#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h5w h GLN 18 N 0.00 0.01 0.59 5.56 4.15 -2.05 -3.15 115.11 120.22 1h5w h GLN 18 Ca 0.00 -0.01 -0.03 0.00 0.77 0.00 0.00 58.65 59.38 1h5w h GLN 18 Cb 0.00 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.70 1h5w h GLN 18 CO 0.00 0.91 -0.29 -0.22 -1.93 0.00 0.00 178.83 177.30 1h5w h LYS 19 N 0.00 -0.77 -0.48 1.69 1.63 -2.00 -2.35 116.57 114.29 1h5w h LYS 19 Ca -0.01 0.05 -0.05 0.00 -0.85 0.00 0.00 60.65 59.79 1h5w h LYS 19 Cb 1.60 0.18 -0.02 0.00 -0.60 0.00 0.00 32.23 33.39 1h5w h LYS 19 CO 0.12 -0.52 0.09 0.07 -3.45 0.00 0.00 179.45 175.76 1h5w h ARG 20 N -0.80 0.73 -0.53 1.90 0.11 -1.83 -2.70 114.38 111.26 1h5w h ARG 20 Ca -0.08 -0.15 0.07 0.00 0.10 0.00 0.00 59.98 59.92 1h5w h ARG 20 Cb 0.62 -0.11 -0.06 0.00 1.11 0.00 0.00 29.97 31.53 1h5w h ARG 20 CO 0.12 0.68 0.20 -0.91 0.10 0.00 0.00 179.97 180.16 1h5w h ASN 21 N 0.70 0.21 -0.30 0.08 -0.26 -1.47 0.75 115.58 115.30 1h5w h ASN 21 Ca 0.15 0.06 -0.03 0.00 -0.56 0.00 0.00 56.30 55.93 1h5w h ASN 21 Cb 0.30 0.04 -0.01 0.00 -1.06 0.00 0.00 38.32 37.59 1h5w h ASN 21 CO 0.00 0.14 0.07 -0.09 -1.06 0.00 0.00 177.43 176.50 1h5w h ARG 22 N 0.38 0.48 0.00 0.81 9.65 -1.14 -2.11 114.38 122.45 1h5w h ARG 22 Ca 0.25 -0.12 -0.09 0.00 -1.10 0.00 0.00 59.98 58.93 1h5w h ARG 22 Cb 0.27 -0.06 -0.01 0.00 -1.39 0.00 0.00 29.97 28.77 1h5w h ARG 22 CO -0.25 0.56 -0.43 -1.49 2.80 0.00 0.00 179.97 181.15 1h5w h TRP 23 N 0.32 0.00 -0.62 2.20 4.06 -1.15 -2.27 115.95 118.49 1h5w h TRP 23 Ca 0.09 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 61.01 1h5w h TRP 23 Cb 0.29 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 28.42 1h5w h TRP 23 CO 0.01 0.43 0.26 0.35 -3.56 0.00 0.00 178.44 175.93 1h5w h PHE 24 N 0.00 0.93 -0.51 0.49 3.57 0.78 -0.33 116.94 121.86 1h5w h PHE 24 Ca -0.00 -0.06 -0.10 0.00 3.53 0.00 0.00 57.97 61.33 1h5w h PHE 24 Cb 0.97 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 39.42 1h5w h PHE 24 CO 0.00 0.73 -0.08 0.82 -2.23 0.00 0.00 178.31 177.54 1h5w h ILE 25 N 0.86 1.26 0.26 1.41 1.08 -1.08 -0.37 117.51 120.93 1h5w h ILE 25 Ca 0.21 -1.20 -0.01 0.00 -0.39 0.00 0.00 64.86 63.46 1h5w h ILE 25 Cb 0.18 0.96 0.00 0.00 -3.07 0.00 0.00 36.82 34.89 1h5w h ILE 25 CO -0.02 0.42 -0.13 -0.74 -0.69 0.00 0.00 178.15 177.00 1h5w h HIS 26 N 0.84 -0.33 -0.54 1.37 -0.00 -1.04 -2.24 115.15 113.22 1h5w h HIS 26 Ca 0.14 -0.01 -0.09 0.00 -0.00 0.00 0.00 60.37 60.41 1h5w h HIS 26 Cb 0.62 0.11 -0.02 0.00 -0.00 0.00 0.00 27.41 28.11 1h5w h HIS 26 CO 0.04 -0.14 -0.03 1.88 -0.00 0.00 0.00 177.93 179.67 1h5w h TYR 27 N -0.43 1.04 0.34 5.26 0.99 -0.99 -1.55 116.97 121.62 1h5w h TYR 27 Ca -0.04 -0.18 -0.02 0.00 2.00 0.00 0.00 58.73 60.50 1h5w h TYR 27 Cb 0.33 -0.27 0.00 0.00 1.00 0.00 0.00 36.73 37.79 1h5w h TYR 27 CO -0.04 0.94 -0.16 1.25 -0.00 0.00 0.00 178.16 180.15 1h5w h LEU 28 N 0.87 -0.39 -1.01 3.88 6.46 -1.04 0.11 115.31 124.18 1h5w h LEU 28 Ca 0.15 -0.01 -0.03 0.00 -0.12 0.00 0.00 57.88 57.88 1h5w h LEU 28 Cb 0.56 0.10 -0.04 0.00 -0.73 0.00 0.00 40.66 40.55 1h5w h LEU 28 CO 0.03 -0.24 0.37 0.78 -0.62 0.00 0.00 178.44 178.76 1h5w h ASN 29 N -0.50 0.97 -0.16 1.25 2.35 -1.38 0.11 115.58 118.22 1h5w h ASN 29 Ca -0.05 -0.10 -0.02 0.00 -0.55 0.00 0.00 56.30 55.58 1h5w h ASN 29 Cb 0.38 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.49 1h5w h ASN 29 CO 0.08 0.81 0.02 0.22 -1.65 0.00 0.00 177.43 176.91 1h5w h TYR 30 N 1.06 0.28 -0.37 1.19 3.20 -1.12 -0.77 116.97 120.45 1h5w h TYR 30 Ca 0.26 -0.04 -0.06 0.00 3.14 0.00 0.00 58.73 62.03 1h5w h TYR 30 Cb 0.10 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.27 1h5w h TYR 30 CO 0.01 0.44 -0.04 -0.07 -1.64 0.00 0.00 178.16 176.87 1h5w h LEU 31 N 0.04 0.58 -0.36 2.82 3.38 -0.51 -1.89 115.31 119.37 1h5w h LEU 31 Ca 0.05 -0.13 -0.08 0.00 0.09 0.00 0.00 57.88 57.81 1h5w h LEU 31 Cb 0.32 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1h5w h LEU 31 CO 0.00 0.68 -0.08 1.56 0.09 0.00 0.00 178.44 180.69 1h5w h GLN 32 N 0.57 0.69 -0.26 1.13 4.20 -0.77 -0.35 115.11 120.32 1h5w h GLN 32 Ca 0.11 -0.26 -0.04 0.00 0.06 0.00 0.00 58.65 58.52 1h5w h GLN 32 Cb 0.42 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.15 1h5w h GLN 32 CO 0.02 0.85 -0.00 0.66 -0.67 0.00 0.00 178.83 179.68 1h5w h SER 33 N 0.49 0.36 -0.12 1.46 4.64 -0.89 0.16 113.55 119.65 1h5w h SER 33 Ca 0.09 -0.06 -0.20 0.00 -0.47 0.00 0.00 61.79 61.15 1h5w h SER 33 Cb 0.59 -0.09 0.01 0.00 -0.31 0.00 0.00 62.40 62.59 1h5w h SER 33 CO 0.03 0.43 -0.71 -0.07 -0.87 0.00 0.00 176.83 175.64 1h5w h LEU 34 N 0.38 0.83 -0.18 5.97 3.38 -1.13 -3.05 115.31 121.51 1h5w h LEU 34 Ca 0.09 -0.65 -0.02 0.00 0.09 0.00 0.00 57.88 57.39 1h5w h LEU 34 Cb 0.26 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 1h5w h LEU 34 CO 0.01 1.35 0.03 0.00 0.09 0.00 0.00 178.44 179.92 1h5w h ALA 35 N 0.50 0.24 -0.35 1.53 0.00 -0.64 -2.98 119.26 117.55 1h5w h ALA 35 Ca -0.06 -0.16 0.07 0.00 0.00 0.00 0.00 54.91 54.76 1h5w h ALA 35 Cb 1.35 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.06 1h5w h ALA 35 CO 0.15 -0.10 0.25 1.88 0.00 0.00 0.00 179.25 181.42 1h5w h TYR 36 N 0.09 0.16 -0.16 0.00 0.05 -0.76 -1.99 116.97 114.36 1h5w h TYR 36 Ca 0.05 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.84 1h5w h TYR 36 Cb 0.30 -0.05 0.00 0.00 1.01 0.00 0.00 36.73 37.99 1h5w h TYR 36 CO 0.02 0.08 0.00 0.00 -1.05 0.00 0.00 178.16 177.21 1h5w n GLN 37 N -4.47 2.04 -0.15 4.88 -0.00 -1.15 -4.50 117.38 114.03 1h5w n GLN 37 Ca 0.05 -1.55 -0.03 0.00 -0.00 0.00 0.00 57.00 55.47 1h5w n GLN 37 Cb 0.32 -1.46 0.06 0.00 -0.00 0.00 0.00 30.24 29.16 1h5w n GLN 37 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.06 176.99 1h5w h LEU 38 N 3.35 0.01 -9.58 2.61 3.38 -1.21 -3.42 115.31 110.46 1h5w h LEU 38 Ca 0.00 0.09 -0.65 0.00 0.09 0.00 0.00 57.88 57.40 1h5w h LEU 38 Cb 0.73 0.12 -0.10 0.00 0.09 0.00 0.00 40.66 41.50 1h5w h LEU 38 CO 0.00 0.03 -0.58 -0.36 0.09 0.00 0.00 178.44 177.62 1h5w s PHE 39 N -6.14 3.26 -0.10 1.13 0.40 -1.26 -0.25 117.98 115.02 1h5w s PHE 39 Ca -0.13 0.18 0.03 0.00 -0.60 0.00 0.00 56.93 56.40 1h5w s PHE 39 Cb 0.15 -1.71 0.01 0.00 0.51 0.00 0.00 43.02 41.98 1h5w s PHE 39 CO 0.73 0.54 -0.19 -2.00 0.70 0.00 0.00 175.22 175.00 1h5w s GLU 40 N -1.89 2.57 0.05 0.44 2.12 0.46 -4.73 118.70 117.72 1h5w s GLU 40 Ca 0.24 -0.70 0.00 0.00 0.36 0.00 0.00 54.97 54.87 1h5w s GLU 40 Cb -0.12 -2.04 -0.04 0.00 0.26 0.00 0.00 34.13 32.19 1h5w s GLU 40 CO 0.16 0.06 0.17 -1.58 -0.54 0.00 0.00 175.26 173.52 1h5w s TRP 41 N 0.64 3.43 0.06 5.30 0.52 -1.26 -1.65 118.94 125.99 1h5w s TRP 41 Ca -0.13 0.22 0.04 0.00 0.02 0.00 0.00 56.10 56.25 1h5w s TRP 41 Cb -0.16 -1.74 -0.03 0.00 -1.15 0.00 0.00 33.47 30.39 1h5w s TRP 41 CO 0.04 0.58 -0.12 -1.21 0.02 0.00 0.00 176.95 176.26 1h5w s GLU 42 N -2.35 0.72 -1.33 4.98 2.02 0.16 -4.83 118.70 118.06 1h5w s GLU 42 Ca 0.32 -0.90 -0.05 0.00 0.02 0.00 0.00 54.97 54.36 1h5w s GLU 42 Cb -0.13 -0.62 0.01 0.00 0.10 0.00 0.00 34.13 33.48 1h5w s GLU 42 CO 0.24 0.13 0.69 0.09 0.02 0.00 0.00 175.26 176.43 1h5w n ASN 43 N 1.29 -5.71 -4.82 -0.19 3.02 -1.26 -1.17 115.26 106.42 1h5w n ASN 43 Ca -0.21 -0.32 -0.36 0.00 -0.03 0.00 0.00 54.58 53.66 1h5w n ASN 43 Cb 0.54 -4.48 -0.06 0.00 -0.61 0.00 0.00 39.78 35.17 1h5w n ASN 43 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1h5w s LEU 44 N -6.14 4.29 0.43 3.41 1.43 -1.26 -4.11 118.68 116.73 1h5w s LEU 44 Ca 0.34 1.43 -0.24 0.00 -1.03 0.00 0.00 54.13 54.63 1h5w s LEU 44 Cb -0.15 -3.71 -0.10 0.00 0.03 0.00 0.00 46.19 42.26 1h5w s LEU 44 CO 0.42 -0.02 1.13 -2.65 0.23 0.00 0.00 176.35 175.46 1h5w n PRO 45 N 0.51 1.57 0.01 1.29 -0.02 -1.26 -4.81 135.00 132.30 1h5w n PRO 45 Ca -0.01 0.56 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 1h5w n PRO 45 Cb 0.51 -2.20 0.02 0.00 -0.02 0.00 0.00 33.50 31.82 1h5w n PRO 45 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1h5w n PRO 46 N 0.02 0.01 0.00 0.52 -0.04 -1.26 -1.14 135.00 133.11 1h5w n PRO 46 Ca 0.08 0.46 0.13 0.00 -0.04 0.00 0.00 63.50 64.14 1h5w n PRO 46 Cb 0.40 -1.56 0.31 0.00 -0.04 0.00 0.00 33.50 32.61 1h5w n PRO 46 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1h5w n THR 47 N -1.49 0.00 -3.58 0.52 -2.24 -1.26 -4.83 114.28 101.40 1h5w n THR 47 Ca -0.00 -0.33 -0.38 0.00 -2.27 0.00 0.00 64.05 61.08 1h5w n THR 47 Cb 0.04 0.91 -0.10 0.00 -2.10 0.00 0.00 70.33 69.08 1h5w n THR 47 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1h5w s ILE 48 N -2.09 5.31 -0.51 2.28 -1.09 -0.29 -4.72 121.20 120.08 1h5w s ILE 48 Ca 0.31 0.24 -0.24 0.00 -2.23 0.00 0.00 60.65 58.74 1h5w s ILE 48 Cb 0.20 -3.55 0.04 0.00 -1.58 0.00 0.00 42.46 37.57 1h5w s ILE 48 CO 0.36 0.27 0.87 0.21 -1.23 0.00 0.00 174.94 175.42 1h5w s ASN 49 N 1.50 6.37 0.32 3.58 3.84 -1.26 -4.88 114.94 124.41 1h5w s ASN 49 Ca 0.09 -0.29 0.00 0.00 0.21 0.00 0.00 52.86 52.87 1h5w s ASN 49 Cb -0.15 -2.41 0.53 0.00 -0.55 0.00 0.00 41.25 38.67 1h5w s ASN 49 CO 0.09 -1.10 1.98 1.55 -2.79 0.00 0.00 177.10 176.82 1h5w h PRO 50 N 9.18 0.98 0.07 0.43 0.13 -1.96 0.19 132.00 141.02 1h5w h PRO 50 Ca -0.26 -0.06 -0.00 0.00 -0.87 0.00 0.00 66.00 64.81 1h5w h PRO 50 Cb 1.08 -0.22 0.00 0.00 0.13 0.00 0.00 31.00 31.99 1h5w h PRO 50 CO 1.04 0.65 -0.03 1.03 -0.23 0.00 0.00 178.00 180.45 1h5w h SER 51 N 1.01 -0.08 -0.63 1.44 0.87 -1.97 -1.11 113.55 113.07 1h5w h SER 51 Ca 0.29 -0.07 -0.00 0.00 -1.23 0.00 0.00 61.79 60.79 1h5w h SER 51 Cb -0.06 0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 61.89 1h5w h SER 51 CO -0.07 0.01 0.39 0.15 -0.53 0.00 0.00 176.83 176.79 1h5w h PHE 52 N -0.17 0.82 0.08 2.24 3.57 -1.88 -1.09 116.94 120.51 1h5w h PHE 52 Ca -0.01 0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.52 1h5w h PHE 52 Cb 0.14 -0.27 -0.04 0.00 2.79 0.00 0.00 35.95 38.57 1h5w h PHE 52 CO -0.05 0.55 -0.31 1.25 -2.23 0.00 0.00 178.31 177.52 1h5w h LEU 53 N 0.86 -0.89 -0.54 0.59 5.85 -0.25 -1.34 115.31 119.59 1h5w h LEU 53 Ca 0.23 0.11 -0.13 0.00 0.84 0.00 0.00 57.88 58.92 1h5w h LEU 53 Cb -0.05 0.35 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 1h5w h LEU 53 CO -0.05 -0.39 -0.26 -0.33 -0.34 0.00 0.00 178.44 177.08 1h5w h GLU 54 N -0.50 0.90 -0.32 1.25 4.39 -1.11 -2.54 114.58 116.66 1h5w h GLU 54 Ca 0.04 -0.40 0.04 0.00 0.34 0.00 0.00 59.36 59.38 1h5w h GLU 54 Cb 0.55 -0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 29.14 1h5w h GLU 54 CO -0.21 1.05 0.07 0.87 -1.16 0.00 0.00 179.01 179.64 1h5w h LYS 55 N 0.77 0.18 -0.39 2.33 1.57 -1.03 -1.92 116.57 118.09 1h5w h LYS 55 Ca 0.09 -0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.88 1h5w h LYS 55 Cb 0.82 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.06 1h5w h LYS 55 CO 0.07 0.12 0.23 0.77 -0.57 0.00 0.00 179.45 180.07 1h5w h SER 56 N 0.19 0.38 -0.79 0.86 0.02 -1.18 0.95 113.55 113.97 1h5w h SER 56 Ca 0.15 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.09 1h5w h SER 56 Cb 0.15 -0.08 -0.04 0.00 0.14 0.00 0.00 62.40 62.57 1h5w h SER 56 CO -0.19 0.28 0.45 0.40 -1.14 0.00 0.00 176.83 176.63 1h5w h ILE 57 N 0.47 1.23 -0.21 3.27 2.04 -1.16 0.18 117.51 123.32 1h5w h ILE 57 Ca 0.15 -0.55 -0.10 0.00 1.00 0.00 0.00 64.86 65.35 1h5w h ILE 57 Cb -0.01 0.16 -0.00 0.00 -0.74 0.00 0.00 36.82 36.23 1h5w h ILE 57 CO -0.06 0.25 -0.27 0.45 0.00 0.00 0.00 178.15 178.52 1h5w h HIS 58 N 1.09 0.69 -0.16 1.37 3.86 -1.10 0.50 115.15 121.39 1h5w h HIS 58 Ca 0.28 -0.22 -0.18 0.00 -1.16 0.00 0.00 60.37 59.09 1h5w h HIS 58 Cb 0.01 -0.14 -0.00 0.00 1.06 0.00 0.00 27.41 28.34 1h5w h HIS 58 CO -0.00 0.93 -0.64 1.96 0.86 0.00 0.00 177.93 181.04 1h5w h GLN 59 N 0.25 0.59 0.00 2.45 4.20 -0.63 0.49 115.11 122.45 1h5w h GLN 59 Ca 0.03 -0.42 0.00 0.00 0.06 0.00 0.00 58.65 58.32 1h5w h GLN 59 Cb 0.84 0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.69 1h5w h GLN 59 CO 0.06 1.03 -1.32 1.19 -0.67 0.00 0.00 178.83 179.13 1h5w n PHE 60 N -3.93 0.00 0.00 2.96 3.01 0.60 -4.79 117.46 115.32 1h5w n PHE 60 Ca -0.04 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.42 1h5w n PHE 60 Cb 0.66 -0.22 0.00 0.00 -0.01 0.00 0.00 39.48 39.91 1h5w n PHE 60 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1h5w n GLY 61 N 1.62 0.08 3.60 1.37 0.00 0.15 -4.48 105.19 107.54 1h5w n GLY 61 Ca -0.01 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.02 1h5w n GLY 61 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1h5w s TYR 62 N -2.00 -0.04 0.02 1.61 1.13 -1.14 -0.49 117.35 116.44 1h5w s TYR 62 Ca 0.00 -0.03 -0.14 0.00 -1.41 0.00 0.00 57.07 55.49 1h5w s TYR 62 Cb 0.00 0.53 0.02 0.00 -1.10 0.00 0.00 41.96 41.41 1h5w s TYR 62 CO 0.00 -0.20 0.30 0.54 -2.51 0.00 0.00 175.55 173.68 1h5w s VAL 63 N -2.33 0.08 0.11 -3.49 0.11 -0.21 -4.14 120.40 110.53 1h5w s VAL 63 Ca 0.14 -0.63 -0.14 0.00 -2.93 0.00 0.00 61.98 58.42 1h5w s VAL 63 Cb 0.05 -0.83 -0.07 0.00 -1.53 0.00 0.00 36.38 34.00 1h5w s VAL 63 CO -0.05 -0.34 0.51 -0.83 -3.33 0.00 0.00 175.10 171.06 1h5w s GLY 64 N -1.83 2.48 -0.24 6.54 0.00 0.54 -0.36 107.32 114.45 1h5w s GLY 64 Ca -0.08 -0.15 0.01 0.00 0.00 0.00 0.00 44.72 44.50 1h5w s GLY 64 CO -0.01 0.15 -0.06 -0.12 0.00 0.00 0.00 173.10 173.06 1h5w s PHE 65 N -1.35 2.51 -0.02 1.90 5.36 0.19 -1.22 117.98 125.36 1h5w s PHE 65 Ca 0.34 -1.83 0.01 0.00 -0.96 0.00 0.00 56.93 54.48 1h5w s PHE 65 Cb -0.16 -1.63 0.01 0.00 -0.34 0.00 0.00 43.02 40.90 1h5w s PHE 65 CO 0.18 -0.79 -0.02 -0.47 -1.46 0.00 0.00 175.22 172.66 1h5w s TYR 66 N 1.36 0.36 -0.74 10.12 5.04 -0.68 -0.51 117.35 132.30 1h5w s TYR 66 Ca -0.06 -0.05 -0.21 0.00 -2.44 0.00 0.00 57.07 54.30 1h5w s TYR 66 Cb -0.19 -0.32 0.09 0.00 0.35 0.00 0.00 41.96 41.89 1h5w s TYR 66 CO -0.06 -0.07 1.01 0.21 -1.34 0.00 0.00 175.55 175.31 1h5w s LYS 67 N 0.39 3.26 -0.07 4.97 2.20 -1.26 -0.26 119.74 128.97 1h5w s LYS 67 Ca -0.04 -1.12 -0.30 0.00 -0.36 0.00 0.00 55.97 54.15 1h5w s LYS 67 Cb -0.07 -4.46 -0.02 0.00 -1.51 0.00 0.00 37.83 31.77 1h5w s LYS 67 CO -0.01 -1.81 1.06 0.34 -0.36 0.00 0.00 175.35 174.57 1h5w s ASP 68 N 3.71 7.21 0.44 1.43 -1.08 -0.97 -4.82 116.67 122.60 1h5w s ASP 68 Ca 0.25 1.64 0.26 0.00 -0.52 0.00 0.00 52.55 54.19 1h5w s ASP 68 Cb -0.13 -2.56 1.31 0.00 -1.46 0.00 0.00 42.92 40.07 1h5w s ASP 68 CO 0.04 -0.45 1.73 -0.65 0.52 0.00 0.00 175.17 176.36 1h5w h PRO 69 N 7.12 0.21 0.00 4.34 0.11 -1.95 0.69 132.00 142.51 1h5w h PRO 69 Ca -0.34 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.76 1h5w h PRO 69 Cb 1.16 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1h5w h PRO 69 CO 0.84 0.14 -0.66 0.28 -0.21 0.00 0.00 178.00 178.39 1h5w n VAL 70 N -4.53 1.30 1.44 3.15 0.31 -1.26 -4.61 118.33 114.13 1h5w n VAL 70 Ca 0.29 0.22 0.12 0.00 -0.01 0.00 0.00 64.34 64.96 1h5w n VAL 70 Cb 1.14 -2.28 0.48 0.00 -0.91 0.00 0.00 33.84 32.28 1h5w n VAL 70 CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81 1h5w n ILE 71 N -4.30 0.11 -4.20 2.52 -5.35 -1.21 -5.06 119.36 101.87 1h5w n ILE 71 Ca -0.09 -0.26 0.01 0.00 -0.27 0.00 0.00 62.75 62.13 1h5w n ILE 71 Cb 0.35 0.29 -0.00 0.00 -1.74 0.00 0.00 39.64 38.54 1h5w n ILE 71 CO 0.00 0.00 0.00 -0.24 -1.76 0.00 0.00 176.55 174.55 1h5w n SER 72 N 0.08 -3.02 -4.54 7.28 2.88 0.24 -4.85 113.62 111.70 1h5w n SER 72 Ca 0.17 0.06 -0.57 0.00 -1.33 0.00 0.00 58.87 57.20 1h5w n SER 72 Cb 0.30 -0.16 -0.07 0.00 -0.75 0.00 0.00 64.21 63.52 1h5w n SER 72 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 1h5w n TYR 73 N -1.10 0.97 -3.77 0.66 4.02 -1.26 -2.29 117.16 114.40 1h5w n TYR 73 Ca 0.00 0.93 -0.13 0.00 -0.01 0.00 0.00 57.90 58.69 1h5w n TYR 73 Cb 0.02 -2.17 -0.11 0.00 -0.02 0.00 0.00 39.34 37.06 1h5w n TYR 73 CO 0.00 0.00 0.00 -1.50 -1.01 0.00 0.00 176.86 174.35 1h5w s ILE 74 N 0.32 -0.00 -0.25 -0.72 2.07 0.64 -4.38 121.20 118.88 1h5w s ILE 74 Ca 0.90 0.01 -0.14 0.00 -1.41 0.00 0.00 60.65 60.01 1h5w s ILE 74 Cb -1.18 -0.41 -0.04 0.00 0.13 0.00 0.00 42.46 40.96 1h5w s ILE 74 CO 0.55 0.00 0.30 0.00 -1.91 0.00 0.00 174.94 173.89 1h5w s ALA 75 N 0.21 3.57 0.04 1.50 0.00 -1.26 -1.68 121.76 124.14 1h5w s ALA 75 Ca -0.00 -0.81 0.03 0.00 0.00 0.00 0.00 51.96 51.17 1h5w s ALA 75 Cb -0.02 -2.57 -0.02 0.00 0.00 0.00 0.00 23.12 20.50 1h5w s ALA 75 CO -0.00 -0.46 -0.09 0.00 0.00 0.00 0.00 175.76 175.22 1h5w s ASN 77 N -1.40 6.48 0.00 0.00 0.01 -1.26 -0.34 114.94 118.43 1h5w s ASN 77 Ca -0.07 0.56 0.00 0.00 -0.71 0.00 0.00 52.86 52.64 1h5w s ASN 77 Cb -0.09 -2.08 0.00 0.00 0.41 0.00 0.00 41.25 39.49 1h5w s ASN 77 CO 0.01 0.09 0.00 0.61 -1.51 0.00 0.00 177.10 176.29 1h5w n GLY 78 N 0.23 -0.84 3.79 0.66 0.00 -1.26 -2.01 105.19 105.76 1h5w n GLY 78 Ca -0.04 -0.69 -0.35 0.00 0.00 0.00 0.00 46.02 44.94 1h5w n GLY 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h5w s ALA 79 N -1.00 3.60 -0.19 4.61 0.00 -0.79 -4.88 121.76 123.11 1h5w s ALA 79 Ca 0.00 -0.76 -0.23 0.00 0.00 0.00 0.00 51.96 50.97 1h5w s ALA 79 Cb 0.00 -1.70 -0.02 0.00 0.00 0.00 0.00 23.12 21.40 1h5w s ALA 79 CO 0.00 0.63 0.74 -0.51 0.00 0.00 0.00 175.76 176.62 1h5w s LEU 80 N -1.16 4.16 0.00 0.00 1.43 -1.26 -1.22 118.68 120.62 1h5w s LEU 80 Ca 0.17 1.02 0.00 0.00 -1.03 0.00 0.00 54.13 54.28 1h5w s LEU 80 Cb -0.12 -3.08 0.00 0.00 0.03 0.00 0.00 46.19 