121.76 113.49 3kw9 s ALA 105 Ca 0.00 1.41 -0.14 0.00 0.00 0.00 0.00 51.96 53.22 3kw9 s ALA 105 Cb 0.00 -0.06 0.01 0.00 0.00 0.00 0.00 23.12 23.07 3kw9 s ALA 105 CO 0.00 -0.80 0.59 -1.59 0.00 0.00 0.00 175.76 173.96 3kw9 s LYS 106 N -2.09 1.74 0.07 0.00 -2.85 -1.26 -1.39 119.74 113.95 3kw9 s LYS 106 Ca 0.13 -1.25 -0.11 0.00 -1.00 0.00 0.00 55.97 53.74 3kw9 s LYS 106 Cb 0.03 0.53 0.01 0.00 -2.06 0.00 0.00 37.83 36.34 3kw9 s LYS 106 CO -0.04 -0.76 0.24 0.00 0.10 0.00 0.00 175.35 174.89 3kw9 n ARG 108 N 0.31 2.35 0.00 0.00 1.85 0.54 -4.06 116.66 117.65 3kw9 n ARG 108 Ca -0.17 -3.08 0.00 0.00 -1.00 0.00 0.00 57.85 53.60 3kw9 n ARG 108 Cb 0.61 -1.93 0.00 0.00 -1.05 0.00 0.00 32.46 30.09 3kw9 n ARG 108 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 3kw9 n GLY 109 N -0.89 0.67 3.57 2.89 0.00 -1.25 -4.89 105.19 105.30 3kw9 n GLY 109 Ca 0.36 -2.09 -0.09 0.00 0.00 0.00 0.00 46.02 44.20 3kw9 n GLY 109 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3kw9 s TYR 110 N -1.22 0.08 0.04 1.61 1.13 -1.26 -0.03 117.35 117.70 3kw9 s TYR 110 Ca 0.00 -0.45 0.04 0.00 -1.41 0.00 0.00 57.07 55.25 3kw9 s TYR 110 Cb 0.00 0.33 -0.02 0.00 -1.10 0.00 0.00 41.96 41.17 3kw9 s TYR 110 CO 0.00 -0.97 -0.12 1.03 -2.51 0.00 0.00 175.55 172.98 3kw9 s ARG 111 N -3.94 0.78 -0.08 -3.49 0.52 -0.48 -4.90 118.95 107.36 3kw9 s ARG 111 Ca 0.15 -0.70 0.01 0.00 -0.52 0.00 0.00 55.73 54.67 3kw9 s ARG 111 Cb -0.01 -0.74 -0.03 0.00 0.52 0.00 0.00 34.95 34.69 3kw9 s ARG 111 CO 0.03 0.18 -0.09 -1.21 0.02 0.00 0.00 175.30 174.22 3kw9 s GLU 112 N -1.14 2.90 0.25 3.54 0.41 -1.26 -1.59 118.70 121.82 3kw9 s GLU 112 Ca -0.01 -0.60 -0.30 0.00 -0.41 0.00 0.00 54.97 53.65 3kw9 s GLU 112 Cb -0.08 -2.58 -0.09 0.00 -1.78 0.00 0.00 34.13 29.60 3kw9 s GLU 112 CO 0.01 0.53 1.17 0.42 -0.49 0.00 0.00 175.26 176.90 3kw9 s ILE 113 N -0.46 3.40 0.15 -1.63 1.09 0.31 -4.92 121.20 119.13 3kw9 s ILE 113 Ca 0.06 1.30 -0.34 0.00 -1.10 0.00 0.00 60.65 60.57 3kw9 s ILE 113 Cb -0.12 -3.83 -0.15 0.00 -1.06 0.00 0.00 42.46 37.30 3kw9 s ILE 113 CO 0.02 0.27 1.42 -2.65 -0.10 0.00 0.00 174.94 173.90 3kw9 n PRO 114 N 1.68 1.66 -1.66 2.79 -0.02 -1.26 -4.67 135.00 133.52 3kw9 n PRO 114 Ca 0.01 0.60 -0.51 0.00 -2.02 0.00 0.00 63.50 61.58 3kw9 n PRO 114 Cb 0.44 -2.27 -0.06 0.00 -0.02 0.00 0.00 33.50 31.59 3kw9 n PRO 114 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 3kw9 n GLU 115 N 2.70 1.62 -0.93 -0.52 2.13 -1.26 -1.94 120.64 122.45 3kw9 n GLU 115 Ca 0.16 0.59 0.00 0.00 0.66 0.00 0.00 57.16 58.57 3kw9 n GLU 115 Cb 0.25 -2.32 0.00 0.00 0.27 0.00 0.00 31.44 29.64 3kw9 n GLU 115 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3kw9 n GLY 116 N 3.56 0.84 3.44 8.31 0.00 0.12 -4.95 105.19 116.51 3kw9 n GLY 116 Ca 0.21 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.79 3kw9 n GLY 116 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3kw9 s ASN 117 N -2.83 6.28 0.40 1.61 3.84 -0.82 -4.86 114.94 118.56 3kw9 s ASN 117 Ca 0.00 -1.31 0.21 0.00 0.21 0.00 0.00 52.86 51.97 3kw9 s ASN 117 Cb 0.00 -2.39 0.67 0.00 -0.55 0.00 0.00 41.25 38.97 3kw9 s ASN 117 CO 0.00 -1.30 1.72 -0.33 -2.79 0.00 0.00 177.10 174.40 3kw9 h GLU 118 N 9.33 0.00 -0.33 0.43 5.08 -1.90 -1.80 114.58 125.39 3kw9 h GLU 118 Ca -0.19 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.01 3kw9 h GLU 118 Cb 1.06 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.31 3kw9 h GLU 118 CO 1.15 0.29 -0.43 0.87 -1.00 0.00 0.00 179.01 179.89 3kw9 h LYS 119 N 0.00 0.87 -0.41 2.33 1.79 -1.99 -0.18 116.57 118.98 3kw9 h LYS 119 Ca -0.00 -0.50 -0.11 0.00 -2.18 0.00 0.00 60.65 57.86 3kw9 h LYS 119 Cb 0.92 