#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h5d s LEU 2 N 0.00 4.19 -0.00 1.08 1.43 -1.26 -4.97 118.68 119.14 1h5d s LEU 2 Ca 0.00 1.87 -0.00 0.00 -1.03 0.00 0.00 54.13 54.97 1h5d s LEU 2 Cb 0.00 -4.19 -0.00 0.00 0.03 0.00 0.00 46.19 42.03 1h5d s LEU 2 CO 0.00 -0.27 0.01 0.28 0.23 0.00 0.00 176.35 176.59 1h5d s THR 3 N -1.75 0.01 0.47 5.49 -1.32 -0.11 -4.71 115.64 113.72 1h5d s THR 3 Ca 0.55 -0.06 0.36 0.00 -1.21 0.00 0.00 61.69 61.33 1h5d s THR 3 Cb -0.18 -0.04 0.38 0.00 -1.51 0.00 0.00 72.50 71.16 1h5d s THR 3 CO 0.23 -0.04 2.20 -0.65 -2.21 0.00 0.00 174.62 174.15 1h5d h PRO 4 N 6.03 0.00 -0.35 7.08 0.11 -1.84 0.23 132.00 143.26 1h5d h PRO 4 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1h5d h PRO 4 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1h5d h PRO 4 CO 0.50 0.03 0.00 0.25 -0.21 0.00 0.00 178.00 178.57 1h5d n THR 5 N -3.32 0.46 -0.33 -1.15 -2.24 -1.26 -4.61 114.28 101.84 1h5d n THR 5 Ca -0.02 -0.55 0.23 0.00 -2.27 0.00 0.00 64.05 61.44 1h5d n THR 5 Cb 0.17 0.45 0.45 0.00 -2.10 0.00 0.00 70.33 69.30 1h5d n THR 5 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 1h5d h PHE 6 N 2.87 0.77 -0.42 4.78 3.57 -1.78 -1.24 116.94 125.50 1h5d h PHE 6 Ca 0.00 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.54 1h5d h PHE 6 Cb 0.64 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 39.21 1h5d h PHE 6 CO 0.23 -0.24 0.00 0.66 -2.23 0.00 0.00 178.31 176.73 1h5d n TYR 7 N -5.14 0.88 0.32 0.41 4.01 -1.26 -4.63 117.16 111.75 1h5d n TYR 7 Ca 0.31 -0.63 0.20 0.00 -0.16 0.00 0.00 57.90 57.62 1h5d n TYR 7 Cb 0.97 -0.16 1.10 0.00 -0.31 0.00 0.00 39.34 40.95 1h5d n TYR 7 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 1h5d h ASP 8 N 2.60 0.00 0.00 7.72 3.32 -1.49 0.43 116.42 129.00 1h5d h ASP 8 Ca 0.00 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 56.79 1h5d h ASP 8 Cb 1.12 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.63 1h5d h ASP 8 CO 0.12 0.01 -1.95 0.59 -1.72 0.00 0.00 179.24 176.29 1h5d n ASN 9 N -3.29 2.18 0.16 6.45 3.02 -1.26 -4.25 115.26 118.27 1h5d n ASN 9 Ca -0.03 0.02 0.03 0.00 -0.03 0.00 0.00 54.58 54.58 1h5d n ASN 9 Cb 0.09 -0.35 0.16 0.00 -0.61 0.00 0.00 39.78 39.07 1h5d n ASN 9 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1h5d h SER 10 N -0.23 0.00 0.00 6.41 4.64 -1.82 -3.41 113.55 119.14 1h5d h SER 10 Ca -0.39 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 60.74 1h5d h SER 10 Cb 1.50 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.45 1h5d h SER 10 CO -0.13 0.47 -0.39 0.00 -0.87 0.00 0.00 176.83 175.91 1h5d h PRO 12 N 3.71 0.00 -0.24 0.00 0.13 -1.58 -2.44 132.00 131.57 1h5d h PRO 12 Ca -0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 1h5d h PRO 12 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1h5d h PRO 12 CO 0.20 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.06 1h5d n ASN 13 N -3.89 1.88 -0.08 1.44 5.03 -1.26 -4.47 115.26 113.91 1h5d n ASN 13 Ca -0.02 -1.81 -0.07 0.00 0.87 0.00 0.00 54.58 53.55 1h5d n ASN 13 Cb 0.12 -0.16 -0.00 0.00 -1.02 0.00 0.00 39.78 38.73 1h5d n ASN 13 CO 0.00 0.00 0.00 1.62 -1.83 0.00 0.00 177.26 177.05 1h5d h VAL 14 N 2.36 0.81 -0.83 2.41 3.04 -1.80 -1.35 116.25 120.89 1h5d h VAL 14 Ca 0.00 -0.04 -0.02 0.00 -1.01 0.00 0.00 66.70 65.63 1h5d h VAL 14 Cb 0.52 0.68 -0.04 0.00 -2.01 0.00 0.00 31.29 30.45 1h5d h VAL 14 CO 0.00 0.02 0.45 -1.28 -1.01 0.00 0.00 177.57 175.75 1h5d h SER 15 N 0.12 1.05 -0.17 3.17 0.87 -1.84 -1.53 113.55 115.21 1h5d h SER 15 Ca 0.14 -0.09 -0.11 0.00 -1.23 0.00 0.00 61.79 60.49 1h5d h SER 15 Cb 0.17 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 61.85 1h5d h SER 15 CO -0.22 0.85 -0.27 0.78 -0.53 0.00 0.00 176.83 177.44 1h5d h ASN 16 N 1.17 0.66 -0.46 6.23 2.35 -1.77 -0.93 115.58 122.82 1h5d h ASN 16 Ca 0.29 -0.24 -0.12 0.00 -0.55 0.00 0.00 56.30 55.68 1h5d h ASN 16 Cb 0.04 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.21 1h5d h ASN 16 CO -0.05 0.90 -0.17 0.40 -1.65 0.00 0.00 177.43 176.87 1h5d h ILE 17 N 0.56 1.27 -0.27 2.81 2.04 -0.85 -0.81 117.51 122.25 1h5d h ILE 17 Ca 0.07 -1.32 -0.02 0.00 1.00 0.00 0.00 64.86 64.60 1h5d h ILE 17 Cb 0.75 1.15 -0.01 0.00 -0.74 0.00 0.00 36.82 37.97 1h5d h ILE 17 CO 0.06 0.45 0.10 0.58 0.00 0.00 0.00 178.15 179.34 1h5d h VAL 18 N 0.78 1.18 -0.10 1.67 2.07 -1.12 -2.22 116.25 118.50 1h5d h VAL 18 Ca 0.11 -0.57 0.01 0.00 0.82 0.00 0.00 66.70 67.08 1h5d h VAL 18 Cb 0.74 1.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.54 1h5d h VAL 18 CO 0.06 0.19 0.01 -0.09 0.02 0.00 0.00 177.57 177.76 1h5d h ARG 19 N 0.29 0.04 -0.91 1.57 2.43 -1.04 -2.21 114.38 114.55 1h5d h ARG 19 Ca 0.09 -0.00 0.08 0.00 -0.81 0.00 0.00 59.98 59.34 1h5d h ARG 19 Cb 0.20 -0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 29.67 1h5d h ARG 19 CO -0.01 0.03 0.56 -0.44 -1.51 0.00 0.00 179.97 178.61 1h5d h ASP 20 N 0.05 0.86 -0.46 -3.80 3.32 -1.05 -0.09 116.42 115.25 1h5d h ASP 20 Ca 0.05 0.03 -0.02 0.00 0.02 0.00 0.00 57.03 57.11 1h5d h ASP 20 Cb 0.05 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.43 