43.02 1h5w s LEU 80 CO 0.06 -0.35 0.00 -0.24 0.23 0.00 0.00 176.35 176.05 1h5w n SER 81 N 5.19 0.00 0.00 2.29 2.88 0.85 -5.00 113.62 119.83 1h5w n SER 81 Ca 0.02 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.56 1h5w n SER 81 Cb 0.49 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.95 1h5w n SER 81 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1h5w n GLY 82 N 0.00 -2.34 3.57 0.46 0.00 -1.26 -1.45 105.19 104.16 1h5w n GLY 82 Ca 0.00 -1.80 -0.42 0.00 0.00 0.00 0.00 46.02 43.80 1h5w n GLY 82 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1h5w s GLN 83 N -0.30 3.62 0.52 1.61 -0.21 -1.26 -4.77 119.66 118.86 1h5w s GLN 83 Ca 0.00 0.11 -0.21 0.00 0.02 0.00 0.00 55.36 55.28 1h5w s GLN 83 Cb 0.00 -3.85 -0.08 0.00 1.00 0.00 0.00 33.01 30.07 1h5w s GLN 83 CO 0.00 -0.91 0.83 0.54 -2.12 0.00 0.00 175.29 173.63 1h5w n ARG 84 N 6.42 0.92 -0.80 2.91 5.12 -1.26 -4.35 116.66 125.62 1h5w n ARG 84 Ca 0.02 0.34 -0.06 0.00 -1.93 0.00 0.00 57.85 56.22 1h5w n ARG 84 Cb 0.48 -1.95 0.04 0.00 -1.16 0.00 0.00 32.46 29.87 1h5w n ARG 84 CO 0.00 0.00 0.00 -0.40 -1.93 0.00 0.00 177.63 175.30 1h5w n ASP 85 N 0.16 0.19 0.17 0.55 3.85 -0.72 -4.83 116.55 115.93 1h5w n ASP 85 Ca 0.11 -1.20 0.12 0.00 -0.71 0.00 0.00 54.79 53.11 1h5w n ASP 85 Cb 0.44 -0.20 0.60 0.00 -1.35 0.00 0.00 41.12 40.61 1h5w n ASP 85 CO 0.00 0.00 0.00 -0.37 -1.01 0.00 0.00 177.20 175.82 1h5w h VAL 86 N -0.79 0.00 -0.34 2.12 -1.51 -1.94 -0.05 116.25 113.76 1h5w h VAL 86 Ca -0.09 -0.04 0.00 0.00 -1.23 0.00 0.00 66.70 65.34 1h5w h VAL 86 Cb 0.30 0.57 0.00 0.00 -2.13 0.00 0.00 31.29 30.03 1h5w h VAL 86 CO 0.08 0.00 0.00 -1.22 -1.23 0.00 0.00 177.57 175.20 1h5w n TYR 87 N -2.29 0.92 -2.08 5.19 0.53 -1.26 -4.95 117.16 113.22 1h5w n TYR 87 Ca -0.01 -0.74 -0.19 0.00 -1.02 0.00 0.00 57.90 55.94 1h5w n TYR 87 Cb 0.06 -0.24 -0.03 0.00 -1.03 0.00 0.00 39.34 38.10 1h5w n TYR 87 CO 0.00 0.00 0.00 -1.71 -1.02 0.00 0.00 176.86 174.13 1h5w n ASN 88 N -0.02 -5.35 -4.87 7.72 4.05 -0.03 -4.99 115.26 111.77 1h5w n ASN 88 Ca 0.19 0.14 -0.31 0.00 0.45 0.00 0.00 54.58 55.06 1h5w n ASN 88 Cb 0.78 -4.43 -0.04 0.00 1.23 0.00 0.00 39.78 37.32 1h5w n ASN 88 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 177.26 173.11 1h5w s GLN 89 N -4.47 3.81 0.43 1.20 -0.21 -1.26 -4.74 119.66 114.41 1h5w s GLN 89 Ca 0.00 0.36 -0.23 0.00 0.02 0.00 0.00 55.36 55.52 1h5w s GLN 89 Cb 0.00 -2.53 -0.09 0.00 1.00 0.00 0.00 33.01 31.40 1h5w s GLN 89 CO 0.00 0.16 1.04 0.00 -2.12 0.00 0.00 175.29 174.37 1h5w s ALA 90 N -2.06 3.02 -0.25 6.09 0.00 -1.26 -1.75 121.76 125.55 1h5w s ALA 90 Ca 0.49 0.66 0.03 0.00 0.00 0.00 0.00 51.96 53.14 1h5w s ALA 90 Cb -0.11 -3.26 -0.02 0.00 0.00 0.00 0.00 23.12 19.74 1h5w s ALA 90 CO 0.25 -0.23 0.28 0.25 0.00 0.00 0.00 175.76 176.31 1h5w n THR 91 N -0.37 0.00 -3.95 0.00 -2.24 -0.94 -4.81 114.28 101.96 1h5w n THR 91 Ca 0.06 -0.44 -0.14 0.00 -2.27 0.00 0.00 64.05 61.26 1h5w n THR 91 Cb 0.51 1.02 -0.15 0.00 -2.10 0.00 0.00 70.33 69.61 1h5w n THR 91 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1h5w s VAL 92 N -1.03 0.14 -0.14 2.28 1.01 -0.53 -0.59 120.40 121.54 1h5w s VAL 92 Ca 0.02 -0.03 -0.01 0.00 0.00 0.00 0.00 61.98 61.96 1h5w s VAL 92 Cb 0.03 -0.15 -0.01 0.00 0.00 0.00 0.00 36.38 36.24 1h5w s VAL 92 CO 0.11 0.06 -0.12 0.12 0.00 0.00 0.00 175.10 175.28 1h5w s PHE 93 N 0.21 2.84 -0.62 5.22 5.36 0.27 -0.11 117.98 131.16 1h5w s PHE 93 Ca -0.02 -0.68 -0.02 0.00 -0.96 0.00 0.00 56.93 55.25 1h5w s PHE 93 Cb -0.04 -1.88 0.16 0.00 -0.34 0.00 0.00 43.02 40.92 1h5w s PHE 93 CO -0.01 -0.25 0.42 0.50 -1.46 0.00 0.00 175.22 174.43 1h5w s ARG 94 N 0.50 2.51 -0.38 10.12 3.52 -0.36 -1.11 118.95 133.76 1h5w s ARG 94 Ca -0.08 -2.54 -0.28 0.00 -0.13 0.00 0.00 55.73 52.70 1h5w s ARG 94 Cb -0.16 -3.70 -0.07 0.00 -1.56 0.00 0.00 34.95 29.47 1h5w s ARG 94 CO 0.04 -1.17 2.33 0.00 -0.81 0.00 0.00 175.30 175.69 1h5w n ALA 95 N 3.46 1.23 -2.90 6.12 0.00 0.18 -1.89 120.51 126.71 1h5w n ALA 95 Ca 0.08 -0.54 -0.40 0.00 0.00 0.00 0.00 53.44 52.58 1h5w n ALA 95 Cb 0.37 -3.00 -0.11 0.00 0.00 0.00 0.00 19.45 16.71 1h5w n ALA 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1h5w s ALA 96 N 10.01 3.24 -0.16 0.00 0.00 -0.85 -2.59 121.76 131.41 1h5w s ALA 96 Ca 1.02 -1.63 -0.27 0.00 0.00 0.00 0.00 51.96 51.08 1h5w s ALA 96 Cb -0.34 -2.48 0.07 0.00 0.00 0.00 0.00 23.12 20.36 1h5w s ALA 96 CO 0.33 -1.24 0.69 0.45 0.00 0.00 0.00 175.76 175.99 1h5w s SER 97 N 1.55 -0.69 0.00 0.00 0.15 -0.38 -4.55 113.70 109.78 1h5w s SER 97 Ca 0.02 1.08 0.14 0.00 0.70 0.00 0.00 55.95 57.89 1h5w s SER 97 Cb -0.19 1.02 0.69 0.00 -1.71 0.00 0.00 66.02 65.83 1h5w s SER 97 CO 0.06 -0.41 1.38 -0.81 1.20 0.00 0.00 173.24 174.66 1h5w n PRO 98 N 1.87 0.17 -0.00 5.44 -0.04 -1.26 -2.61 135.00 138.57 1h5w n PRO 98 Ca -0.16 0.17 0.00 0.00 -0.04 0.00 0.00 63.50 63.47 1h5w n PRO 98 Cb 0.56 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.51 1h5w n PRO 98 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1h5w n VAL 99 N -1.31 0.01 -3.80 0.52 0.31 -1.26 -5.03 118.33 107.77 1h5w n VAL 99 Ca 0.06 -0.02 -0.14 0.00 -0.01 0.00 0.00 64.34 64.23 1h5w n VAL 99 Cb 0.12 0.11 -0.15 0.00 -0.91 0.00 0.00 33.84 33.00 1h5w n VAL 99 CO 0.00 0.00 0.00 -0.47 -1.32 0.00 0.00 176.83 175.04 1h5w s TYR 100 N -2.04 0.01 -0.06 3.52 5.04 -1.07 -5.14 117.35 117.61 1h5w s TYR 100 Ca -0.00 0.12 -0.02 0.00 -2.44 0.00 0.00 57.07 54.72 1h5w s TYR 100 Cb 0.00 -0.16 0.04 0.00 0.35 0.00 0.00 41.96 42.19 1h5w s TYR 100 CO 0.03 -0.07 0.13 1.14 -1.34 0.00 0.00 175.55 175.43 1h5w s GLN 101 N 0.78 0.04 -0.23 4.97 1.03 -1.26 -1.24 119.66 123.75 1h5w s GLN 101 Ca -0.06 0.40 -0.28 0.00 0.04 0.00 0.00 55.36 55.45 1h5w s GLN 101 Cb -0.09 -0.24 0.14 0.00 0.03 0.00 0.00 33.01 32.85 1h5w s GLN 101 CO -0.02 -0.22 1.11 0.21 -2.54 0.00 0.00 175.29 173.83 1h5w s LYS 102 N 1.54 0.43 -0.06 9.60 2.47 -1.07 -4.99 119.74 127.66 1h5w s LYS 102 Ca -0.05 0.24 0.05 0.00 -1.56 0.00 0.00 55.97 54.65 1h5w s LYS 102 Cb -0.12 0.20 -0.02 0.00 -1.46 0.00 0.00 37.83 36.44 1h5w s LYS 102 CO -0.05 -0.11 -0.20 -1.21 0.16 0.00 0.00 175.35 173.94 1h5w s GLU 103 N -0.61 2.55 -0.01 4.03 2.02 -1.26 0.49 118.70 125.91 1h5w s GLU 103 Ca 0.02 -0.81 -0.16 0.00 0.02 0.00 0.00 54.97 54.04 1h5w s GLU 103 Cb -0.02 -2.27 0.03 0.00 0.10 0.00 0.00 34.13 31.96 1h5w s GLU 103 CO -0.04 0.48 0.34 -0.59 0.02 0.00 0.00 175.26 175.47 1h5w s PHE 104 N -0.39 -0.21 0.46 1.61 -0.12 -0.27 -4.98 117.98 114.08 1h5w s PHE 104 Ca 0.04 0.31 -0.22 0.00 -0.05 0.00 0.00 56.93 57.00 1h5w s PHE 104 Cb -0.12 0.13 -0.08 0.00 -0.63 0.00 0.00 43.02 42.31 1h5w s PHE 104 CO 0.02 -0.42 1.08 0.15 -0.05 0.00 0.00 175.22 176.00 1h5w s LYS 105 N -1.46 3.87 -0.17 1.99 1.02 -1.26 -0.56 119.74 123.16 1h5w s LYS 105 Ca -0.12 1.54 -0.09 0.00 0.02 0.00 0.00 55.97 57.32 1h5w s LYS 105 Cb -0.04 -2.31 -0.05 0.00 -0.52 0.00 0.00 37.83 34.91 1h5w s LYS 105 CO 0.04 -0.41 0.13 -0.51 -0.92 0.00 0.00 175.35 173.69 1h5w s LEU 106 N -3.12 4.28 -0.36 3.17 1.43 0.24 -0.09 118.68 124.23 1h5w s LEU 106 Ca 0.64 0.33 -0.26 0.00 -1.03 0.00 0.00 54.13 53.80 1h5w s LEU 106 Cb -0.22 -2.08 0.01 0.00 0.03 0.00 0.00 46.19 43.93 1h5w s LEU 106 CO 0.27 0.27 0.94 -0.47 0.23 0.00 0.00 176.35 177.59 1h5w s TYR 107 N -0.21 3.10 0.00 0.29 5.04 0.07 -4.85 117.35 120.79 1h5w s TYR 107 Ca 0.11 0.83 0.00 0.00 -2.44 0.00 0.00 57.07 55.57 1h5w s TYR 107 Cb -0.11 -3.63 0.00 0.00 0.35 0.00 0.00 41.96 38.57 1h5w s TYR 107 CO 0.00 -0.80 0.00 0.09 -1.34 0.00 0.00 175.55 173.50 1h5w n ASN 108 N 6.75 4.76 -4.13 4.32 3.02 -1.26 -4.85 115.26 123.87 1h5w n ASN 108 Ca 0.08 0.00 -0.28 0.00 -0.03 0.00 0.00 54.58 54.34 1h5w n ASN 108 Cb 0.48 0.74 -0.17 0.00 -0.61 0.00 0.00 39.78 40.23 1h5w n ASN 108 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1h5w s TYR 109 N -1.92 2.03 0.18 3.10 2.02 -1.26 -5.05 117.35 116.44 1h5w s TYR 109 Ca 0.00 -0.79 -0.24 0.00 -0.37 0.00 0.00 57.07 55.67 1h5w s TYR 109 Cb 0.00 -1.40 0.07 0.00 -0.40 0.00 0.00 41.96 40.23 1h5w s TYR 109 CO 0.00 -0.34 1.46 -2.13 -1.57 0.00 0.00 175.55 172.97 1h5w n ARG 110 N 3.64 -0.33 0.08 -0.62 0.63 -1.26 -1.64 116.66 117.16 1h5w n ARG 110 Ca -0.21 1.44 -0.10 0.00 -0.92 0.00 0.00 57.85 58.06 1h5w n ARG 110 Cb 0.52 -2.13 -0.05 0.00 0.45 0.00 0.00 32.46 31.25 1h5w n ARG 110 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 1h5w h ASP 111 N 0.00 0.28 0.00 6.15 3.32 -2.04 -3.35 116.42 120.78 1h5w h ASP 111 Ca 0.23 -0.25 -0.33 0.00 0.02 0.00 0.00 57.03 56.70 1h5w h ASP 111 Cb 0.47 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.91 1h5w