0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 31.59 3kw9 h LYS 119 CO 0.04 1.14 -0.18 0.00 -1.08 0.00 0.00 179.45 179.37 3kw9 h ALA 120 N 0.72 0.91 -0.59 3.86 0.00 -1.91 -0.96 119.26 121.28 3kw9 h ALA 120 Ca 0.04 -0.35 -0.10 0.00 0.00 0.00 0.00 54.91 54.50 3kw9 h ALA 120 Cb 1.03 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 3kw9 h ALA 120 CO 0.10 0.62 -0.01 1.25 0.00 0.00 0.00 179.25 181.21 3kw9 h LEU 121 N 0.70 1.04 -0.41 0.00 5.85 -1.15 -0.49 115.31 120.85 3kw9 h LEU 121 Ca 0.10 -0.31 -0.00 0.00 0.84 0.00 0.00 57.88 58.51 3kw9 h LEU 121 Cb 0.68 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 3kw9 h LEU 121 CO 0.05 1.10 0.25 0.50 -0.34 0.00 0.00 178.44 180.00 3kw9 h LYS 122 N 0.95 0.56 -0.79 1.25 3.64 -0.68 0.26 116.57 121.76 3kw9 h LYS 122 Ca 0.17 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 59.46 3kw9 h LYS 122 Cb 0.57 -0.12 -0.04 0.00 -0.41 0.00 0.00 32.23 32.24 3kw9 h LYS 122 CO 0.03 0.42 0.37 0.00 -2.27 0.00 0.00 179.45 178.00 3kw9 h ARG 123 N 0.54 1.14 -0.51 1.90 3.08 -0.93 -1.26 114.38 118.36 3kw9 h ARG 123 Ca 0.15 -0.17 -0.12 0.00 0.07 0.00 0.00 59.98 59.91 3kw9 h ARG 123 Cb -0.00 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 29.83 3kw9 h ARG 123 CO -0.03 0.88 -0.16 0.00 -1.07 0.00 0.00 179.97 179.60 3kw9 h ALA 124 N 1.28 0.76 -0.42 0.04 0.00 -0.52 0.57 119.26 120.97 3kw9 h ALA 124 Ca 0.27 -0.37 -0.08 0.00 0.00 0.00 0.00 54.91 54.73 3kw9 h ALA 124 Cb 0.13 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 3kw9 h ALA 124 CO -0.03 0.67 -0.08 0.28 0.00 0.00 0.00 179.25 180.08 3kw9 h VAL 125 N 0.87 1.25 0.00 0.00 2.07 -0.58 0.39 116.25 120.25 3kw9 h VAL 125 Ca 0.13 -1.10 -0.26 0.00 0.82 0.00 0.00 66.70 66.29 3kw9 h VAL 125 Cb 0.72 1.01 0.02 0.00 -1.52 0.00 0.00 31.29 31.53 3kw9 h VAL 125 CO 0.06 0.37 -1.04 0.00 0.02 0.00 0.00 177.57 176.99 3kw9 h ALA 126 N 1.24 0.16 0.00 1.67 0.00 -1.02 -2.99 119.26 118.32 3kw9 h ALA 126 Ca 0.12 -0.70 -0.05 0.00 0.00 0.00 0.00 54.91 54.28 3kw9 h ALA 126 Cb 0.53 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 3kw9 h ALA 126 CO 0.03 0.71 -1.43 0.54 0.00 0.00 0.00 179.25 179.10 3kw9 n ARG 127 N -3.84 0.63 -0.07 0.00 1.74 0.17 -4.65 116.66 110.64 3kw9 n ARG 127 Ca -0.10 0.04 -0.14 0.00 -0.77 0.00 0.00 57.85 56.87 3kw9 n ARG 127 Cb 0.88 -1.72 -0.05 0.00 -1.02 0.00 0.00 32.46 30.55 3kw9 n ARG 127 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3kw9 n VAL 128 N -2.60 1.11 0.00 1.55 0.31 0.13 -5.05 118.33 113.79 3kw9 n VAL 128 Ca -0.04 -0.07 0.00 0.00 -0.01 0.00 0.00 64.34 64.21 3kw9 n VAL 128 Cb 0.64 -1.85 0.00 0.00 -0.91 0.00 0.00 33.84 31.71 3kw9 n VAL 128 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3kw9 n GLY 129 N 2.02 0.74 3.63 2.92 0.00 -1.07 -4.86 105.19 108.57 3kw9 n GLY 129 Ca -0.25 -1.94 -0.46 0.00 0.00 0.00 0.00 46.02 43.36 3kw9 n GLY 129 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3kw9 n PRO 130 N 0.00 1.67 -5.25 1.61 -0.02 -1.26 -4.26 135.00 127.50 3kw9 n PRO 130 Ca 0.00 0.59 -0.32 0.00 -2.02 0.00 0.00 63.50 61.76 3kw9 n PRO 130 Cb 0.00 -2.18 -0.17 0.00 -0.02 0.00 0.00 33.50 31.13 3kw9 n PRO 130 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3kw9 s VAL 131 N -0.12 2.06 0.13 -1.45 1.01 -0.46 -4.68 120.40 116.91 3kw9 s VAL 131 Ca 0.70 -1.05 -0.30 0.00 0.00 0.00 0.00 61.98 61.33 3kw9 s VAL 131 Cb -0.73 -1.76 -0.07 0.00 0.00 0.00 0.00 36.38 33.82 3kw9 s VAL 131 CO 0.51 0.57 1.24 -0.44 0.00 0.00 0.00 175.10 176.97 3kw9 s SER 132 N 0.01 7.03 0.11 3.32 0.01 -0.20 -0.79 113.70 123.19 3kw9 s SER 132 Ca -0.09 2.19 -0.01 0.00 1.31 0.00 0.00 55.95 59.35 3kw9 s SER 132 Cb -0.15 -2.59 -0.04 0.00 0.21 0.00 0.00 66.02 63.44 