1h5d h ASP 20 CO -0.07 0.52 0.23 0.74 -1.72 0.00 0.00 179.24 178.94 1h5d h THR 21 N 0.98 1.18 -0.42 0.35 2.02 -1.03 -1.77 112.91 114.22 1h5d h THR 21 Ca 0.42 -0.50 -0.12 0.00 0.77 0.00 0.00 66.41 66.97 1h5d h THR 21 Cb 0.27 0.67 -0.01 0.00 -1.74 0.00 0.00 68.15 67.34 1h5d h THR 21 CO -0.21 0.20 -0.22 0.40 0.37 0.00 0.00 175.52 176.05 1h5d h ILE 22 N 0.60 1.27 -0.29 3.11 2.04 -0.79 -1.79 117.51 121.66 1h5d h ILE 22 Ca 0.16 -1.36 0.00 0.00 1.00 0.00 0.00 64.86 64.66 1h5d h ILE 22 Cb 0.11 1.19 -0.01 0.00 -0.74 0.00 0.00 36.82 37.36 1h5d h ILE 22 CO -0.02 0.46 0.19 0.58 0.00 0.00 0.00 178.15 179.35 1h5d h VAL 23 N 0.73 1.09 -0.13 1.67 2.07 -0.83 0.03 116.25 120.87 1h5d h VAL 23 Ca 0.10 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.44 1h5d h VAL 23 Cb 0.76 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 31.21 1h5d h VAL 23 CO 0.06 0.08 0.08 0.78 0.02 0.00 0.00 177.57 178.60 1h5d h ASN 24 N 0.38 0.14 -0.61 0.57 2.35 -1.21 -2.99 115.58 114.21 1h5d h ASN 24 Ca 0.11 -0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.81 1h5d h ASN 24 Cb -0.02 -0.03 -0.03 0.00 0.05 0.00 0.00 38.32 38.29 1h5d h ASN 24 CO -0.02 0.10 0.21 -0.08 -1.65 0.00 0.00 177.43 175.99 1h5d h GLU 25 N 0.17 0.97 -0.20 0.81 4.57 -1.09 -2.76 114.58 117.04 1h5d h GLU 25 Ca 0.05 -0.18 0.06 0.00 -1.18 0.00 0.00 59.36 58.10 1h5d h GLU 25 Cb -0.02 -0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 28.41 1h5d h GLU 25 CO -0.01 0.82 0.19 -0.07 -1.18 0.00 0.00 179.01 178.75 1h5d h LEU 26 N 0.94 0.00 -0.75 1.64 3.38 -0.84 0.13 115.31 119.82 1h5d h LEU 26 Ca 0.21 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.12 1h5d h LEU 26 Cb 0.25 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 1h5d h LEU 26 CO -0.01 0.00 0.23 0.03 0.09 0.00 0.00 178.44 178.78 1h5d h ARG 27 N 0.00 1.16 0.00 1.13 3.08 -1.51 -3.00 114.38 115.24 1h5d h ARG 27 Ca 0.10 -0.25 -0.09 0.00 0.07 0.00 0.00 59.98 59.80 1h5d h ARG 27 Cb 0.47 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 30.33 1h5d h ARG 27 CO -0.00 0.99 -1.72 -1.13 -1.07 0.00 0.00 179.97 177.03 1h5d n SER 28 N -4.25 0.36 -3.52 7.04 3.41 -0.74 -4.76 113.62 111.17 1h5d n SER 28 Ca 0.06 0.15 -0.29 0.00 -0.26 0.00 0.00 58.87 58.53 1h5d n SER 28 Cb 0.23 1.12 -0.13 0.00 -0.26 0.00 0.00 64.21 65.18 1h5d n SER 28 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1h5d s ASP 29 N -5.12 3.19 0.00 4.04 2.15 0.38 -4.99 116.67 116.32 1h5d s ASP 29 Ca -0.06 -2.06 0.07 0.00 0.43 0.00 0.00 52.55 50.93 1h5d s ASP 