h ASP 111 CO -0.91 1.10 1.45 0.23 -1.72 0.00 0.00 179.24 179.38 1h5w n MET 112 N -3.60 2.22 -3.36 3.56 2.81 -0.65 -4.89 117.12 113.20 1h5w n MET 112 Ca -0.04 -1.29 -0.34 0.00 -1.81 0.00 0.00 57.70 54.22 1h5w n MET 112 Cb 0.87 -2.25 -0.06 0.00 -0.71 0.00 0.00 33.22 31.08 1h5w n MET 112 CO 0.00 0.00 0.00 0.21 1.51 0.00 0.00 175.97 177.69 1h5w s LYS 113 N 2.06 3.93 0.05 0.03 2.20 -1.25 -4.65 119.74 122.11 1h5w s LYS 113 Ca 0.54 0.44 -0.17 0.00 -0.36 0.00 0.00 55.97 56.42 1h5w s LYS 113 Cb 0.20 -2.82 0.03 0.00 -1.51 0.00 0.00 37.83 33.73 1h5w s LYS 113 CO -0.02 0.41 0.38 -1.21 -0.36 0.00 0.00 175.35 174.55 1h5w s GLU 114 N -2.26 0.89 0.56 4.03 2.02 -1.26 -5.16 118.70 117.52 1h5w s GLU 114 Ca 0.41 -0.43 -0.18 0.00 0.02 0.00 0.00 54.97 54.80 1h5w s GLU 114 Cb -0.14 0.39 -0.05 0.00 0.10 0.00 0.00 34.13 34.44 1h5w s GLU 114 CO 0.20 -0.30 1.09 -1.21 0.02 0.00 0.00 175.26 175.06 1h5w s GLU 115 N -2.57 3.33 -1.27 1.61 2.02 -1.26 -3.78 118.70 116.78 1h5w s GLU 115 Ca -0.05 1.44 0.00 0.00 0.02 0.00 0.00 54.97 56.38 1h5w s GLU 115 Cb -0.01 -2.02 0.00 0.00 0.10 0.00 0.00 34.13 32.21 1h5w s GLU 115 CO -0.03 -0.83 0.00 -3.47 0.02 0.00 0.00 175.26 170.94 1h5w n ASP 116 N -1.59 -4.49 -4.96 -0.19 2.03 -1.26 -5.01 116.55 101.08 1h5w n ASP 116 Ca 0.10 0.30 -0.19 0.00 0.52 0.00 0.00 54.79 55.52 1h5w n ASP 116 Cb 0.52 -3.05 -0.01 0.00 -0.72 0.00 0.00 41.12 37.86 1h5w n ASP 116 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1h5w s MET 117 N -2.99 2.96 0.00 -0.67 0.23 -1.25 -4.35 119.30 113.24 1h5w s MET 117 Ca 0.00 -1.13 0.00 0.00 -1.03 0.00 0.00 55.69 53.53 1h5w s MET 117 Cb 0.00 -2.72 0.00 0.00 -1.53 0.00 0.00 34.83 30.58 1h5w s MET 117 CO 0.00 0.00 0.00 0.41 -2.03 0.00 0.00 175.02 173.40 1h5w n GLY 118 N -1.62 5.54 2.98 3.16 0.00 0.87 -4.64 105.19 111.49 1h5w n GLY 118 Ca 0.01 -1.92 -0.14 0.00 0.00 0.00 0.00 46.02 43.97 1h5w n GLY 118 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1h5w s VAL 119 N -0.52 0.39 -0.18 1.61 1.01 0.33 -0.75 120.40 122.29 1h5w s VAL 119 Ca 0.00 -0.52 -0.07 0.00 0.00 0.00 0.00 61.98 61.39 1h5w s VAL 119 Cb 0.00 -0.39 -0.04 0.00 0.00 0.00 0.00 36.38 35.95 1h5w s VAL 119 CO 0.00 -0.10 0.05 -0.69 0.00 0.00 0.00 175.10 174.36 1h5w s VAL 120 N -0.61 4.65 -0.30 2.92 1.01 -1.26 0.57 120.40 127.38 1h5w s VAL 120 Ca -0.03 -0.08 -0.11 0.00 0.00 0.00 0.00 61.98 61.75 1h5w s VAL 120 Cb -0.05 -3.09 -0.03 0.00 0.00 0.00 0.00 36.38 33.21 1h5w s VAL 120 CO -0.00 0.46 0.19 -0.63 0.00 0.00 0.00 175.10 175.13 1h5w s ILE 121 N 0.39 5.12 0.10 2.22 1.01 0.51 -4.84 121.20 125.72 1h5w s ILE 121 Ca 0.02 -0.08 -0.10 0.00 0.00 0.00 0.00 60.65 60.49 1h5w s ILE 121 Cb -0.13 -3.53 -0.06 0.00 0.01 0.00 0.00 42.46 38.75 1h5w s ILE 121 CO 0.01 0.13 0.42 -0.31 0.00 0.00 0.00 174.94 175.19 1h5w s TYR 122 N 1.71 3.56 0.30 3.97 1.51 -1.26 -1.04 117.35 126.10 1h5w s TYR 122 Ca 0.06 0.80 0.18 0.00 -1.01 0.00 0.00 57.07 57.10 1h5w s TYR 122 Cb -0.17 -2.17 0.83 0.00 -0.11 0.00 0.00 41.96 40.35 1h5w s TYR 122 CO 0.10 0.49 1.83 -0.97 -1.11 0.00 0.00 175.55 175.88 1h5w h ASN 123 N 3.54 0.00 -5.59 2.29 -0.00 -1.01 -3.33 115.58 111.48 1h5w h ASN 123 Ca -0.49 0.00 0.25 0.00 -0.00 0.00 0.00 56.30 56.06 1h5w h ASN 123 Cb 1.19 0.00 -0.07 0.00 -0.00 0.00 0.00 38.32 39.44 1h5w h ASN 123 CO 0.67 0.34 0.71 0.54 -0.00 0.00 0.00 177.43 179.69 1h5w s ASN 124 N -6.58 -0.03 0.04 1.15 4.22 -1.26 -4.30 114.94 108.17 1h5w s ASN 124 Ca -0.02 -0.40 0.05 0.00 -2.14 0.00 0.00 52.86 50.35 1h5w s ASN 124 Cb 0.13 0.33 0.22 0.00 1.28 0.00 0.00 41.25 43.21 1h5w s ASN 124 CO 0.68 -0.64 1.14 0.47 -2.04 0.00 0.00 177.10 176.71 1h5w n ASP 125 N -0.93 0.08 -0.45 3.54 10.43 -1.26 -1.43 116.55 126.52 1h5w n ASP 125 Ca -0.03 0.53 0.06 0.00 2.57 0.00 0.00 54.79 57.93 1h5w n ASP 125 Cb 0.60 -0.54 0.04 0.00 1.84 0.00 0.00 41.12 43.06 1h5w n ASP 125 CO 0.00 0.00 0.00 0.23 -1.07 0.00 0.00 177.20 176.36 1h5w n MET 126 N -1.60 0.94 -2.43 -1.24 2.81 -1.26 -4.98 117.12 109.37 1h5w n MET 126 Ca 0.00 -1.13 -0.20 0.00 -1.81 0.00 0.00 57.70 54.56 1h5w n MET 126 Cb 0.03 -1.22 -0.01 0.00 -0.71 0.00 0.00 33.22 31.31 1h5w n MET 126 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1h5w n ALA 127 N 0.53 -0.65 -2.32 3.04 0.00 -0.51 -4.96 120.51 115.64 1h5w n ALA 127 Ca 0.07 0.16 -0.40 0.00 0.00 0.00 0.00 53.44 53.27 1h5w n ALA 127 Cb 0.30 -2.15 -0.05 0.00 0.00 0.00 0.00 19.45 17.55 1h5w n ALA 127 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1h5w s PHE 128 N -2.99 3.77 0.74 0.00 2.99 -1.26 -4.43 117.98 116.81 1h5w s PHE 128 Ca 0.01 1.53 -0.12 0.00 0.00 0.00 0.00 56.93 58.34 1h5w s PHE 128 Cb -0.00 -2.83 0.04 0.00 0.00 0.00 0.00 43.02 40.23 1h5w s PHE 128 CO 0.01 0.31 1.11 -2.14 -0.00 0.00 0.00 175.22 174.51 1h5w s PRO 129 N -0.24 2.33 -0.02 0.24 0.02 -1.26 -4.49 135.00 131.58 1h5w s PRO 129 Ca 0.39 1.31 0.09 0.00 0.02 0.00 0.00 61.00 62.81 1h5w s PRO 129 Cb -0.21 -1.90 -0.23 0.00 0.02 0.00 0.00 34.50 32.18 1h5w s PRO 129 CO 0.24 -1.61 0.74 1.15 -0.33 0.00 0.00 177.00 177.20 1h5w h THR 130 N -0.76 0.98 -0.83 0.99 2.02 -0.28 -3.41 112.91 111.61 1h5w h THR 130 Ca -0.45 -2.79 0.09 0.00 0.77 0.00 0.00 66.41 64.03 1h5w h THR 130 Cb 1.24 2.51 -0.11 0.00 -1.74 0.00 0.00 68.15 70.05 1h5w h THR 130 CO 0.51 0.61 -0.55 0.74 0.37 0.00 0.00 175.52 177.20 1h5w h THR 131 N 0.01 0.01 -0.75 3.16 2.02 -1.88 -1.57 112.91 113.90 1h5w h THR 131 Ca -0.25 0.00 0.19 0.00 0.77 0.00 0.00 66.41 67.12 1h5w h THR 131 Cb 1.98 0.01 -0.04 0.00 -1.74 0.00 0.00 68.15 68.36 1h5w h THR 131 CO 0.09 0.00 0.52 1.55 0.37 0.00 0.00 175.52 178.06 1h5w h PRO 132 N -0.11 0.16 -0.18 6.66 0.13 -1.93 0.59 132.00 137.32 1h5w h PRO 132 Ca 0.16 -0.01 -0.20 0.00 -0.87 0.00 0.00 66.00 65.08 1h5w h PRO 132 Cb 0.48 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.58 1h5w h PRO 132 CO -0.85 0.11 -0.67 1.15 -0.23 0.00 0.00 178.00 177.52 1h5w h THR 133 N 0.17 1.30 -0.61 1.56 2.02 -1.58 -1.46 112.91 114.30 1h5w h THR 133 Ca 0.37 -1.91 -0.04 0.00 0.77 0.00 0.00 66.41 65.61 1h5w h THR 133 Cb 1.21 1.87 -0.03 0.00 -1.74 0.00 0.00 68.15 69.46 1h5w h THR 133 CO -0.06 0.60 0.23 -0.07 0.37 0.00 0.00 175.52 176.59 1h5w h LEU 134 N 0.51 0.85 -0.75 2.58 3.38 -0.66 -1.77 115.31 119.45 1h5w h LEU 134 Ca -0.02 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 57.73 1h5w h LEU 134 Cb 1.27 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.76 1h5w h LEU 134 CO 0.13 0.80 0.31 -0.33 0.09 0.00 0.00 178.44 179.44 1h5w h GLU 135 N 0.85 1.11 -0.01 1.13 5.08 -0.91 0.80 114.58 122.64 1h5w h GLU 135 Ca 0.20 -0.20 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1h5w h GLU 135 Cb 0.22 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.29 1h5w h GLU 135 CO -0.01 0.90 0.01 1.25 -1.00 0.00 0.00 179.01 180.16 1h5w h LEU 136 N 1.07 0.01 -0.52 1.33 5.85 -0.88 -1.58 115.31 120.59 1h5w h LEU 136 Ca 0.25 -0.00 -0.16 0.00 0.84 0.00 0.00 57.88 58.81 1h5w h LEU 136 Cb 0.20 -0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.22 1h5w h LEU 136 CO -0.02 0.01 -0.50 -0.26 -0.34 0.00 0.00 178.44 177.33 1h5w h PHE 137 N 0.01 0.77 -0.89 1.25 -1.00 -1.18 -2.69 116.94 113.22 1h5w h PHE 137 Ca 0.00 -0.26 0.02 0.00 2.81 0.00 0.00 57.97 60.55 1h5w h PHE 137 Cb 0.00 -0.15 -0.05 0.00 3.61 0.00 0.00 35.95 39.36 1h5w h PHE 137 CO -0.08 1.00 0.59 0.00 -1.61 0.00 0.00 178.31 178.21 1h5w h ALA 138 N 0.95 1.40 -0.29 2.45 0.00 -0.70 0.14 119.26 123.21 1h5w h ALA 138 Ca 0.02 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.76 1h5w h ALA 138 Cb 1.04 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1h5w h ALA 138 CO 0.10 0.53 -0.31 0.00 0.00 0.00 0.00 179.25 179.57 1h5w h ALA 139 N 1.46 0.92 -0.20 0.00 0.00 -1.16 -0.72 119.26 119.57 1h5w h ALA 139 Ca 0.34 -0.39 -0.18 0.00 0.00 0.00 0.00 54.91 54.68 1h5w h ALA 139 Cb -0.06 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 1h5w h ALA 139 CO -0.09 0.62 -0.60 1.49 0.00 0.00 0.00 179.25 180.67 1h5w h GLU 140 N 0.52 0.66 -0.40 0.00 4.57 -1.04 -1.40 114.58 117.48 1h5w h GLU 140 Ca 0.06 -0.44 -0.09 0.00 -1.18 0.00 0.00 59.36 57.70 1h5w h GLU 140 Cb 0.79 0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.43 1h5w h GLU 140 CO 0.06 1.06 -0.12 -0.07 -1.18 0.00 0.00 179.01 178.77 1h5w h LEU 141 N 0.49 0.80 -0.86 1.64 3.38 -0.82 -2.17 115.31 117.77 1h5w h LEU 141 Ca -0.00 -0.37 -0.08 0.00 0.09 0.00 0.00 57.88 57.52 1h5w h LEU 141 Cb 1.18 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.69 1h5w h LEU 141 CO 0.12 0.99 0.01 0.00 0.09 0.00 0.00 178.44 179.65 1h5w h ALA 142 N 0.84 1.05 -0.51 1.53 0.00 -1.10 -1.48 119.26 119.59 1h5w h