3kw9 s SER 132 CO 0.05 -0.46 0.03 0.68 0.41 0.00 0.00 173.24 173.96 3kw9 s VAL 133 N 0.50 0.18 0.05 3.43 -7.23 -0.75 -1.01 120.40 115.58 3kw9 s VAL 133 Ca 0.57 -1.89 0.06 0.00 -1.81 0.00 0.00 61.98 58.91 3kw9 s VAL 133 Cb -0.33 -1.92 -0.03 0.00 0.56 0.00 0.00 36.38 34.67 3kw9 s VAL 133 CO 0.33 -0.60 -0.18 0.00 -0.31 0.00 0.00 175.10 174.35 3kw9 s ALA 134 N -3.98 1.50 0.28 1.32 0.00 -1.23 -0.35 121.76 119.29 3kw9 s ALA 134 Ca 0.20 -0.98 -0.02 0.00 0.00 0.00 0.00 51.96 51.15 3kw9 s ALA 134 Cb 0.07 -0.25 -0.02 0.00 0.00 0.00 0.00 23.12 22.92 3kw9 s ALA 134 CO -0.01 0.31 0.34 0.96 0.00 0.00 0.00 175.76 177.36 3kw9 s ILE 135 N -0.89 0.00 -0.40 0.00 -4.36 -0.06 -4.22 121.20 111.28 3kw9 s ILE 135 Ca 0.04 -1.75 -0.19 0.00 -0.26 0.00 0.00 60.65 58.49 3kw9 s ILE 135 Cb -0.09 -2.49 0.01 0.00 1.25 0.00 0.00 42.46 41.14 3kw9 s ILE 135 CO 0.02 0.00 0.53 -0.62 0.24 0.00 0.00 174.94 175.11 3kw9 s ASP 136 N -3.20 6.28 -0.13 4.36 2.15 -0.76 -1.28 116.67 124.09 3kw9 s ASP 136 Ca 0.33 -0.30 0.16 0.00 0.43 0.00 0.00 52.55 53.17 3kw9 s ASP 136 Cb 0.02 -2.27 0.35 0.00 -0.30 0.00 0.00 42.92 40.72 3kw9 s ASP 136 CO 0.17 -0.60 1.23 0.00 -0.17 0.00 0.00 175.17 175.80 3kw9 n ALA 137 N 5.87 2.48 0.18 3.66 0.00 -1.26 -4.71 120.51 126.73 3kw9 n ALA 137 Ca -0.04 -2.31 0.06 0.00 0.00 0.00 0.00 53.44 51.15 3kw9 n ALA 137 Cb 0.48 -0.46 0.27 0.00 0.00 0.00 0.00 19.45 19.74 3kw9 n ALA 137 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3kw9 h SER 138 N 0.70 0.00 -3.75 0.00 4.64 -1.91 -3.41 113.55 109.82 3kw9 h SER 138 Ca 0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.79 3kw9 h SER 138 Cb 1.09 0.00 0.09 0.00 -0.31 0.00 0.00 62.40 63.28 3kw9 h SER 138 CO 0.07 0.35 0.78 -0.76 -0.87 0.00 0.00 176.83 176.41 3kw9 s LEU 139 N -6.73 4.34 0.38 5.97 1.43 -1.26 -4.89 118.68 117.92 3kw9 s LEU 139 Ca 0.02 2.95 0.06 0.00 -1.03 0.00 0.00 54.13 56.13 3kw9 s LEU 139 Cb 0.09 -3.65 0.75 0.00 0.03 0.00 0.00 46.19 43.40 3kw9 s LEU 139 CO 0.69 -0.82 1.97 0.71 0.23 0.00 0.00 176.35 179.13 3kw9 h THR 140 N 3.12 1.15 0.00 5.49 1.35 -2.00 -1.69 112.91 120.33 3kw9 h THR 140 Ca -0.49 -0.47 -0.05 0.00 -0.55 0.00 0.00 66.41 64.85 3kw9 h THR 140 Cb 1.23 0.72 -0.01 0.00 -1.73 0.00 0.00 68.15 68.37 3kw9 h THR 140 CO 0.69 0.18 -0.22 0.77 -0.25 0.00 0.00 175.52 176.69 3kw9 h SER 141 N 0.52 0.00 -0.06 5.36 4.64 -1.96 -1.74 113.55 120.31 3kw9 h SER 141 Ca 0.13 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.40 3kw9 h SER 141 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 3kw9 h SER 141 CO -0.01 0.22 -0.17 0.15 -0.87 0.00 0.00 176.83 176.15 3kw9 h PHE 142 N 0.00 0.28 -0.42 4.77 3.57 -1.65 -2.91 116.94 120.58 3kw9 h PHE 142 Ca -0.00 -0.11 -0.01 0.00 3.53 0.00 0.00 57.97 61.37 3kw9 h PHE 142 Cb 0.55 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.22 3kw9 h PHE 142 CO 0.00 0.78 0.20 1.96 -2.23 0.00 0.00 178.31 179.02 3kw9 h GLN 143 N -0.31 0.57 -0.64 1.11 4.20 -1.13 -2.30 115.11 116.61 3kw9 h GLN 143 Ca -0.00 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.64 3kw9 h GLN 143 Cb 0.78 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.45 3kw9 h GLN 143 CO 0.04 0.45 0.00 1.97 -0.67 0.00 0.00 178.83 180.61 3kw9 n PHE 144 N -4.40 1.43 -1.67 2.96 1.16 -0.69 -4.78 117.46 111.47 3kw9 n PHE 144 Ca 0.03 -0.56 -0.43 0.00 -1.87 0.00 0.00 57.45 54.62 3kw9 n PHE 144 Cb 0.12 -0.26 -0.01 0.00 -1.61 0.00 0.00 39.48 37.72 3kw9 n PHE 144 CO 0.00 0.00 0.00 0.98 -1.87 0.00 0.00 176.76 175.87 3kw9 n TYR 145 N 0.96 2.00 0.00 2.97 4.19 -0.87 -4.91 117.16 121.50 3kw9 n TYR 145 Ca 0.24 0.58 0.00 0.00 3.31 0.00 0.00 57.90 62.02 3kw9 n TYR 145 Cb 0.86 -2.38 0.00 0.00 0.49 