29 Cb 0.11 -0.49 0.30 0.00 -0.30 0.00 0.00 42.92 42.54 1h5d s ASP 29 CO 0.85 -0.33 1.21 -0.81 -0.17 0.00 0.00 175.17 175.92 1h5d n PRO 30 N 4.22 0.01 0.00 4.34 -0.04 -1.14 -2.19 135.00 140.21 1h5d n PRO 30 Ca 0.08 0.36 0.11 0.00 -0.04 0.00 0.00 63.50 64.01 1h5d n PRO 30 Cb 0.38 -1.50 0.06 0.00 -0.04 0.00 0.00 33.50 32.40 1h5d n PRO 30 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 1h5d n ARG 31 N -1.48 0.04 -0.13 0.54 0.63 -1.26 -4.49 116.66 110.51 1h5d n ARG 31 Ca 0.02 -0.00 0.08 0.00 -0.92 0.00 0.00 57.85 57.03 1h5d n ARG 31 Cb 0.08 -1.51 0.41 0.00 0.45 0.00 0.00 32.46 31.88 1h5d n ARG 31 CO 0.00 0.00 0.00 0.97 -2.51 0.00 0.00 177.63 176.09 1h5d h ILE 32 N 0.00 0.99 -0.22 5.15 6.09 -1.80 -1.80 117.51 125.92 1h5d h ILE 32 Ca 0.00 -0.21 -0.01 0.00 -1.37 0.00 0.00 64.86 63.27 1h5d h ILE 32 Cb 0.53 0.31 -0.01 0.00 0.47 0.00 0.00 36.82 38.12 1h5d h ILE 32 CO 0.00 0.11 0.12 0.00 -3.07 0.00 0.00 178.15 175.31 1h5d h ALA 33 N 1.65 0.28 -0.44 0.18 0.00 -1.83 -0.37 119.26 118.74 1h5d h ALA 33 Ca 0.28 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 1h5d h ALA 33 Cb 0.31 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1h5d h ALA 33 CO -0.09 -0.18 0.23 0.00 0.00 0.00 0.00 179.25 179.22 1h5d h ALA 34 N 1.00 0.56 -0.73 0.00 0.00 -1.76 -2.27 119.26 116.06 1h5d h ALA 34 Ca 0.08 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 54.92 1h5d h ALA 34 Cb 0.08 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 1h5d h ALA 34 CO -0.01 0.09 0.47 0.77 0.00 0.00 0.00 179.25 180.57 1h5d h SER 35 N 0.57 0.78 -0.57 0.00 0.02 -1.04 -1.99 113.55 111.31 1h5d h SER 35 Ca 0.15 -0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.99 1h5d h SER 35 Cb 0.07 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.41 1h5d h SER 35 CO -0.02 0.54 -0.06 0.40 -1.14 0.00 0.00 176.83 176.55 1h5d h ILE 36 N 0.92 1.27 -0.68 3.27 2.04 -0.87 -1.56 117.51 121.89 1h5d h ILE 36 Ca 0.29 -1.22 -0.01 0.00 1.00 0.00 0.00 64.86 64.92 1h5d h ILE 36 Cb -0.00 0.88 -0.03 0.00 -0.74 0.00 0.00 36.82 36.92 1h5d h ILE 36 CO -0.10 0.44 0.38 0.25 0.00 0.00 0.00 178.15 179.11 1h5d h LEU 37 N 0.95 0.85 -1.14 1.44 5.85 -1.10 -2.23 115.31 119.92 1h5d h LEU 37 Ca 0.16 -0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.73 1h5d h LEU 37 Cb 0.62 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.42 1h5d h LEU 37 CO 0.04 0.69 -0.01 -0.09 -0.34 0.00 0.00 178.44 178.73 1h5d h ARG 38 N 0.93 0.58 -0.74 1.25 2.43 -1.08 -2.22 114.38 115.54 1h5d h ARG 38 Ca 0.24 -0.13 -0.01 0.00 -0.81 0.00 0.00 59.98 59.27 1h5d h ARG 38 Cb 0.03 -0.08 -0.04 0.00 -0.42 0.00 0.00 29.97 29.47 1h5d h ARG 38 CO -0.04 0.61 0.42 -0.07 -1.51 0.00 0.00 179.97 179.39 1h5d h LEU 39 N 0.55 0.90 -0.63 3.80 3.38 -0.70 -0.25 115.31 122.37 1h5d h LEU 39 Ca 0.11 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 1h5d h LEU 39 Cb 0.37 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 1h5d h LEU 39 CO 0.01 0.72 0.23 -0.74 0.09 0.00 0.00 178.44 178.75 1h5d h HIS 40 N 1.01 0.98 0.17 1.13 2.76 -1.07 0.16 115.15 120.28 1h5d h HIS 40 Ca 0.26 -0.09 -0.01 0.00 -2.20 0.00 0.00 60.37 58.34 1h5d h HIS 40 Cb 0.00 -0.29 0.00 0.00 1.55 0.00 0.00 27.41 28.68 1h5d h HIS 40 CO -0.01 0.79 -0.08 0.35 -1.30 0.00 0.00 177.93 177.68 1h5d h PHE 41 N 0.89 -0.21 0.00 5.26 3.57 -0.97 -0.13 116.94 125.35 1h5d h PHE 41 Ca 0.21 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.70 1h5d h PHE 41 Cb 0.24 0.07 0.00 0.00 2.79 0.00 0.00 35.95 39.05 1h5d h PHE 41 CO 0.02 -0.11 0.00 0.45 -2.23 0.00 0.00 178.31 176.43 1h5d h HIS 42 N -0.24 0.00 0.02 0.41 3.86 -0.86 -2.03 115.15 116.31 1h5d h HIS 42 Ca -0.02 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.19 1h5d h HIS 42 Cb 0.18 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.65 1h5d h HIS 42 CO -0.06 0.00 -0.01 0.22 0.86 0.00 0.00 177.93 178.94 1h5d h ASP 43 N 0.00 -0.02 -0.20 2.45 3.58 -0.32 -3.36 116.42 118.55 1h5d h ASP 43 Ca 0.00 -0.67 0.01 0.00 0.42 0.00 0.00 57.03 56.79 1h5d h ASP 43 Cb 0.36 0.01 -0.01 0.00 1.72 0.00 0.00 39.33 41.40 1h5d h ASP 43 CO 0.00 0.78 0.13 0.00 -2.88 0.00 0.00 179.24 177.28 1h5d n PHE 45 N -4.51 0.00 -3.73 0.00 3.01 -0.79 -2.87 117.46 108.58 1h5d n PHE 45 Ca 0.00 -0.00 -0.30 0.00 1.01 0.00 0.00 57.45 58.16 1h5d n PHE 45 Cb 0.12 0.00 -0.15 0.00 -0.01 0.00 0.00 39.48 39.44 1h5d n PHE 45 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1h5d s VAL 46 N -2.00 0.90 -1.42 -4.37 1.01 -0.90 -4.69 120.40 108.94 1h5d s VAL 46 Ca 0.38 -1.46 0.00 0.00 0.00 0.00 0.00 61.98 60.90 1h5d s VAL 46 Cb 0.18 -1.69 0.00 0.00 0.00 0.00 0.00 36.38 34.87 1h5d s VAL 46 CO 0.30 -0.69 0.00 -3.20 0.00 0.00 0.00 175.10 171.51 1h5d n ASN 47 N 4.78 -5.08 0.00 3.32 5.15 -1.26 -4.75 115.26 117.42 1h5d n ASN 47 Ca -0.01 0.33 0.00 0.00 -0.60 0.00 0.00 54.58 54.30 1h5d n ASN 47 Cb 0.42 -3.75 0.00 0.00 -0.53 0.00 0.00 39.78 35.91 1h5d n ASN 47 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1h5d n GLY 48 N -0.72 -0.46 3.56 8.20 0.00 -1.14 -4.64 105.19 110.00 1h5d n GLY 48 Ca -0.13 -1.76 -0.42 0.00 