ALA 142 Ca 0.10 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.68 1h5w h ALA 142 Cb 0.65 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1h5w h ALA 142 CO 0.04 0.59 0.08 1.49 0.00 0.00 0.00 179.25 181.46 1h5w h GLU 143 N 0.80 0.85 -0.59 0.00 4.81 -1.10 -1.50 114.58 117.85 1h5w h GLU 143 Ca 0.15 -0.23 -0.08 0.00 -0.13 0.00 0.00 59.36 59.07 1h5w h GLU 143 Cb 0.46 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.72 1h5w h GLU 143 CO 0.02 0.85 0.06 -0.07 -0.73 0.00 0.00 179.01 179.13 1h5w h LEU 144 N 0.73 0.95 -1.26 1.64 3.38 -1.16 -1.30 115.31 118.29 1h5w h LEU 144 Ca 0.16 -0.23 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 1h5w h LEU 144 Cb 0.41 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 1h5w h LEU 144 CO 0.01 0.97 0.19 0.50 0.09 0.00 0.00 178.44 180.20 1h5w h LYS 145 N 0.92 0.70 -0.30 1.13 3.11 -0.99 -0.27 116.57 120.88 1h5w h LYS 145 Ca 0.18 -0.10 -0.15 0.00 -2.81 0.00 0.00 60.65 57.77 1h5w h LYS 145 Cb 0.46 -0.13 -0.00 0.00 -1.00 0.00 0.00 32.23 31.56 1h5w h LYS 145 CO 0.02 0.58 -0.41 1.49 -2.81 0.00 0.00 179.45 178.32 1h5w h GLU 146 N 0.69 0.80 -0.56 1.90 4.81 -0.69 -1.08 114.58 120.46 1h5w h GLU 146 Ca 0.17 -0.47 -0.08 0.00 -0.13 0.00 0.00 59.36 58.85 1h5w h GLU 146 Cb 0.15 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.55 1h5w h GLU 146 CO -0.01 1.10 0.03 0.82 -0.73 0.00 0.00 179.01 180.21 1h5w h ILE 147 N 0.57 1.25 -0.49 2.32 2.04 -0.91 -1.41 117.51 120.88 1h5w h ILE 147 Ca 0.03 -1.05 -0.02 0.00 1.00 0.00 0.00 64.86 64.82 1h5w h ILE 147 Cb 1.00 0.79 -0.02 0.00 -0.74 0.00 0.00 36.82 37.85 1h5w h ILE 147 CO 0.10 0.38 0.24 0.40 0.00 0.00 0.00 178.15 179.27 1h5w h ILE 148 N 0.88 1.19 -0.70 -0.67 2.04 -0.94 -0.25 117.51 119.06 1h5w h ILE 148 Ca 0.17 -0.52 0.01 0.00 1.00 0.00 0.00 64.86 65.52 1h5w h ILE 148 Cb 0.48 0.64 -0.04 0.00 -0.74 0.00 0.00 36.82 37.16 1h5w h ILE 148 CO 0.02 0.21 0.46 0.28 0.00 0.00 0.00 178.15 179.11 1h5w h SER 149 N 0.64 0.78 -0.19 1.72 0.02 -0.77 -0.34 113.55 115.42 1h5w h SER 149 Ca 0.17 -0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 61.09 1h5w h SER 149 Cb 0.11 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.45 1h5w h SER 149 CO -0.02 0.56 0.08 0.58 -1.14 0.00 0.00 176.83 176.89 1h5w h VAL 150 N 0.92 1.15 -0.53 2.27 2.07 -0.91 -1.92 116.25 119.31 1h5w h VAL 150 Ca 0.26 -0.46 -0.08 0.00 0.82 0.00 0.00 66.70 67.25 1h5w h VAL 150 Cb -0.08 1.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.78 1h5w h VAL 150 CO -0.07 0.15 0.02 -1.13 0.02 0.00 0.00 177.57 176.56 1h5w h ASN 151 N 0.15 0.90 -0.35 0.57 -0.00 -0.71 -1.07 115.58 115.08 1h5w h ASN 151 Ca 0.06 -0.30 -0.10 0.00 -0.00 0.00 0.00 56.30 55.96 1h5w h ASN 151 Cb 0.16 -0.24 -0.02 0.00 -0.00 0.00 0.00 38.32 38.22 1h5w h ASN 151 CO -0.01 0.98 -0.14 0.06 -0.00 0.00 0.00 177.43 178.32 1h5w h GLN 152 N 0.80 0.80 -0.29 6.67 3.07 -1.07 -2.79 115.11 122.30 1h5w h GLN 152 Ca 0.15 -0.29 -0.09 0.00 0.09 0.00 0.00 58.65 58.52 1h5w h GLN 152 Cb 0.51 -0.06 -0.02 0.00 0.08 0.00 0.00 27.48 27.99 1h5w h GLN 152 CO 0.02 0.90 -0.19 -0.97 0.09 0.00 0.00 178.83 178.69 1h5w h ASN 153 N 0.72 0.53 0.28 0.06 -0.73 -1.18 -2.27 115.58 113.00 1h5w h ASN 153 Ca 0.11 -0.16 0.00 0.00 1.87 0.00 0.00 56.30 58.12 1h5w h ASN 153 Cb 0.64 -0.14 0.00 0.00 0.27 0.00 0.00 38.32 39.09 1h5w h ASN 153 CO 0.04 0.73 0.00 0.00 -0.37 0.00 0.00 177.43 177.83 1h5w h ALA 154 N 1.32 1.00 0.00 1.57 0.00 -0.92 -2.24 119.26 120.00 1h5w h ALA 154 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1h5w h ALA 154 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1h5w h ALA 154 CO 0.04 0.00 0.00 1.96 0.00 0.00 0.00 179.25 181.25 1h5w h GLN 155 N 0.00 0.00 0.00 0.00 1.08 -1.35 -2.98 115.11 111.87 1h5w h GLN 155 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1h5w h GLN 155 Cb 0.14 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.57 1h5w h GLN 155 CO 0.00 0.00 0.00 0.87 -0.95 0.00 0.00 178.83 178.75 1h5w h LYS 156 N 0.00 0.00 -2.17 1.46 1.57 -1.57 -3.38 116.57 112.48 1h5w h LYS 156 Ca 0.00 0.00 -0.59 0.00 -1.87 0.00 0.00 60.65 58.19 1h5w h LYS 156 Cb 0.45 0.00 -0.42 0.00 0.08 0.00 0.00 32.23 32.34 1h5w h LYS 156 CO 0.00 0.00 -0.68 0.25 -0.57 0.00 0.00 179.45 178.45 1h5w n THR 157 N -3.09 1.95 0.36 -0.16 -2.24 -1.12 -4.86 114.28 105.11 1h5w n THR 157 Ca 0.03 -5.07 0.12 0.00 -2.27 0.00 0.00 64.05 56.85 1h5w n THR 157 Cb 0.44 -2.00 0.15 0.00 -2.10 0.00 0.00 70.33 66.82 1h5w n THR 157 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1h5w h PRO 158 N 4.04 0.00 -5.65 -0.78 0.13 -1.77 -3.39 132.00 124.57 1h5w h PRO 158 Ca 0.17 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.77 1h5w h PRO 158 Cb 0.68 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 31.53 1h5w h PRO 158 CO 0.78 0.00 -0.83 0.08 -0.23 0.00 0.00 178.00 177.80 1h5w s VAL 159 N -3.23 1.37 -0.07 1.56 1.01 -1.26 -0.11 120.40 119.67 1h5w s VAL 159 Ca 0.05 -0.78 0.01 0.00 0.00 0.00 0.00 61.98 61.26 1h5w s VAL 159 Cb 0.10 -1.14 0.02 0.00 0.00 0.00 0.00 36.38 35.36 1h5w s VAL 159 CO 0.71 0.35 -0.09 -0.22 0.00 0.00 0.00 175.10 175.86 1h5w s LEU 160 N -0.50 1.41 -0.15 3.92 2.96 -0.41 -4.90 118.68 121.01 1h5w s LEU 160 Ca 0.06 -0.25 -0.00 0.00 -0.22 0.00 0.00 54.13 53.73 1h5w s LEU 160 Cb -0.07 -0.72 -0.01 0.00 0.50 0.00 0.00 46.19 45.90 1h5w s LEU 160 CO -0.00 -0.03 -0.14 -0.63 -1.32 0.00 0.00 176.35 174.22 1h5w s ILE 161 N 1.04 2.80 -0.25 6.68 1.01 -1.26 -0.01 121.20 131.20 1h5w s ILE 161 Ca -0.08 -0.73 -0.10 0.00 0.00 0.00 0.00 60.65 59.74 1h5w s ILE 161 Cb -0.14 -2.18 -0.05 0.00 0.01 0.00 0.00 42.46 40.09 1h5w s ILE 161 CO -0.00 0.51 0.16 -0.60 0.00 0.00 0.00 174.94 175.00 1h5w s ARG 162 N 0.73 3.99 0.09 2.79 3.52 0.26 -4.98 118.95 125.35 1h5w s ARG 162 Ca -0.06 -0.31 0.07 0.00 -0.13 0.00 0.00 55.73 55.30 1h5w s ARG 162 Cb -0.15 -3.54 -0.03 0.00 -1.56 0.00 0.00 34.95 29.66 1h5w s ARG 162 CO 0.01 -0.03 -0.18 0.00 -0.81 0.00 0.00 175.30 174.29 1h5w s ALA 163 N 1.31 1.53 0.00 6.12 0.00 -1.26 -1.94 121.76 127.52 1h5w s ALA 163 Ca 0.07 -1.13 0.00 0.00 0.00 0.00 0.00 51.96 50.90 1h5w s ALA 163 Cb -0.14 -0.18 0.00 0.00 0.00 0.00 0.00 23.12 22.79 1h5w s ALA 163 CO 0.06 0.28 0.00 0.09 0.00 0.00 0.00 175.76 176.19 1h5w n ASN 164 N 1.19 0.00 0.00 0.00 5.03 -1.08 -5.05 115.26 115.36 1h5w n ASN 164 Ca -0.20 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.25 1h5w n ASN 164 Cb 0.54 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.30 1h5w n ASN 164 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 1h5w n ASP 165 N 0.00 0.00 0.00 6.41 8.00 -1.26 -5.15 116.55 124.55 1h5w n ASP 165 Ca 0.00 0.14 0.00 0.00 0.71 0.00 0.00 54.79 55.64 1h5w n ASP 165 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1h5w n ASP 165 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 1h5w n SER 170 N -0.25 0.00 -0.12 -2.24 2.88 -1.26 -5.17 113.62 107.46 1h5w n SER 170 Ca 0.00 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.42 1h5w n SER 170 Cb 0.00 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.44 1h5w n SER 170 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 1h5w h LEU 171 N 0.00 0.79 -0.85 2.46 6.46 -2.01 -2.30 115.31 119.86 1h5w h LEU 171 Ca 0.00 -0.41 0.03 0.00 -0.12 0.00 0.00 57.88 57.38 1h5w h LEU 171 Cb 0.00 -0.22 -0.05 0.00 -0.73 0.00 0.00 40.66 39.66 1h5w h LEU 171 CO 0.00 1.03 0.55 0.50 -0.62 0.00 0.00 178.44 179.90 1h5w h LYS 172 N 0.56 1.05 -0.34 1.25 1.63 -2.02 -1.66 116.57 117.03 1h5w h LYS 172 Ca 0.08 -0.06 -0.05 0.00 -0.85 0.00 0.00 60.65 59.77 1h5w h LYS 172 Cb 0.73 -0.24 -0.02 0.00 -0.60 0.00 0.00 32.23 32.11 1h5w h LYS 172 CO 0.06 0.69 0.02 1.96 -3.45 0.00 0.00 179.45 178.73 1h5w h GLN 173 N 1.08 0.53 -0.74 1.90 4.20 -1.94 0.83 115.11 120.97 1h5w h GLN 173 Ca 0.34 -0.11 -0.05 0.00 0.06 0.00 0.00 58.65 58.89 1h5w h GLN 173 Cb -0.01 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 27.66 1h5w h GLN 173 CO -0.11 0.54 0.25 0.28 -0.67 0.00 0.00 178.83 179.12 1h5w h VAL 174 N 0.51 1.26 -0.32 -0.54 2.07 -0.74 -0.24 116.25 118.24 1h5w h VAL 174 Ca 0.11 -0.87 -0.14 0.00 0.82 0.00 0.00 66.70 66.62 1h5w h VAL 174 Cb 0.30 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 1h5w h VAL 174 CO 0.01 0.35 -0.38 1.88 0.02 0.00 0.00 177.57 179.44 1h5w h TYR 175 N 1.09 0.91 -0.51 1.57 -1.99 -0.77 -2.03 116.97 115.24 1h5w h TYR 175 Ca 0.24 -0.26 -0.05 0.00 2.00 0.00 0.00 58.73 60.66 1h5w h TYR 175 Cb 0.28 -0.19 -0.02 0.00 2.00 0.00 0.00 36.73 38.79 1h5w h TYR 175 CO 0.02 1.02 0.13 -0.91 -0.00 0.00 0.00 178.16 178.42 1h5w h ASN 176 N 0.63 0.72 -0.49 3.88 2.35 -0.35 -2.74 