0.00 0.00 39.34 38.31 3kw9 n TYR 145 CO 0.00 0.00 0.00 0.45 0.91 0.00 0.00 176.86 178.22 3kw9 n SER 146 N 1.10 2.22 -3.50 2.98 2.88 -1.26 -3.55 113.62 114.49 3kw9 n SER 146 Ca 0.07 0.00 -0.07 0.00 -1.33 0.00 0.00 58.87 57.54 3kw9 n SER 146 Cb 0.34 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 63.80 3kw9 n SER 146 CO 0.00 0.00 0.00 -1.59 -1.23 0.00 0.00 175.04 172.22 3kw9 s LYS 147 N -1.72 1.88 1.10 -1.46 -2.85 -1.26 -3.88 119.74 111.56 3kw9 s LYS 147 Ca 0.00 -1.12 0.00 0.00 -1.00 0.00 0.00 55.97 53.85 3kw9 s LYS 147 Cb 0.00 0.59 0.00 0.00 -2.06 0.00 0.00 37.83 36.36 3kw9 s LYS 147 CO 0.00 -0.87 0.00 0.41 0.10 0.00 0.00 175.35 174.99 3kw9 n GLY 148 N -0.50 -1.93 3.37 0.59 0.00 -1.26 -4.76 105.19 100.71 3kw9 n GLY 148 Ca -0.06 -1.48 -0.39 0.00 0.00 0.00 0.00 46.02 44.10 3kw9 n GLY 148 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3kw9 s VAL 149 N 0.00 4.34 0.08 1.61 1.01 -1.26 -4.28 120.40 121.90 3kw9 s VAL 149 Ca 0.00 -0.74 -0.31 0.00 0.00 0.00 0.00 61.98 60.93 3kw9 s VAL 149 Cb 0.00 -3.33 -0.08 0.00 0.00 0.00 0.00 36.38 32.97 3kw9 s VAL 149 CO 0.00 -0.08 1.50 -0.47 0.00 0.00 0.00 175.10 176.05 3kw9 s TYR 150 N 1.54 2.88 -0.26 5.22 5.04 0.85 -4.75 117.35 127.86 3kw9 s TYR 150 Ca 0.02 0.67 -0.03 0.00 -2.44 0.00 0.00 57.07 55.30 3kw9 s TYR 150 Cb -0.18 -3.81 0.15 0.00 0.35 0.00 0.00 41.96 38.47 3kw9 s TYR 150 CO 0.05 -3.03 0.46 -0.47 -1.34 0.00 0.00 175.55 171.22 3kw9 s TYR 151 N 1.87 -1.07 -0.19 4.97 5.04 -1.26 -1.13 117.35 125.57 3kw9 s TYR 151 Ca 0.68 1.23 -0.04 0.00 -2.44 0.00 0.00 57.07 56.50 3kw9 s TYR 151 Cb -0.38 0.24 0.06 0.00 0.35 0.00 0.00 41.96 42.24 3kw9 s TYR 151 CO 0.30 -0.74 0.06 0.34 -1.34 0.00 0.00 175.55 174.17 3kw9 s ASP 152 N 2.66 2.79 0.06 4.32 -1.08 -1.26 -5.01 116.67 119.15 3kw9 s ASP 152 Ca 0.13 -0.80 0.06 0.00 -0.52 0.00 0.00 52.55 51.42 3kw9 s ASP 152 Cb -0.15 -0.48 0.28 0.00 -1.46 0.00 0.00 42.92 41.11 3kw9 s ASP 152 CO -0.17 -0.33 1.17 -0.62 0.52 0.00 0.00 175.17 175.74 3kw9 n GLU 153 N 5.12 0.03 0.09 4.34 1.02 -1.26 -1.14 120.64 128.84 3kw9 n GLU 153 Ca -0.08 0.50 0.12 0.00 -0.02 0.00 0.00 57.16 57.68 3kw9 n GLU 153 Cb 0.47 -1.59 0.45 0.00 -0.02 0.00 0.00 31.44 30.76 3kw9 n GLU 153 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 3kw9 n SER 154 N -1.65 0.59 -4.74 1.62 7.64 -1.26 -4.83 113.62 110.99 3kw9 n SER 154 Ca 0.00 0.59 -0.42 0.00 1.01 0.00 0.00 58.87 60.06 3kw9 n SER 154 Cb 0.03 -0.74 -0.01 0.00 -1.01 0.00 0.00 64.21 62.48 3kw9 n SER 154 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3kw9 s ASN 156 N -0.12 5.61 0.00 0.00 3.84 -1.26 -4.70 114.94 118.31 3kw9 s ASN 156 Ca 0.56 -1.22 0.13 0.00 0.21 0.00 0.00 52.86 52.54 3kw9 s ASN 156 Cb -0.52 -1.98 0.55 0.00 -0.55 0.00 0.00 41.25 38.75 3kw9 s ASN 156 CO 0.61 -0.43 1.40 -1.20 -2.79 0.00 0.00 177.10 174.69 3kw9 n SER 157 N 4.93 0.00 -1.23 -4.21 7.64 -1.26 -1.61 113.62 117.88 3kw9 n SER 157 Ca -0.11 0.46 0.11 0.00 1.01 0.00 0.00 58.87 60.34 3kw9 n SER 157 Cb 0.45 -0.48 0.28 0.00 -1.01 0.00 0.00 64.21 63.45 3kw9 n SER 157 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 3kw9 n ASP 158 N -1.48 3.73 -3.37 6.43 8.00 -1.26 -4.61 116.55 124.00 3kw9 n ASP 158 Ca 0.03 -1.99 -0.26 0.00 0.71 0.00 0.00 54.79 53.28 3kw9 n ASP 158 Cb 0.14 -0.41 -0.08 0.00 -0.02 0.00 0.00 41.12 40.75 3kw9 n ASP 158 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 3kw9 n ASN 159 N 1.49 1.81 -4.63 -2.24 5.15 -0.64 -5.06 115.26 111.14 3kw9 n ASN 159 Ca 0.22 -3.01 -0.43 0.00 -0.60 0.00 0.00 54.58 50.76 3kw9 n ASN 159 Cb 0.59 -0.65 -0.02 0.00 -0.53 0.00 0.00 39.78 39.17 3kw9 n ASN 159 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3kw9 