0.00 0.00 0.00 46.02 43.71 1h5d n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h5d n ASP 50 N 8.60 1.52 -1.56 0.00 5.75 -1.26 -4.74 116.55 124.86 1h5d n ASP 50 Ca 0.39 -2.47 -0.20 0.00 -0.01 0.00 0.00 54.79 52.50 1h5d n ASP 50 Cb 0.49 -0.27 -0.09 0.00 -1.03 0.00 0.00 41.12 40.22 1h5d n ASP 50 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1h5d n ALA 51 N -0.81 -0.31 0.15 2.12 0.00 -1.26 -0.93 120.51 119.47 1h5d n ALA 51 Ca 0.08 0.32 0.04 0.00 0.00 0.00 0.00 53.44 53.88 1h5d n ALA 51 Cb 0.58 -2.02 0.45 0.00 0.00 0.00 0.00 19.45 18.45 1h5d n ALA 51 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1h5d h SER 52 N 0.00 0.15 0.54 0.00 4.64 -1.86 -2.17 113.55 114.84 1h5d h SER 52 Ca -0.41 -0.03 -0.02 0.00 -0.47 0.00 0.00 61.79 60.86 1h5d h SER 52 Cb 1.33 -0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 63.38 1h5d h SER 52 CO 0.60 0.29 -0.12 -0.29 -0.87 0.00 0.00 176.83 176.44 1h5d h ILE 53 N 0.16 0.45 0.00 0.95 2.10 -1.88 -2.76 117.51 116.52 1h5d h ILE 53 Ca 0.03 -0.62 0.00 0.00 1.08 0.00 0.00 64.86 65.36 1h5d h ILE 53 Cb 0.30 1.43 0.00 0.00 -1.09 0.00 0.00 36.82 37.46 1h5d h ILE 53 CO 0.02 0.12 0.00 0.18 -1.08 0.00 0.00 178.15 177.38 1h5d n LEU 54 N -3.47 0.78 -4.76 2.19 4.77 -0.82 -4.59 117.00 111.11 1h5d n LEU 54 Ca -0.01 0.59 -0.41 0.00 -0.03 0.00 0.00 56.01 56.15 1h5d n LEU 54 Cb 0.27 -0.35 -0.03 0.00 -2.33 0.00 0.00 43.42 40.98 1h5d n LEU 54 CO 0.30 -0.22 0.88 -0.76 -1.33 0.00 0.00 177.39 176.26 1h5d s LEU 55 N -4.49 4.49 0.62 2.23 1.43 -1.04 -4.00 118.68 117.91 1h5d s LEU 55 Ca 0.10 2.43 -0.00 0.00 -1.03 0.00 0.00 54.13 55.63 1h5d s LEU 55 Cb 0.12 -3.63 0.07 0.00 0.03 0.00 0.00 46.19 42.78 1h5d s LEU 55 CO 0.57 -0.34 0.87 -1.81 0.23 0.00 0.00 176.35 175.88 1h5d s ASP 56 N -0.54 4.92 0.60 2.29 1.01 -0.42 -4.46 116.67 120.08 1h5d s ASP 56 Ca 0.48 -0.10 -0.19 0.00 0.71 0.00 0.00 52.55 53.45 1h5d s ASP 56 Cb -0.35 -0.59 -0.03 0.00 1.01 0.00 0.00 42.92 42.95 1h5d s ASP 56 CO 0.45 -1.43 1.19 0.59 0.21 0.00 0.00 175.17 176.18 1h5d n ASN 57 N -2.56 1.76 -4.11 0.27 3.02 -1.26 -4.64 115.26 107.74 1h5d n ASN 57 Ca 0.10 0.86 -0.10 0.00 -0.03 0.00 0.00 54.58 55.42 1h5d n ASN 57 Cb 0.60 -1.50 -0.09 0.00 -0.61 0.00 0.00 39.78 38.18 1h5d n ASN 57 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1h5d s THR 58 N -1.40 0.09 -1.01 3.41 -4.23 -0.92 -4.99 115.64 106.60 1h5d s THR 58 Ca 0.77 -1.80 0.20 0.00 -1.18 0.00 0.00 61.69 59.69 1h5d s THR 58 Cb -0.41 -2.03 0.17 0.00 1.34 0.00 0.00 72.50 71.57 1h5d s THR 58 CO 0.45 -0.39 