115.58 119.57 1h5w h ASN 176 Ca 0.06 -0.12 0.00 0.00 -0.55 0.00 0.00 56.30 55.69 1h5w h ASN 176 Cb 0.93 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 39.11 1h5w h ASN 176 CO 0.08 0.71 0.00 0.00 -1.65 0.00 0.00 177.43 176.57 1h5w n GLN 177 N -4.29 2.24 -1.92 0.81 1.13 -0.15 -4.95 117.38 110.25 1h5w n GLN 177 Ca 0.04 -1.92 -0.42 0.00 -1.94 0.00 0.00 57.00 52.76 1h5w n GLN 177 Cb 0.22 -1.43 -0.03 0.00 0.11 0.00 0.00 30.24 29.10 1h5w n GLN 177 CO 0.00 0.00 0.00 -0.47 -1.44 0.00 0.00 177.06 175.15 1h5w s TYR 178 N -1.35 2.63 -2.08 1.08 5.04 -0.78 -4.90 117.35 116.99 1h5w s TYR 178 Ca 0.36 0.41 0.23 0.00 -2.44 0.00 0.00 57.07 55.64 1h5w s TYR 178 Cb 0.19 -3.96 0.04 0.00 0.35 0.00 0.00 41.96 38.59 1h5w s TYR 178 CO 0.26 -3.74 1.12 0.39 -1.34 0.00 0.00 175.55 172.24 1h5w n GLU 179 N 5.05 1.26 -1.28 4.97 1.02 -1.26 -4.97 120.64 125.43 1h5w n GLU 179 Ca 0.15 -1.03 -0.10 0.00 -0.02 0.00 0.00 57.16 56.16 1h5w n GLU 179 Cb 0.40 -1.48 -0.04 0.00 -0.02 0.00 0.00 31.44 30.30 1h5w n GLU 179 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1h5w n GLY 180 N 1.41 1.09 0.79 0.62 0.00 -1.26 -4.87 105.19 102.98 1h5w n GLY 180 Ca 0.10 -0.43 0.10 0.00 0.00 0.00 0.00 46.02 45.78 1h5w n GLY 180 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1h5w n ASN 181 N 0.07 2.35 0.00 1.61 5.03 -1.26 -4.96 115.26 118.10 1h5w n ASN 181 Ca -0.10 -1.87 0.00 0.00 0.87 0.00 0.00 54.58 53.48 1h5w n ASN 181 Cb 0.36 -0.21 0.00 0.00 -1.02 0.00 0.00 39.78 38.91 1h5w n ASN 181 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1h5w n ALA 182 N 0.77 0.00 -1.09 5.41 0.00 -1.26 -5.15 120.51 119.20 1h5w n ALA 182 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.28 1h5w n ALA 182 Cb 0.41 0.00 0.13 0.00 0.00 0.00 0.00 19.45 19.99 1h5w n ALA 182 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1h5w s PRO 183 N -2.00 1.63 0.18 0.00 0.02 -1.26 -4.89 135.00 128.67 1h5w s PRO 183 Ca 0.00 1.71 -0.31 0.00 0.02 0.00 0.00 61.00 62.42 1h5w s PRO 183 Cb 0.00 -1.78 -0.09 0.00 0.02 0.00 0.00 34.50 32.65 1h5w s PRO 183 CO 0.00 -2.21 1.46 0.08 -0.33 0.00 0.00 177.00 176.00 1h5w s VAL 184 N -2.23 2.87 -0.10 3.83 1.01 -1.26 -5.00 120.40 119.53 1h5w s VAL 184 Ca 0.72 0.66 0.03 0.00 0.00 0.00 0.00 61.98 63.39 1h5w s VAL 184 Cb -0.27 -3.42 0.01 0.00 0.00 0.00 0.00 36.38 32.69 1h5w s VAL 184 CO 0.51 0.07 -0.18 -0.63 0.00 0.00 0.00 175.10 174.86 1h5w s ILE 185 N 0.75 1.68 -0.31 2.22 1.01 -1.26 -5.09 121.20 120.20 1h5w s ILE 185 Ca 0.65 -0.78 0.03 0.00 0.00 0.00 0.00 60.65 60.55 1h5w s ILE 185 Cb -0.41 -1.49 0.08 0.00 0.01 0.00 0.00 42.46 40.66 1h5w s ILE 185 CO 0.35 0.48 -0.01 0.12 0.00 0.00 0.00 174.94 175.87 1h5w s PHE 186 N 0.64 3.45 -0.03 3.97 5.36 -1.26 -5.01 117.98 125.11 1h5w s PHE 186 Ca -0.13 -2.66 0.03 0.00 -0.96 0.00 0.00 56.93 53.20 1h5w s PHE 186 Cb -0.16 -2.47 0.00 0.00 -0.34 0.00 0.00 43.02 40.05 1h5w s PHE 186 CO 0.04 -0.91 -0.11 0.00 -1.46 0.00 0.00 175.22 172.77 1h5w s ALA 187 N 1.02 1.01 -0.28 11.12 0.00 -1.26 -5.11 121.76 128.26 1h5w s ALA 187 Ca 0.03 -0.41 -0.25 0.00 0.00 0.00 0.00 51.96 51.33 1h5w s ALA 187 Cb -0.19 -0.36 0.13 0.00 0.00 0.00 0.00 23.12 22.70 1h5w s ALA 187 CO -0.08 0.17 1.08 -1.58 0.00 0.00 0.00 175.76 175.36 1h5w s HIS 188 N 0.14 -0.43 0.46 0.00 5.04 -1.26 -5.04 115.29 114.20 1h5w s HIS 188 Ca -0.03 1.03 0.15 0.00 -1.54 0.00 0.00 55.06 54.67 1h5w s HIS 188 Cb -0.09 0.38 1.11 0.00 0.04 0.00 0.00 32.58 34.01 1h5w s HIS 188 CO 0.01 -0.21 2.03 1.49 -2.34 0.00 0.00 174.74 175.72 1h5w h GLU 189 N 4.17 0.28 0.00 2.88 4.81 -2.06 -1.65 114.58 123.01 1h5w h GLU 189 Ca -0.28 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.93 1h5w h GLU 189 Cb 1.18 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.50 1h5w h GLU 189 CO 0.12 0.18 0.00 0.00 -0.73 0.00 0.00 179.01 178.58 1h5w h ALA 190 N 1.77 1.00 -2.66 2.92 0.00 -2.04 -3.45 119.26 116.80 1h5w h ALA 190 Ca 0.20 0.00 -0.51 0.00 0.00 0.00 0.00 54.91 54.59 1h5w h ALA 190 Cb 0.42 0.00 0.10 0.00 0.00 0.00 0.00 17.79 18.31 1h5w h ALA 190 CO -0.04 0.00 0.43 -0.51 0.00 0.00 0.00 179.25 179.13 1h5w s LEU 191 N -4.91 3.62 0.35 0.00 1.43 -0.62 -5.05 118.68 113.50 1h5w s LEU 191 Ca 0.03 2.24 0.06 0.00 -1.03 0.00 0.00 54.13 55.43 1h5w s LEU 191 Cb 0.09 -4.58 -0.03 0.00 0.03 0.00 0.00 46.19 41.70 1h5w s LEU 191 CO 0.43 -1.51 0.23 1.51 0.23 0.00 0.00 176.35 177.24 1h5w s ASP 192 N -1.87 1.93 0.00 2.29 -4.77 -1.26 -5.02 116.67 107.98 1h5w s ASP 192 Ca 0.74 -1.72 0.03 0.00 -3.30 0.00 0.00 52.55 48.30 1h5w s ASP 192 Cb -0.26 0.54 0.17 0.00 -1.09 0.00 0.00 42.92 42.29 1h5w s ASP 192 CO 0.33 -1.02 0.95 -1.20 0.70 0.00 0.00 175.17 174.93 1h5w n SER 193 N -1.43 0.00 -0.16 2.11 7.64 -1.26 -1.99 113.62 118.53 1h5w n SER 193 Ca 0.03 0.26 0.03 0.00 1.01 0.00 0.00 58.87 60.20 1h5w n SER 193 Cb 0.63 -0.30 0.04 0.00 -1.01 0.00 0.00 64.21 63.57 1h5w n SER 193 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1h5w n ASP 194 N -1.30 1.17 0.21 6.43 2.03 -1.26 -4.74 116.55 119.08 1h5w n ASP 194 Ca 0.02 -2.14 0.09 0.00 0.52 0.00 0.00 54.79 53.27 1h5w n ASP 194 Cb 0.03 -0.19 0.36 0.00 -0.72 0.00 0.00 41.12 40.60 1h5w n ASP 194 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1h5w h SER 195 N 0.00 0.00 -3.84 1.67 0.02 -1.78 -3.45 113.55 106.17 1h5w h SER 195 Ca 0.00 0.00 -0.30 0.00 -0.84 0.00 0.00 61.79 60.65 1h5w h SER 195 Cb 1.00 0.00 -0.28 0.00 0.14 0.00 0.00 62.40 63.25 1h5w h SER 195 CO 0.00 0.26 -0.74 -0.63 -1.14 0.00 0.00 176.83 174.58 1h5w s ILE 196 N -3.49 0.28 -0.07 3.27 -1.09 -1.26 -2.63 121.20 116.21 1h5w s ILE 196 Ca 0.02 -0.14 -0.03 0.00 -2.23 0.00 0.00 60.65 58.26 1h5w s ILE 196 Cb 0.09 -0.24 0.04 0.00 -1.58 0.00 0.00 42.46 40.77 1h5w s ILE 196 CO 0.66 0.08 0.15 -0.70 -1.23 0.00 0.00 174.94 173.90 1h5w s GLU 197 N -0.05 0.09 -0.17 2.79 2.12 -0.82 -5.00 118.70 117.66 1h5w s GLU 197 Ca 0.01 0.39 -0.05 0.00 0.36 0.00 0.00 54.97 55.67 1h5w s GLU 197 Cb -0.02 -0.18 -0.03 0.00 0.26 0.00 0.00 34.13 34.16 1h5w s GLU 197 CO -0.00 -0.17 0.00 0.08 -0.54 0.00 0.00 175.26 174.63 1h5w s VAL 198 N 1.24 4.20 0.05 3.70 1.01 -1.26 -0.57 120.40 128.77 1h5w s VAL 198 Ca -0.09 -0.25 0.08 0.00 0.00 0.00 0.00 61.98 61.73 1h5w s VAL 198 Cb -0.12 -2.87 -0.03 0.00 0.00 0.00 0.00 36.38 33.37 1h5w s VAL 198 CO -0.06 0.47 -0.19 -0.36 0.00 0.00 0.00 175.10 174.96 1h5w s PHE 199 N 0.46 2.52 -0.23 5.22 0.40 0.99 -4.99 117.98 122.34 1h5w s PHE 199 Ca -0.01 -0.28 -0.14 0.00 -0.60 0.00 0.00 56.93 55.89 1h5w s PHE 199 Cb -0.14 -1.43 -0.04 0.00 0.51 0.00 0.00 43.02 41.92 1h5w s PHE 199 CO 0.02 0.26 0.34 0.15 0.70 0.00 0.00 175.22 176.69 1h5w s LYS 200 N -1.52 4.10 -0.24 0.44 -0.14 -1.26 -1.29 119.74 119.83 1h5w s LYS 200 Ca 0.15 0.06 0.13 0.00 -1.36 0.00 0.00 55.97 54.94 1h5w s LYS 200 Cb -0.10 -3.57 0.46 0.00 -1.68 0.00 0.00 37.83 32.93 1h5w s LYS 200 CO 0.05 -0.09 1.18 0.25 -0.76 0.00 0.00 175.35 175.98 1h5w n THR 201 N 4.56 1.95 -2.49 2.17 -2.24 0.85 -4.97 114.28 114.11 1h5w n THR 201 Ca -0.10 -3.40 -0.41 0.00 -2.27 0.00 0.00 64.05 57.87 1h5w n THR 201 Cb 0.51 -0.23 -0.04 0.00 -2.10 0.00 0.00 70.33 68.48 1h5w n THR 201 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1h5w s ASP 202 N -3.39 7.24 -0.23 3.42 -4.77 -1.14 -4.40 116.67 113.40 1h5w s ASP 202 Ca 0.41 2.13 -0.10 0.00 -3.30 0.00 0.00 52.55 51.69 1h5w s ASP 202 Cb 0.38 -2.61 -0.05 0.00 -1.09 0.00 0.00 42.92 39.56 1h5w s ASP 202 CO -0.02 -0.23 0.13 0.00 0.70 0.00 0.00 175.17 175.75 1h5w s ALA 203 N -0.31 3.54 0.26 2.11 0.00 -1.26 -5.05 121.76 121.05 1h5w s ALA 203 Ca 0.49 -0.88 -0.29 0.00 0.00 0.00 0.00 51.96 51.29 1h5w s ALA 203 Cb -0.30 -2.23 -0.14 0.00 0.00 0.00 0.00 23.12 20.45 1h5w s ALA 203 CO 0.36 -0.14 1.02 -2.30 0.00 0.00 0.00 175.76 174.70 1h5w n PRO 204 N 4.18 1.27 -2.73 0.00 -0.02 -1.26 -4.86 135.00 131.57 1h5w n PRO 204 Ca -0.15 0.45 -0.43 0.00 -2.02 0.00 0.00 63.50 61.35 1h5w n PRO 204 Cb 0.52 -1.83 -0.03 0.00 -0.02 0.00 0.00 33.50 32.14 1h5w n PRO 204 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1h5w s TYR 205 N -0.88 3.08 -0.03 6.00 5.04 -1.26 -4.85 117.35 124.44 1h5w s TYR 205 Ca 0.61 0.91 0.04 0.00 -2.44 0.00 0.00 57.07 56.20 1h5w s TYR 205 Cb -0.74 -3.74 0.06 0.00 0.35 0.00 0.00 41.96 37.90 1h5w s TYR 205 CO 0.58 -0.85 0.89 1.33 -1.34 0.00 0.00 175.55 176.17 1h5w n VAL 206 N 6.02 0.61 -0.27 3.14 0.24 -1.26 -4.82 118.33 121.99 1h5w n VAL 206 Ca 0.09 -0.70 -0.04 0.00 -2.04 0.00 0.00 64.34 61.66 1h5w n VAL 206 Cb 0.48 0.48 0.07 0.00 -1.47 0.00 0.00 33.84 33.40 1h5w n VAL 206 CO 0.00 0.00 0.00 0.58 -2.14 0.00 0.00 176.83 175.27 1h5w h VAL 207 N 2.93 1.16 -0.64 3.34 2.07 -1.93 0.98 116.25 124.15 1h5w h VAL 207 Ca 0.00 -0.33 -0.04 0.00 0.82 0.00 0.00 66.70 67.15 1h5w h VAL 207 Cb 1.02 0.10 -0.03 0.00 -1.52 0.00 0.00 31.29 30.85 1h5w h VAL 207 CO 0.00 0.18 0.25 -2.24 0.02 0.00 0.00 177.57 175.77 1h5w h ASP 208 N 0.97 0.86 0.04 0.57 2.03 -1.99 0.18 116.42 119.08 1h5w h ASP 208 Ca 0.28 -0.12 -0.24 0.00 -0.73 0.00 0.00 57.03 56.22 1h5w h ASP 208 Cb -0.06 -0.22 0.01 0.00 -0.83 0.00 0.00 39.33 38.23 1h5w h ASP 208 CO -0.08 0.77 -0.92 0.11 -1.03 0.00 0.00 179.24 178.09 1h5w h LYS 209 N 0.92 0.65 -0.68 4.15 1.57 -1.80 -2.38 116.57 118.99 1h5w h LYS 209 Ca 0.22 -0.64 -0.04 0.00 -1.87 0.00 0.00 60.65 58.32 1h5w h LYS 209 Cb 0.19 0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.63 1h5w h LYS 209 CO -0.02 1.24 0.26 -0.07 -0.57 0.00 0.00 179.45 180.29 1h5w h LEU 210 N 0.40 0.94 -1.05 2.94 3.38 -0.48 -1.17 115.31 120.26 1h5w h LEU 210 Ca -0.09 -0.14 -0.04 0.00 0.09 0.00 0.00 57.88 57.70 1h5w h LEU 210 Cb 1.56 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 42.04 1h5w h LEU 210 CO 0.18 0.84 0.19 -1.13 0.09 0.00 0.00 178.44 178.61 1h5w h ASN 211 N 0.99 0.81 -0.47 -0.43 -1.24 -0.57 -0.33 115.58 114.34 1h5w h ASN 211 Ca 0.23 -0.13 -0.12 0.00 0.71 0.00 0.00 56.30 57.00 1h5w h ASN 211 Cb 0.21 -0.21 -0.02 0.00 0.73 0.00 0.00 38.32 39.04 1h5w h ASN 211 CO -0.02 0.76 -0.15 0.00 -1.29 0.00 0.00 177.43 176.72 1h5w h ALA 212 N 1.36 0.78 -0.52 1.57 0.00 -0.82 -1.18 119.26 120.45 1h5w h ALA 212 Ca 0.19 -0.36 -0.08 0.00 0.00 0.00 0.00 54.91 54.66 1h5w h ALA 212 Cb 0.23 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1h5w h ALA 212 CO -0.01 0.66 0.01 0.37 0.00 0.00 0.00 179.25 180.28 1h5w h GLN 213 N 0.85 0.88 -0.62 0.00 5.75 -0.65 -0.91 115.11 120.41 1h5w h GLN 213 Ca 0.13 -0.24 -0.04 0.00 -0.15 0.00 0.00 58.65 58.34 1h5w h GLN 213 Cb 0.71 -0.10 -0.03 0.00 1.07 0.00 0.00 27.48 29.13 1h5w h GLN 213 CO 0.05 0.87 0.23 -0.22 -2.65 0.00 0.00 178.83 177.11 1h5w h LYS 214 N 0.82 0.91 -0.29 1.69 3.64 -0.75 -0.23 116.57 122.35 1h5w h LYS 214 Ca 0.16 -0.15 -0.09 0.00 -1.27 0.00 0.00 60.65 59.29 1h5w h LYS 214 Cb 0.47 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 1h5w h LYS 214 CO 0.02 0.76 -0.22 -0.91 -2.27 0.00 0.00 179.45 176.83 1h5w h ASN 215 N 0.89 0.55 -0.24 4.20 2.35 -0.57 -1.36 115.58 121.39 1h5w h ASN 215 Ca 0.21 -0.18 -0.04 0.00 -0.55 0.00 0.00 56.30 55.73 1h5w h ASN 215 Cb 0.20 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.41 1h5w h ASN 215 CO -0.02 0.77 -0.02 0.00 -1.65 0.00 0.00 177.43 176.51 1h5w h ALA 216 N 1.28 0.33 -0.64 -0.83 0.00 -0.18 0.07 119.26 119.29 1h5w h ALA 216 Ca 0.08 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 1h5w h ALA 216 Cb 0.65 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 1h5w h ALA 216 CO 0.05 0.09 0.40 0.28 0.00 0.00 0.00 179.25 180.06 1h5w h VAL 217 N 0.21 1.18 -0.12 0.00 2.07 -0.97 -0.09 116.25 118.52 1h5w h VAL 217 Ca 0.07 -0.38 -0.00 0.00 0.82 0.00 0.00 66.70 67.21 1h5w h VAL 217 Cb 0.45 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 30.49 1h5w h VAL 217 CO 0.02 0.18 0.07 -0.25 0.02 0.00 0.00 177.57 177.61 1h5w h TRP 218 N 0.87 0.16 -0.00 1.57 2.91 -1.09 -1.47 115.95 118.90 1h5w h TRP 218 Ca 0.23 0.00 -0.03 0.00 1.13 0.00 0.00 58.89 60.22 1h5w h TRP 218 Cb -0.05 -0.05 -0.00 0.00 -0.51 0.00 0.00 29.16 28.54 1h5w h TRP 218 CO -0.02 0.13 -0.14 -0.91 -1.03 0.00 0.00 178.44 176.48 1h5w h ASN 219 N 0.13 0.01 -0.25 2.65 2.35 -0.62 -0.36 115.58 119.48 1h5w h ASN 219 Ca 0.04 -0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.75 1h5w h ASN 219 Cb 0.02 -0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.38 1h5w h ASN 219 CO -0.01 0.14 0.01 -0.08 -1.65 0.00 0.00 177.43 175.84 1h5w h GLU 220 N 0.01 0.44 -0.60 0.81 4.81 -0.48 -1.12 114.58 118.44 1h5w h GLU 220 Ca 0.00 -0.14 -0.00 0.00 -0.13 0.00 0.00 59.36 59.09 1h5w h GLU 220 Cb 0.24 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.55 1h5w h GLU 220 CO 0.02 0.61 0.37 1.98 -0.73 0.00 0.00 179.01 181.26 1h5w h MET 221 N 0.23 0.81 -0.79 1.92 4.05 -0.40 -1.70 114.93 119.05 1h5w h MET 221 Ca 0.07 -0.07 0.01 0.00 -0.28 0.00 0.00 59.70 59.43 1h5w h MET 221 Cb 0.40 -0.17 -0.04 0.00 -0.80 0.00 0.00 31.60 30.99 1h5w h MET 221 CO 0.01 0.58 0.52 0.52 0.23 0.00 0.00 176.91 178.77 1h5w h MET 222 N 0.82 1.04 -0.63 0.39 2.86 -0.91 -2.35 114.93 116.14 1h5w h MET 222 Ca 0.22 -0.06 -0.03 0.00 -2.06 0.00 0.00 59.70 57.76 1h5w h MET 222 Cb -0.04 -0.23 -0.03 0.00 0.06 0.00 0.00 31.60 31.36 1h5w h MET 222 CO -0.04 0.69 0.28 1.15 1.06 0.00 0.00 176.91 180.05 1h5w h THR 223 N 1.07 1.23 -0.85 2.22 2.02 -0.80 0.25 112.91 118.05 1h5w h THR 223 Ca 0.29 -0.68 0.06 0.00 0.77 0.00 0.00 66.41 66.85 1h5w h THR 223 Cb -0.12 0.50 -0.05 0.00 -1.74 0.00 0.00 68.15 66.73 1h5w h THR 223 CO -0.06 0.27 0.56 0.15 0.37 0.00 0.00 175.52 176.80 1h5w h PHE 224 N 0.88 0.98 -0.01 3.16 3.57 -0.95 -0.89 116.94 123.68 1h5w h PHE 224 Ca 0.21 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.74 1h5w h PHE 224 Cb 0.16 -0.32 0.00 0.00 2.79 0.00 0.00 35.95 38.58 1h5w h PHE 224 CO 0.01 0.53 -0.08 1.28 -2.23 0.00 0.00 178.31 177.81 1h5w n LEU 225 N -4.48 0.77 -0.03 0.59 4.77 -0.92 -4.47 117.00 113.24 1h5w n LEU 225 Ca 0.12 -0.18 -0.00 0.00 -0.03 0.00 0.00 56.01 55.92 1h5w n LEU 225 Cb 0.18 -0.09 -0.00 0.00 -2.33 0.00 0.00 43.42 41.18 1h5w n LEU 225 CO 0.33 0.14 -0.00 0.61 -1.33 0.00 0.00 177.39 177.14 1h5w n GLY 226 N 1.21 0.42 3.75 -0.72 0.00 -0.34 -4.55 105.19 104.96 1h5w n GLY 226 Ca 0.17 -0.96 -0.37 0.00 0.00 0.00 0.00 46.02 44.87 1h5w n GLY 226 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1h5w s ILE 227 N -2.01 5.30 0.35 -0.61 1.01 0.81 -4.79 121.20 121.26 1h5w s ILE 227 Ca 0.00 0.55 -0.28 0.00 0.00 0.00 0.00 60.65 60.93 1h5w s ILE 227 Cb 0.00 -3.62 -0.12 0.00 0.01 0.00 0.00 42.46 38.73 1h5w s ILE 227 CO 0.00 0.42 1.28 0.29 0.00 0.00 0.00 174.94 176.92 1h5w n LYS 228 N 3.34 2.07 0.00 2.79 4.01 -1.26 -3.94 118.16 125.17 1h5w n LYS 228 Ca -0.12 0.73 0.00 0.00 -0.51 0.00 0.00 58.31 58.40 1h5w n LYS 228 Cb 0.52 -2.32 0.00 0.00 -0.51 0.00 0.00 35.03 32.72 1h5w n LYS 228 CO 0.00 0.00 0.00 0.27 -1.11 0.00 0.00 177.40 176.56 1h5w n ASN 229 N 0.68 0.00 -4.57 4.39 0.23 -1.26 -4.98 115.26 109.76 1h5w n ASN 229 Ca 0.05 0.00 -0.39 0.00 -0.53 0.00 0.00 54.58 53.71 1h5w n ASN 229 Cb 0.37 0.00 -0.03 0.00 -2.08 0.00 0.00 39.78 38.04 1h5w n ASN 229 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 1h5w s SER 245 N -1.01 5.15 0.00 0.53 1.04 -1.26 -5.10 113.70 113.05 1h5w s SER 245 Ca 0.00 1.02 0.09 0.00 0.48 0.00 0.00 55.95 57.53 1h5w s SER 245 Cb 0.00 -2.52 0.22 0.00 0.10 0.00 0.00 66.02 63.82 1h5w s SER 245 CO 0.00 -2.34 1.15 -0.46 0.98 0.00 0.00 173.24 172.56 1h5w n ASN 246 N 13.13 2.61 -0.03 7.02 6.94 -1.26 -4.70 115.26 138.97 1h5w n ASN 246 Ca 0.28 -1.91 -0.10 0.00 -0.02 0.00 0.00 54.58 52.83 1h5w n ASN 246 Cb 0.51 -0.16 -0.04 0.00 -2.36 0.00 0.00 39.78 37.73 1h5w n ASN 246 CO 0.00 0.00 0.00 -0.78 -1.03 0.00 0.00 177.26 175.45 1h5w h ASP 247 N 1.64 0.11 -0.32 0.53 1.82 -1.99 -1.40 116.42 116.81 1h5w h ASP 247 Ca 0.00 0.01 -0.05 0.00 -0.39 0.00 0.00 57.03 56.60 1h5w h ASP 247 Cb 0.64 -0.01 -0.02 0.00 0.68 0.00 0.00 39.33 40.62 1h5w h ASP 247 CO 0.00 0.09 0.03 -0.08 -1.61 0.00 0.00 179.24 177.67 1h5w h GLU 248 N 0.17 0.65 -0.41 0.28 4.81 -1.99 -0.09 114.58 118.01 1h5w h GLU 248 Ca 0.07 -0.14 -0.07 0.00 -0.13 0.00 0.00 59.36 59.08 1h5w h GLU 248 Cb 0.02 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.30 1h5w h GLU 248 CO -0.06 0.65 -0.03 1.96 -0.73 0.00 0.00 179.01 180.80 1h5w h GLN 249 N 0.62 0.75 -0.27 1.92 4.20 -1.80 0.11 115.11 120.64 1h5w h GLN 249 Ca 0.13 -0.25 -0.09 0.00 0.06 0.00 0.00 58.65 58.50 1h5w h GLN 249 Cb 0.35 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.06 1h5w h GLN 249 CO 0.01 0.85 -0.18 0.82 -0.67 0.00 0.00 178.83 179.65 1h5w h ILE 250 N 0.57 1.30 -0.24 2.54 2.04 -1.04 -1.34 117.51 121.34 1h5w h ILE 250 Ca 0.11 -1.31 -0.01 0.00 1.00 0.00 0.00 64.86 64.65 1h5w h ILE 250 Cb 0.53 1.56 -0.01 0.00 -0.74 0.00 0.00 36.82 38.16 1h5w h ILE 250 CO 0.03 0.41 0.12 -0.08 0.00 0.00 0.00 178.15 178.63 1h5w h GLU 251 N 0.34 0.34 -0.61 2.37 4.57 -0.95 -1.99 114.58 118.66 1h5w h GLU 251 Ca 0.05 -0.05 -0.08 0.00 -1.18 0.00 0.00 59.36 58.11 1h5w h GLU 251 Cb 0.72 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 29.22 1h5w h GLU 251 CO 0.05 0.34 0.07 0.77 -1.18 0.00 0.00 179.01 179.06 1h5w h SER 252 N 0.26 0.98 -0.26 1.04 0.02 -0.77 -0.09 113.55 114.71 1h5w h SER 252 Ca 0.08 -0.24 0.02 0.00 -0.84 0.00 