s LEU 160 N -1.61 3.84 0.00 1.20 1.43 -1.26 -3.97 118.68 118.30 3kw9 s LEU 160 Ca 0.36 0.85 0.00 0.00 -1.03 0.00 0.00 54.13 54.31 3kw9 s LEU 160 Cb 0.13 -3.54 0.00 0.00 0.03 0.00 0.00 46.19 42.81 3kw9 s LEU 160 CO -0.08 -1.00 0.55 -0.46 0.23 0.00 0.00 176.35 175.58 3kw9 n ASN 161 N 7.19 0.99 -3.70 2.29 0.23 -0.40 -4.92 115.26 116.92 3kw9 n ASN 161 Ca 0.12 -1.28 -0.11 0.00 -0.53 0.00 0.00 54.58 52.78 3kw9 n ASN 161 Cb 0.48 0.00 -0.12 0.00 -2.08 0.00 0.00 39.78 38.06 3kw9 n ASN 161 CO 0.00 0.00 0.00 -2.28 -0.93 0.00 0.00 177.26 174.05 3kw9 s HIS 162 N -0.28 -0.51 -0.10 -2.53 5.04 -0.88 -4.91 115.29 111.13 3kw9 s HIS 162 Ca 0.00 1.11 -0.15 0.00 -1.54 0.00 0.00 55.06 54.48 3kw9 s HIS 162 Cb 0.00 0.19 -0.05 0.00 0.04 0.00 0.00 32.58 32.76 3kw9 s HIS 162 CO 0.00 -0.31 0.38 0.00 -2.34 0.00 0.00 174.74 172.47 3kw9 s ALA 163 N 1.40 3.60 0.00 1.58 0.00 -1.26 -0.88 121.76 126.20 3kw9 s ALA 163 Ca -0.09 -0.31 0.00 0.00 0.00 0.00 0.00 51.96 51.56 3kw9 s ALA 163 Cb -0.09 -2.45 0.00 0.00 0.00 0.00 0.00 23.12 20.57 3kw9 s ALA 163 CO -0.11 0.19 0.00 1.33 0.00 0.00 0.00 175.76 177.17 3kw9 n VAL 164 N 3.06 0.00 -3.86 0.00 0.24 0.52 -4.55 118.33 113.74 3kw9 n VAL 164 Ca -0.11 0.00 -0.20 0.00 -2.04 0.00 0.00 64.34 61.98 3kw9 n VAL 164 Cb 0.52 0.00 -0.17 0.00 -1.47 0.00 0.00 33.84 32.72 3kw9 n VAL 164 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 3kw9 s LEU 165 N 0.00 0.81 -0.36 1.34 2.96 -0.79 -1.80 118.68 120.83 3kw9 s LEU 165 Ca 0.00 -0.05 -0.27 0.00 -0.22 0.00 0.00 54.13 53.59 3kw9 s LEU 165 Cb 0.00 -0.34 0.02 0.00 0.50 0.00 0.00 46.19 46.37 3kw9 s LEU 165 CO 0.00 -0.15 0.97 0.00 -1.32 0.00 0.00 176.35 175.85 3kw9 s ALA 166 N 1.55 3.41 -0.70 5.97 0.00 0.03 -0.27 121.76 131.76 3kw9 s ALA 166 Ca -0.02 -0.36 0.13 0.00 0.00 0.00 0.00 51.96 51.71 3kw9 s ALA 166 Cb -0.13 -3.59 0.40 0.00 0.00 0.00 0.00 23.12 19.80 3kw9 s ALA 166 CO -0.03 -1.62 1.33 1.33 0.00 0.00 0.00 175.76 176.77 3kw9 n VAL 167 N 6.01 1.47 -1.65 0.00 0.24 0.16 -1.35 118.33 123.22 3kw9 n VAL 167 Ca 0.08 -1.30 0.00 0.00 -2.04 0.00 0.00 64.34 61.08 3kw9 n VAL 167 Cb 0.48 0.23 0.00 0.00 -1.47 0.00 0.00 33.84 33.08 3kw9 n VAL 167 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3kw9 n GLY 168 N 0.21 -2.17 3.60 7.63 0.00 -1.22 -1.18 105.19 112.08 3kw9 n GLY 168 Ca 0.16 -1.25 -0.09 0.00 0.00 0.00 0.00 46.02 44.84 3kw9 n GLY 168 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3kw9 s TYR 169 N -2.42 -0.37 -0.55 1.61 -0.85 -0.11 -0.99 117.35 113.67 3kw9 s TYR 169 Ca 0.00 0.08 0.00 0.00 -0.52 0.00 0.00 57.07 56.63 3kw9 s TYR 169 Cb 0.00 0.62 0.00 0.00 0.38 0.00 0.00 41.96 42.96 3kw9 s TYR 169 CO 0.00 -0.95 0.00 0.41 -1.52 0.00 0.00 175.55 173.49 3kw9 n GLY 170 N -0.40 -0.80 3.34 5.49 0.00 -0.85 -1.68 105.19 110.30 3kw9 n GLY 170 Ca -0.11 -0.22 -0.13 0.00 0.00 0.00 0.00 46.02 45.56 3kw9 n GLY 170 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3kw9 s ILE 171 N -4.00 0.00 0.00 -0.61 2.07 -1.26 -1.24 121.20 116.16 3kw9 s ILE 171 Ca 0.00 -0.02 0.00 0.00 -1.41 0.00 0.00 60.65 59.22 3kw9 s ILE 171 Cb 0.00 -0.64 0.00 0.00 0.13 0.00 0.00 42.46 41.95 3kw9 s ILE 171 CO 0.00 -0.01 0.00 0.00 -1.91 0.00 0.00 174.94 173.02 3kw9 n GLN 172 N 2.73 0.00 -3.09 3.50 1.13 -0.60 -4.85 117.38 116.21 3kw9 n GLN 172 Ca -0.14 0.00 -0.40 0.00 -1.94 0.00 0.00 57.00 54.53 3kw9 n GLN 172 Cb 0.57 0.00 -0.01 0.00 0.11 0.00 0.00 30.24 30.91 3kw9 n GLN 172 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 3kw9 n LYS 173 N 0.00 4.09 -0.98 -1.09 4.76 -1.26 -4.61 118.16 119.07 3kw9 n LYS 173 Ca 0.00 -4.59 0.00 0.00 -2.87 0.00 0.00 58.31 50.85 3kw9 n LYS 173 Cb 0.00 -2.46 