1.65 0.35 -0.54 0.00 0.00 174.62 176.14 1h5d n THR 59 N -0.13 0.59 -0.09 3.99 -2.24 -1.26 -3.30 114.28 111.84 1h5d n THR 59 Ca -0.05 0.15 -0.11 0.00 -2.27 0.00 0.00 64.05 61.77 1h5d n THR 59 Cb 0.64 -0.80 -0.15 0.00 -2.10 0.00 0.00 70.33 67.91 1h5d n THR 59 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1h5d n SER 60 N -1.50 0.29 -3.87 3.42 3.41 -1.26 -5.00 113.62 109.11 1h5d n SER 60 Ca 0.05 0.04 -0.11 0.00 -0.26 0.00 0.00 58.87 58.58 1h5d n SER 60 Cb 0.24 0.74 -0.11 0.00 -0.26 0.00 0.00 64.21 64.82 1h5d n SER 60 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1h5d s PHE 61 N -2.51 0.01 0.41 7.33 -0.12 -1.21 -5.15 117.98 116.75 1h5d s PHE 61 Ca -0.12 -0.03 -0.14 0.00 -0.05 0.00 0.00 56.93 56.59 1h5d s PHE 61 Cb 0.06 -0.04 -0.08 0.00 -0.63 0.00 0.00 43.02 42.34 1h5d s PHE 61 CO 0.81 -0.20 0.82 1.03 -0.05 0.00 0.00 175.22 177.63 1h5d s ARG 62 N -0.90 3.91 0.34 1.99 1.81 -1.26 -2.15 118.95 122.68 1h5d s ARG 62 Ca -0.10 0.68 -0.26 0.00 -1.72 0.00 0.00 55.73 54.33 1h5d s ARG 62 Cb -0.06 -2.33 -0.10 0.00 -0.45 0.00 0.00 34.95 32.02 1h5d s ARG 62 CO 0.01 -0.04 0.96 -0.08 -0.68 0.00 0.00 175.30 175.46 1h5d s THR 63 N -2.32 4.17 -0.72 0.02 -1.32 -1.26 -4.16 115.64 110.05 1h5d s THR 63 Ca 0.55 1.76 0.19 0.00 -1.21 0.00 0.00 61.69 62.98 1h5d s THR 63 Cb -0.10 -3.95 0.19 0.00 -1.51 0.00 0.00 72.50 67.12 1h5d s THR 63 CO 0.26 0.10 1.60 -0.62 -2.21 0.00 0.00 174.62 173.75 1h5d n GLU 64 N 0.43 0.10 0.20 7.08 1.02 -1.26 -2.54 120.64 125.68 1h5d n GLU 64 Ca 0.02 0.34 0.15 0.00 -0.02 0.00 0.00 57.16 57.65 1h5d n GLU 64 Cb 0.50 -1.70 0.70 0.00 -0.02 0.00 0.00 31.44 30.92 1h5d n GLU 64 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 1h5d h LYS 65 N 0.00 0.00 -0.68 3.49 1.57 -1.85 -1.02 116.57 118.09 1h5d h LYS 65 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1h5d h LYS 65 Cb 0.32 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.63 1h5d h LYS 65 CO 0.00 0.00 0.00 -0.25 -0.57 0.00 0.00 179.45 178.63 1h5d n ASP 66 N -2.53 4.73 -4.81 0.86 8.00 -1.05 -2.52 116.55 119.22 1h5d n ASP 66 Ca -0.00 -2.39 -0.32 0.00 0.71 0.00 0.00 54.79 52.79 1h5d n ASP 66 Cb 0.14 -0.58 0.01 0.00 -0.02 0.00 0.00 41.12 40.68 1h5d n ASP 66 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1h5d s ALA 67 N -1.73 2.77 0.42 2.24 0.00 -0.39 -4.69 121.76 120.38 1h5d s ALA 67 Ca 0.52 0.29 0.10 0.00 0.00 0.00 0.00 51.96 52.87 1h5d s ALA 67 Cb 0.33 -3.20 0.93 0.00 0.00 0.00 0.00 23.12 21.17 1h5d s ALA 67 CO 0.27 -0.83 2.02 0.74 0.00 0.00 0.00 175.76 177.96 