0.00 61.79 60.81 1h5w h SER 252 Cb 0.11 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.37 1h5w h SER 252 CO -0.01 0.99 0.13 0.28 -1.14 0.00 0.00 176.83 177.08 1h5w h SER 253 N 0.95 0.19 0.08 3.07 0.02 -1.05 -2.10 113.55 114.71 1h5w h SER 253 Ca 0.18 0.01 -0.09 0.00 -0.84 0.00 0.00 61.79 61.05 1h5w h SER 253 Cb 0.46 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 62.96 1h5w h SER 253 CO 0.02 0.15 -0.30 1.23 -1.14 0.00 0.00 176.83 176.78 1h5w h GLY 254 N 0.27 0.37 2.00 -3.77 0.00 -1.13 -2.64 103.07 98.19 1h5w h GLY 254 Ca 0.11 -0.31 -0.02 0.00 0.00 0.00 0.00 47.33 47.11 1h5w h GLY 254 CO -0.08 0.28 -0.08 -0.84 0.00 0.00 0.00 176.54 175.82 1h5w h THR 255 N 0.30 0.99 -0.92 4.70 2.02 -0.43 -1.49 112.91 118.08 1h5w h THR 255 Ca 0.04 -0.29 0.09 0.00 0.77 0.00 0.00 66.41 67.02 1h5w h THR 255 Cb 0.69 1.16 -0.07 0.00 -1.74 0.00 0.00 68.15 68.19 1h5w h THR 255 CO 0.05 0.08 0.59 0.58 0.37 0.00 0.00 175.52 177.20 1h5w h VAL 256 N 0.00 1.01 0.19 3.16 2.07 -1.01 0.67 116.25 122.33 1h5w h VAL 256 Ca -0.00 -0.33 -0.35 0.00 0.82 0.00 0.00 66.70 66.84 1h5w h VAL 256 Cb 0.15 -0.05 0.01 0.00 -1.52 0.00 0.00 31.29 29.88 1h5w h VAL 256 CO 0.01 0.18 -1.72 -0.26 0.02 0.00 0.00 177.57 175.80 1h5w h PHE 257 N 0.97 0.72 -0.30 1.57 -1.00 -1.44 -3.38 116.94 114.08 1h5w h PHE 257 Ca 0.42 -0.53 -0.15 0.00 2.81 0.00 0.00 57.97 60.52 1h5w h PHE 257 Cb 0.32 -0.03 -0.01 0.00 3.61 0.00 0.00 35.95 39.85 1h5w h PHE 257 CO -0.00 1.65 -0.41 1.25 -1.61 0.00 0.00 178.31 179.19 1h5w h LEU 258 N 0.11 0.79 -0.17 1.54 5.85 -1.09 -3.23 115.31 119.11 1h5w h LEU 258 Ca -0.33 -0.36 0.05 0.00 0.84 0.00 0.00 57.88 58.08 1h5w h LEU 258 Cb 2.10 -0.22 -0.07 0.00 0.37 0.00 0.00 40.66 42.84 1h5w h LEU 258 CO 0.19 1.10 -0.34 0.50 -0.34 0.00 0.00 178.44 179.54 1h5w h LYS 259 N 0.60 -0.38 -0.98 1.25 3.64 -1.05 0.21 116.57 119.86 1h5w h LYS 259 Ca 0.05 0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.47 1h5w h LYS 259 Cb 0.96 0.09 -0.05 0.00 -0.41 0.00 0.00 32.23 32.81 1h5w h LYS 259 CO 0.09 -0.25 0.65 0.77 -2.27 0.00 0.00 179.45 178.43 1h5w h SER 260 N -0.40 1.11 -0.55 4.20 0.02 -1.74 -1.85 113.55 114.33 1h5w h SER 260 Ca 0.10 -0.02 -0.11 0.00 -0.84 0.00 0.00 61.79 60.92 1h5w h SER 260 Cb 0.56 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.82 1h5w h SER 260 CO -0.39 0.78 -0.09 0.03 -1.14 0.00 0.00 176.83 176.02 1h5w h ARG 261 N 1.30 1.04 -0.35 3.45 3.08 -1.40 -2.33 114.38 119.17 1h5w h ARG 261 Ca 0.37 -0.38 -0.11 0.00 0.07 0.00 0.00 59.98 59.93 1h5w h ARG 261 Cb -0.09 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 29.88 1h5w h ARG 261 CO -0.10 1.07 -0.25 0.93 -1.07 0.00 0.00 179.97 180.55 1h5w h GLU 262 N 0.92 0.70 -0.53 0.04 5.08 -0.65 -1.31 114.58 118.83 1h5w h GLU 262 Ca 0.15 -0.29 -0.10 0.00 -1.00 0.00 0.00 59.36 58.12 1h5w h GLU 262 Cb 0.66 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.86 1h5w h GLU 262 CO 0.05 0.88 -0.05 1.49 -1.00 0.00 0.00 179.01 180.38 1h5w h GLU 263 N 0.61 0.95 -0.03 2.33 4.81 -1.23 -1.74 114.58 120.28 1h5w h GLU 263 Ca 0.08 -0.31 -0.17 0.00 -0.13 0.00 0.00 59.36 58.83 1h5w h GLU 263 Cb 0.74 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.03 1h5w h GLU 263 CO 0.06 0.96 -0.75 0.00 -0.73 0.00 0.00 179.01 178.56 1h5w h ALA 264 N 1.07 0.68 -0.60 2.92 0.00 -1.28 -2.70 119.26 119.37 1h5w h ALA 264 Ca 0.15 -0.64 -0.04 0.00 0.00 0.00 0.00 54.91 54.38 1h5w h ALA 264 Cb 0.57 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 1h5w h ALA 264 CO 0.03 0.83 0.20 0.00 0.00 0.00 0.00 179.25 180.31 1h5w h GLU 266 N 0.87 0.88 -0.49 0.00 4.81 -1.19 -2.18 114.58 117.27 1h5w h GLU 266 Ca 0.20 -0.41 -0.10 0.00 -0.13 0.00 0.00 59.36 58.92 1h5w h GLU 266 Cb 0.23 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.58 1h5w h GLU 266 CO -0.01 1.06 -0.08 0.87 -0.73 0.00 0.00 179.01 180.11 1h5w h LYS 267 N 0.70 0.89 -0.48 1.92 1.57 -1.11 -1.27 116.57 118.80 1h5w h LYS 267 Ca 0.08 -0.30 -0.04 0.00 -1.87 0.00 0.00 60.65 58.53 1h5w h LYS 267 Cb 0.82 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.03 1h5w h LYS 267 CO 0.07 0.94 0.14 0.82 -0.57 0.00 0.00 179.45 180.85 1h5w h ILE 268 N 0.80 1.23 -0.36 1.86 2.04 -0.91 -0.18 117.51 122.00 1h5w h ILE 268 Ca 0.14 -0.77 -0.09 0.00 1.00 0.00 0.00 64.86 65.13 1h5w h ILE 268 Cb 0.60 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 37.49 1h5w h ILE 268 CO 0.04 0.28 -0.12 0.78 0.00 0.00 0.00 178.15 179.13 1h5w h ASN 269 N 0.64 0.72 -0.38 1.72 -0.26 -1.27 -0.87 115.58 115.88 1h5w h ASN 269 Ca 0.15 -0.38 -0.08 0.00 -0.56 0.00 0.00 56.30 55.43 1h5w h ASN 269 Cb 0.28 -0.20 -0.02 0.00 -1.06 0.00 0.00 38.32 37.33 1h5w h ASN 269 CO -0.00 0.94 -0.06 -0.33 -1.06 0.00 0.00 177.43 176.92 1h5w h GLU 270 N 0.50 0.80 0.05 0.81 5.08 -1.12 0.53 114.58 121.23 1h5w h GLU 270 Ca 0.09 -0.24 -0.19 0.00 -1.00 0.00 0.00 59.36 58.02 1h5w h GLU 270 Cb 0.64 -0.08 0.02 0.00 0.50 0.00 0.00 28.75 29.83 1h5w h GLU 270 CO 0.04 0.84 -0.77 1.25 -1.00 0.00 0.00 179.01 179.37 1h5w h LEU 271 N 0.73 0.58 -1.54 1.33 5.85 -0.97 -3.37 115.31 117.92 1h5w h LEU 271 Ca 0.13 -0.82 0.00 0.00 0.84 0.00 0.00 57.88 58.03 1h5w h LEU 271 Cb 0.52 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.37 1h5w h LEU 271 CO 0.03 1.34 -0.03 -1.22 -0.34 0.00 0.00 178.44 178.21 1h5w n TYR 272 N -4.12 0.00 -3.28 1.25 4.01 -0.34 -5.00 117.16 109.69 1h5w n TYR 272 Ca -0.12 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.45 1h5w n TYR 272 Cb 0.77 0.00 0.06 0.00 -0.31 0.00 0.00 39.34 39.85 1h5w n TYR 272 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1h5w n GLY 273 N 0.91 -0.13 4.02 2.72 0.00 0.18 -5.01 105.19 107.88 1h5w n GLY 273 Ca 0.09 -0.01 -0.21 0.00 0.00 0.00 0.00 46.02 45.90 1h5w n GLY 273 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1h5w s LEU 274 N -5.54 3.04 -0.24 0.99 1.43 -1.12 -5.04 118.68 112.21 1h5w s LEU 274 Ca 0.40 -0.91 0.11 0.00 -1.03 0.00 0.00 54.13 52.70 1h5w s LEU 274 Cb -0.18 -1.57 0.45 0.00 0.03 0.00 0.00 46.19 44.92 1h5w s LEU 274 CO 0.53 -1.31 1.19 0.59 0.23 0.00 0.00 176.35 177.58 1h5w n ASN 275 N -2.18 3.19 -4.77 2.29 4.13 -1.26 -4.62 115.26 112.04 1h5w n ASN 275 Ca 0.13 -3.57 -0.40 0.00 1.68 0.00 0.00 54.58 52.43 1h5w n ASN 275 Cb 0.62 -0.42 -0.01 0.00 -1.54 0.00 0.00 39.78 38.43 1h5w n ASN 275 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1h5w s VAL 276 N -3.73 2.56 0.05 2.41 1.01 -1.26 -4.65 120.40 116.79 1h5w s VAL 276 Ca 0.43 0.53 0.02 0.00 0.00 0.00 0.00 61.98 62.96 1h5w s VAL 276 Cb 0.39 -3.32 -0.03 0.00 0.00 0.00 0.00 36.38 33.42 1h5w s VAL 276 CO -0.02 0.10 -0.08 -0.54 0.00 0.00 0.00 175.10 174.56 1h5w s LYS 277 N -2.09 0.57 0.00 2.72 1.02 -0.32 -4.90 119.74 116.75 1h5w s LYS 277 Ca 0.54 -0.82 0.00 0.00 0.02 0.00 0.00 55.97 55.71 1h5w s LYS 277 Cb -0.40 -0.31 -0.00 0.00 -0.52 0.00 0.00 37.83 36.59 1h5w s LYS 277 CO 0.52 0.05 -0.02 0.54 -0.92 0.00 0.00 175.35 175.52 1h5w s VAL 278 N -1.59 0.13 0.33 3.17 0.11 -1.26 0.36 120.40 121.64 1h5w s VAL 278 Ca -0.07 -0.21 -0.18 0.00 -2.93 0.00 0.00 61.98 58.58 1h5w s VAL 278 Cb -0.09 -0.14 0.03 0.00 -1.53 0.00 0.00 36.38 34.66 1h5w s VAL 278 CO 0.00 -0.05 0.74 -1.59 -3.33 0.00 0.00 175.10 170.86 1h5w s LYS 279 N -0.28 1.98 0.16 1.54 -2.85 -0.66 -4.93 119.74 114.70 1h5w s LYS 279 Ca -0.02 -1.21 -0.30 0.00 -1.00 0.00 0.00 55.97 53.44 1h5w s LYS 279 Cb -0.02 0.61 -0.08 0.00 -2.06 0.00 0.00 37.83 36.28 1h5w s LYS 279 CO -0.00 -0.91 1.28 -0.06 0.10 0.00 0.00 175.35 175.75 1h5w s PHE 280 N -3.21 3.33 0.32 1.78 0.40 -1.26 -0.40 117.98 118.95 1h5w s PHE 280 Ca 0.14 1.24 0.02 0.00 -0.60 0.00 0.00 56.93 57.72 1h5w s PHE 280 Cb -0.05 -3.54 0.55 0.00 0.51 0.00 0.00 43.02 40.49 1h5w s PHE 280 CO 0.09 -1.69 1.92 -0.09 0.70 0.00 0.00 175.22 176.15 1h5w h ARG 281 N 5.81 0.75 -6.08 0.44 2.43 -0.86 -3.42 114.38 113.46 1h5w h ARG 281 Ca -0.44 -0.11 -0.56 0.00 -0.81 0.00 0.00 59.98 58.07 1h5w h ARG 281 Cb 1.21 -0.14 -0.05 0.00 -0.42 0.00 0.00 29.97 30.58 1h5w h ARG 281 CO 0.79 0.61 0.11 -0.47 -1.51 0.00 0.00 179.97 179.50 1h5w s TYR 282 N -5.36 3.59 0.00 2.20 5.04 -1.26 -4.99 117.35 116.57 1h5w s TYR 282 Ca -0.09 1.30 0.00 0.00 -2.44 0.00 0.00 57.07 55.84 1h5w s TYR 282 Cb 0.16 -2.83 0.00 0.00 0.35 0.00 0.00 41.96 39.64 1h5w s TYR 282 CO 0.78 0.09 0.00 -3.47 -1.34 0.00 0.00 175.55 171.61 1h5w n ASP 283 N 3.73 0.00 0.00 4.32 2.03 -1.26 -5.17 116.55 120.20 1h5w n ASP 283 Ca -0.01 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.30 1h5w n ASP 283 Cb 0.51 -0.12 0.00 0.00 -0.72 0.00 0.00 41.12 40.80 1h5w n ASP 283 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90