0.00 0.00 -1.84 0.00 0.00 35.03 30.73 3kw9 n LYS 173 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3kw9 n GLY 174 N 1.18 0.72 3.18 0.72 0.00 -1.26 -5.01 105.19 104.73 3kw9 n GLY 174 Ca 0.27 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.94 3kw9 n GLY 174 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3kw9 s ASN 175 N -2.43 4.92 0.41 1.61 0.02 -1.26 -5.09 114.94 113.12 3kw9 s ASN 175 Ca 0.00 -1.25 -0.26 0.00 -1.02 0.00 0.00 52.86 50.33 3kw9 s ASN 175 Cb 0.00 -1.72 -0.08 0.00 0.02 0.00 0.00 41.25 39.46 3kw9 s ASN 175 CO 0.00 -0.26 1.28 -0.54 0.02 0.00 0.00 177.10 177.60 3kw9 s LYS 176 N 1.27 3.92 0.30 -0.60 1.02 -1.26 -1.56 119.74 122.83 3kw9 s LYS 176 Ca -0.05 2.11 -0.08 0.00 0.02 0.00 0.00 55.97 57.97 3kw9 s LYS 176 Cb -0.20 -2.70 0.00 0.00 -0.52 0.00 0.00 37.83 34.41 3kw9 s LYS 176 CO -0.01 -0.51 0.48 -3.38 -0.92 0.00 0.00 175.35 171.01 3kw9 s HIS 177 N -1.29 0.70 -0.03 3.18 -3.43 -0.37 -0.96 115.29 113.08 3kw9 s HIS 177 Ca 0.58 -1.02 0.06 0.00 -0.80 0.00 0.00 55.06 53.88 3kw9 s HIS 177 Cb -0.37 0.08 -0.02 0.00 -1.43 0.00 0.00 32.58 30.84 3kw9 s HIS 177 CO 0.47 -1.09 -0.21 -1.58 -2.00 0.00 0.00 174.74 170.33 3kw9 s TRP 178 N -3.45 2.48 -0.28 0.38 0.52 0.91 -2.00 118.94 117.50 3kw9 s TRP 178 Ca 0.26 -0.33 -0.17 0.00 0.02 0.00 0.00 56.10 55.88 3kw9 s TRP 178 Cb -0.00 -1.55 -0.03 0.00 -1.15 0.00 0.00 33.47 30.74 3kw9 s TRP 178 CO 0.14 0.05 0.49 0.42 0.02 0.00 0.00 176.95 178.07 3kw9 s ILE 179 N -0.65 5.08 -0.13 2.03 1.01 -0.16 -1.20 121.20 127.17 3kw9 s ILE 179 Ca 0.10 0.75 0.01 0.00 0.00 0.00 0.00 60.65 61.52 3kw9 s ILE 179 Cb -0.10 -3.83 -0.00 0.00 0.01 0.00 0.00 42.46 38.54 3kw9 s ILE 179 CO -0.00 0.05 -0.18 -0.63 0.00 0.00 0.00 174.94 174.18 3kw9 s ILE 180 N 2.29 2.50 -0.19 2.92 -1.09 -0.18 -0.66 121.20 126.79 3kw9 s ILE 180 Ca 0.20 -0.84 -0.16 0.00 -2.23 0.00 0.00 60.65 57.61 3kw9 s ILE 180 Cb -0.16 -2.03 -0.04 0.00 -1.58 0.00 0.00 42.46 38.66 3kw9 s ILE 180 CO 0.10 0.53 0.41 -0.75 -1.23 0.00 0.00 174.94 174.00 3kw9 s LYS 181 N 0.62 4.20 0.54 2.79 2.20 0.63 -1.30 119.74 129.42 3kw9 s LYS 181 Ca -0.10 0.24 0.07 0.00 -0.36 0.00 0.00 55.97 55.83 3kw9 s LYS 181 Cb -0.16 -3.52 0.05 0.00 -1.51 0.00 0.00 37.83 32.69 3kw9 s LYS 181 CO 0.03 -0.01 0.57 1.21 -0.36 0.00 0.00 175.35 176.78 3kw9 s ASN 182 N 0.97 4.90 -0.28 1.43 3.84 -0.96 -1.89 114.94 122.95 3kw9 s ASN 182 Ca 0.20 -1.01 0.12 0.00 0.21 0.00 0.00 52.86 52.38 3kw9 s ASN 182 Cb -0.15 0.24 0.47 0.00 -0.55 0.00 0.00 41.25 41.27 3kw9 s ASN 182 CO 0.08 -1.15 1.17 -1.54 -2.79 0.00 0.00 177.10 172.87 3kw9 n SER 183 N -1.95 3.83 -1.25 -4.21 3.41 -1.26 -4.53 113.62 107.67 3kw9 n SER 183 Ca 0.06 -3.21 -0.04 0.00 -0.26 0.00 0.00 58.87 55.42 3kw9 n SER 183 Cb 0.63 -0.39 0.21 0.00 -0.26 0.00 0.00 64.21 64.41 3kw9 n SER 183 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 3kw9 n TRP 184 N -0.67 1.32 0.00 7.33 8.01 -1.20 -1.02 117.44 131.21 3kw9 n TRP 184 Ca 0.32 -1.46 0.00 0.00 -1.31 0.00 0.00 57.50 55.05 3kw9 n TRP 184 Cb 0.92 -0.51 0.00 0.00 -2.01 0.00 0.00 31.31 29.70 3kw9 n TRP 184 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3kw9 n GLY 185 N -0.96 0.06 0.12 6.99 0.00 -0.26 -4.18 105.19 106.96 3kw9 n GLY 185 Ca 0.34 -1.68 0.12 0.00 0.00 0.00 0.00 46.02 44.79 3kw9 n GLY 185 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3kw9 n GLU 186 N 0.24 0.20 0.18 1.61 2.13 -1.26 -2.39 120.64 121.34 3kw9 n GLU 186 Ca 0.00 0.38 0.13 0.00 0.66 0.00 0.00 57.16 58.33 3kw9 n GLU 186 Cb 0.00 -1.85 0.30 0.00 0.27 0.00 0.00 31.44 30.16 3kw9 n GLU 186 CO 0.00 0.00 0.00 -0.97 -0.41 0.00 0.00 177.13 175.75 3kw9 h ASN 187 N 0.00 0.00 -3.98 4.31 -0.00 -1.88 -2.72 115.58 111.31 3kw9 h ASN 187 Ca 0.00 0.00 -0.47 0.00 -0.00 0.00 0.00 56.30 55.83 3kw9 h ASN 187 Cb 0.42 0.00 -0.00 0.00 -0.00 0.00 0.00 38.32 38.74 3kw9 h ASN 187 CO 0.00 0.00 0.27 0.86 -0.00 0.00 0.00 177.43 178.56 3kw9 s TRP 188 N -3.20 3.41 0.00 0.67 -0.00 -1.00 -4.82 118.94 114.00 3kw9 s TRP 188 Ca 0.08 1.37 0.00 0.00 -0.00 0.00 0.00 56.10 57.55 3kw9 s TRP 188 Cb 0.08 -2.69 0.00 0.00 -0.00 0.00 0.00 33.47 30.86 3kw9 s TRP 188 CO 0.63 -0.18 0.00 0.41 -0.00 0.00 0.00 176.95 177.81 3kw9 n GLY 189 N -1.10 2.79 3.20 5.86 0.00 -1.23 0.31 105.19 115.02 3kw9 n GLY 189 Ca 0.05 -0.14 -0.41 0.00 0.00 0.00 0.00 46.02 45.52 3kw9 n GLY 189 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3kw9 s ASN 190 N -4.00 5.83 -1.80 1.61 3.84 -0.04 -4.56 114.94 115.82 3kw9 s ASN 190 Ca 0.00 -2.52 0.00 0.00 0.21 0.00 0.00 52.86 50.55 3kw9 s ASN 190 Cb 0.00 -2.01 0.00 0.00 -0.55 0.00 0.00 41.25 38.69 3kw9 s ASN 190 CO 0.00 -0.53 0.00 0.29 -2.79 0.00 0.00 177.10 174.07 3kw9 n LYS 191 N 4.06 -1.54 -0.00 0.43 5.02 -1.23 -1.79 118.16 123.11 3kw9 n LYS 191 Ca 0.05 1.02 0.00 0.00 -2.02 0.00 0.00 58.31 57.36 3kw9 n LYS 191 Cb 0.41 -5.56 0.00 0.00 -0.02 0.00 0.00 35.03 29.86 3kw9 n LYS 191 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3kw9 n GLY 192 N -0.90 0.14 3.66 0.72 0.00 0.15 -4.70 105.19 104.25 3kw9 n GLY 192 Ca -0.23 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.55 3kw9 n GLY 192 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3kw9 s TYR 193 N -2.00 2.58 -0.04 1.61 1.51 -0.74 -2.27 117.35 118.00 3kw9 s TYR 193 Ca 0.00 -0.45 -0.03 0.00 -1.01 0.00 0.00 57.07 55.58 3kw9 s TYR 193 Cb 0.00 -1.57 0.02 0.00 -0.11 0.00 0.00 41.96 40.30 3kw9 s TYR 193 CO 0.00 0.42 0.11 -1.50 -1.11 0.00 0.00 175.55 173.47 3kw9 s ILE 194 N -2.51 -0.01 -0.30 2.71 2.07 -0.42 -0.86 121.20 121.87 3kw9 s ILE 194 Ca 0.36 0.05 -0.17 0.00 -1.41 0.00 0.00 60.65 59.47 3kw9 s ILE 194 Cb 0.00 -0.17 -0.02 0.00 0.13 0.00 0.00 42.46 42.40 3kw9 s ILE 194 CO 0.20 0.02 0.48 -0.76 -1.91 0.00 0.00 174.94 172.98 3kw9 s LEU 195 N 0.34 4.18 -0.10 8.50 1.02 -1.26 -1.01 118.68 130.34 3kw9 s LEU 195 Ca -0.02 0.23 -0.01 0.00 0.02 0.00 0.00 54.13 54.35 3kw9 s LEU 195 Cb -0.04 -2.58 -0.03 0.00 0.02 0.00 0.00 46.19 43.57 3kw9 s LEU 195 CO -0.01 -0.35 -0.07 -0.04 0.02 0.00 0.00 176.35 175.90 3kw9 s MET 196 N 2.29 3.14 0.12 1.70 -1.94 -0.34 -0.11 119.30 124.16 3kw9 s MET 196 Ca 0.19 -0.56 -0.35 0.00 -1.71 0.00 0.00 55.69 53.26 3kw9 s MET 196 Cb -0.16 -2.70 -0.17 0.00 2.01 0.00 0.00 34.83 33.82 3kw9 s MET 196 CO 0.11 0.46 1.17 0.00 -0.01 0.00 0.00 175.02 176.76 3kw9 n ALA 197 N 2.83 -1.43 -2.48 3.03 0.00 -0.28 -0.07 120.51 122.11 3kw9 n ALA 197 Ca -0.18 0.50 -0.32 0.00 0.00 0.00 0.00 53.44 53.44 3kw9 n ALA 197 Cb 0.53 -1.98 -0.13 0.00 0.00 0.00 0.00 19.45 17.87 3kw9 n ALA 197 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 3kw9 s ARG 198 N -0.06 2.39 -1.36 0.00 3.52 -0.13 -4.61 118.95 118.70 3kw9 s ARG 198 Ca 0.79 -0.78 -0.03 0.00 -0.13 0.00 0.00 55.73 55.58 3kw9 s ARG 198 Cb -0.96 -2.34 0.00 0.00 -1.56 0.00 0.00 34.95 30.10 3kw9 s ARG 198 CO 0.51 0.60 0.38 0.09 -0.81 0.00 0.00 175.30 176.07 3kw9 n ASN 199 N 2.00 -5.32 -2.94 -2.12 5.03 -1.26 -4.62 115.26 106.03 3kw9 n ASN 199 Ca -0.17 -0.18 -0.27 0.00 0.87 0.00 0.00 54.58 54.83 3kw9 n ASN 199 Cb 0.52 -4.23 -0.04 0.00 -1.02 0.00 0.00 39.78 35.02 3kw9 n ASN 199 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 3kw9 n LYS 200 N -3.28 3.29 -3.53 3.52 4.76 -1.26 -4.87 118.16 116.80 3kw9 n LYS 200 Ca -0.13 -4.86 -0.24 0.00 -2.87 0.00 0.00 58.31 50.21 3kw9 n LYS 200 Cb 0.62 -2.24 0.07 0.00 -1.84 0.00 0.00 35.03 31.63 3kw9 n LYS 200 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 3kw9 n ASN 201 N -0.25 -6.24 -3.66 4.39 5.03 -1.26 -2.78 115.26 110.49 3kw9 n ASN 201 Ca 0.31 -0.52 -0.23 0.00 0.87 0.00 0.00 54.58 55.02 3kw9 n ASN 201 Cb 0.39 -4.93 0.04 0.00 -1.02 0.00 0.00 39.78 34.26 3kw9 n ASN 201 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 3kw9 n ASN 202 N -2.92 -2.72 -4.66 6.41 5.15 -1.26 -4.83 115.26 110.43 3kw9 n ASN 202 Ca -0.01 -0.86 -0.46 0.00 -0.60 0.00 0.00 54.58 52.65 3kw9 n ASN 202 Cb 0.57 -3.98 -0.03 0.00 -0.53 0.00 0.00 39.78 35.80 3kw9 n ASN 202 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3kw9 n ALA 203 N -4.13 0.96 -0.96 5.20 0.00 -1.12 -1.39 120.51 119.08 3kw9 n ALA 203 Ca -0.23 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.65 3kw9 n ALA 203 Cb 0.65 -2.28 0.00 0.00 0.00 0.00 0.00 19.45 17.83 3kw9 n ALA 203 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3kw9 n GLY 205 N 0.09 0.27 0.40 0.00 0.00 -0.48 -1.83 105.19 103.64 3kw9 n GLY 205 Ca 0.00 -0.68 0.19 0.00 0.00 0.00 0.00 46.02 45.53 3kw9 n GLY 205 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3kw9 h ILE 206 N 0.00 0.67 -0.47 -0.61 6.09 -1.66 -1.63 117.51 119.90 3kw9 h ILE 206 Ca -0.13 -0.15 -0.03 0.00 -1.37 0.00 0.00 64.86 63.18 3kw9 h ILE 206 Cb 0.95 0.19 -0.02 0.00 0.47 0.00 0.00 36.82 38.41 3kw9 h ILE 206 CO 0.16 0.08 0.03 0.00 -3.07 0.00 0.00 178.15 175.35 3kw9 n ALA 207 N -2.50 3.65 0.08 0.18 0.00 -1.26 -4.51 120.51 116.15 3kw9 n ALA 207 Ca 0.20 -2.14 0.08 0.00 0.00 0.00 0.00 53.44 51.57 3kw9 n ALA 207 Cb 0.71 -0.98 -0.03 0.00 0.00 0.00 0.00 19.45 19.14 3kw9 n ALA 207 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3kw9 n ASN 208 N 0.09 0.83 -2.91 0.00 3.02 -0.61 0.16 115.26 115.83 3kw9 n ASN 208 Ca 0.27 0.33 -0.13 0.00 -0.03 0.00 0.00 54.58 55.03 3kw9 n ASN 208 Cb 1.11 0.40 0.02 0.00 -0.61 0.00 0.00 39.78 40.69 3kw9 n ASN 208 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 3kw9 n LEU 209 N -2.74 0.42 -4.83 3.41 7.94 -1.26 -4.69 117.00 115.24 3kw9 n LEU 209 Ca -0.03 -4.28 -0.37 0.00 -1.11 0.00 0.00 56.01 50.21 3kw9 n LEU 209 Cb 0.65 0.59 -0.06 0.00 0.53 0.00 0.00 43.42 45.12 3kw9 n LEU 209 CO 0.41 1.99 -0.12 0.00 -1.11 0.00 0.00 177.39 178.56 3kw9 s ALA 210 N -2.11 3.79 0.20 1.96 0.00 -1.26 -3.54 121.76 120.80 3kw9 s ALA 210 Ca 0.32 -0.57 -0.17 0.00 0.00 0.00 0.00 51.96 51.54 3kw9 s ALA 210 Cb 0.38 -2.11 0.03 0.00 0.00 0.00 0.00 23.12 21.42 3kw9 s ALA 210 CO -0.04 0.47 0.52 -1.54 0.00 0.00 0.00 175.76 175.17 3kw9 s SER 211 N -0.65 -0.25 -0.01 0.00 1.04 -0.18 -0.53 113.70 113.12 3kw9 s SER 211 Ca 0.15 -0.51 -0.15 0.00 0.48 0.00 0.00 55.95 55.92 3kw9 s SER 211 Cb -0.13 0.58 0.02 0.00 0.10 0.00 0.00 66.02 66.60 3kw9 s SER 211 CO 0.04 -1.06 0.31 0.72 0.98 0.00 0.00 173.24 174.23 3kw9 s PHE 212 N -3.88 -0.18 0.44 5.02 -0.12 -0.62 -1.03 117.98 117.61 3kw9 s PHE 212 Ca 0.10 0.26 -0.12 0.00 -0.05 0.00 0.00 56.93 57.12 3kw9 s PHE 212 Cb -0.01 0.10 -0.07 0.00 -0.63 0.00 0.00 43.02 42.41 3kw9 s PHE 212 CO -0.02 -0.39 0.83 -1.25 -0.05 0.00 0.00 175.22 174.34 3kw9 s PRO 213 N -1.35 3.81 -0.01 1.99 0.04 -1.26 -1.38 135.00 136.84 3kw9 s PRO 213 Ca -0.13 0.60 0.01 0.00 0.04 0.00 0.00 61.00 61.51 3kw9 s PRO 213 Cb -0.05 -2.31 -0.04 0.00 0.04 0.00 0.00 34.50 32.14 3kw9 s PRO 213 CO 0.04 -0.12 0.03 0.15 0.04 0.00 0.00 177.00 177.14 3kw9 s LYS 214 N -3.97 2.88 0.00 4.56 1.02 0.96 -4.90 119.74 120.29 3kw9 s LYS 214 Ca 0.53 -0.56 0.00 0.00 0.02 0.00 0.00 55.97 55.96 3kw9 s LYS 214 Cb -0.10 -2.74 0.00 0.00 -0.52 0.00 0.00 37.83 34.47 3kw9 s LYS 214 CO 0.32 0.64 0.27 -1.33 -0.92 0.00 0.00 175.35 174.33