1h5d h PHE 68 N 0.23 0.49 -0.00 0.00 0.04 -1.91 0.28 116.94 116.07 1h5d h PHE 68 Ca -0.46 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.32 1h5d h PHE 68 Cb 1.21 -0.16 0.00 0.00 2.20 0.00 0.00 35.95 39.20 1h5d h PHE 68 CO 0.60 0.27 -0.12 0.41 -0.60 0.00 0.00 178.31 178.87 1h5d n GLY 69 N -1.49 -1.35 0.04 -1.45 0.00 -1.26 -4.23 105.19 95.45 1h5d n GLY 69 Ca 0.06 -0.18 -0.06 0.00 0.00 0.00 0.00 46.02 45.84 1h5d n GLY 69 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1h5d n ASN 70 N -1.41 3.34 -4.65 1.61 3.02 -0.42 -4.59 115.26 112.17 1h5d n ASN 70 Ca 0.08 -0.04 -0.48 0.00 -0.03 0.00 0.00 54.58 54.11 1h5d n ASN 70 Cb 0.32 -0.10 -0.05 0.00 -0.61 0.00 0.00 39.78 39.35 1h5d n ASN 70 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1h5d n ALA 71 N -2.73 0.74 -3.47 5.41 0.00 0.84 -0.50 120.51 120.80 1h5d n ALA 71 Ca -0.15 0.46 -0.25 0.00 0.00 0.00 0.00 53.44 53.49 1h5d n ALA 71 Cb 0.66 -2.29 0.01 0.00 0.00 0.00 0.00 19.45 17.84 1h5d n ALA 71 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1h5d n ASN 72 N 3.35 -4.48 0.18 0.00 5.15 -1.26 -4.69 115.26 113.51 1h5d n ASN 72 Ca 0.18 -0.49 0.00 0.00 -0.60 0.00 0.00 54.58 53.66 1h5d n ASN 72 Cb 0.26 -3.64 0.00 0.00 -0.53 0.00 0.00 39.78 35.87 1h5d n ASN 72 CO 0.00 0.00 0.00 -0.24 1.40 0.00 0.00 177.26 178.42 1h5d n SER 73 N -2.49 -1.99 -4.77 1.20 2.88 -0.55 -5.10 113.62 102.80 1h5d n SER 73 Ca -0.01 0.67 -0.41 0.00 -1.33 0.00 0.00 58.87 57.79 1h5d n SER 73 Cb 0.55 1.98 -0.01 0.00 -0.75 0.00 0.00 64.21 65.98 1h5d n SER 73 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1h5d s ALA 74 N -2.00 3.57 0.25 -1.46 0.00 0.34 -5.00 121.76 117.46 1h5d s ALA 74 Ca 0.00 1.44 -0.11 0.00 0.00 0.00 0.00 51.96 53.29 1h5d s ALA 74 Cb 0.00 -3.56 -0.01 0.00 0.00 0.00 0.00 23.12 19.55 1h5d s ALA 74 CO 0.00 -0.87 0.44 -0.98 0.00 0.00 0.00 175.76 174.35 1h5d s ARG 75 N -1.61 1.53 0.00 0.00 1.70 -1.26 -4.94 118.95 114.36 1h5d s ARG 75 Ca 0.53 -1.32 0.00 0.00 -0.47 0.00 0.00 55.73 54.48 1h5d s ARG 75 Cb -0.44 0.45 0.00 0.00 -0.57 0.00 0.00 34.95 34.39 1h5d s ARG 75 CO 0.56 -0.62 0.00 0.41 -1.08 0.00 0.00 175.30 174.56 1h5d n GLY 76 N -0.38 0.58 0.34 3.88 0.00 -1.26 -4.57 105.19 103.78 1h5d n GLY 76 Ca -0.01 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.09 1h5d n GLY 76 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1h5d h PHE 77 N 0.00 0.98 -0.15 1.61 0.04 -1.98 -1.13 116.94 116.31 1h5d h PHE 77 Ca 0.00 0.03 -0.07 0.00 2.80 0.00 0.00 57.97 60.74 1h5d h PHE 77 Cb 0.00 -0.30 -0.01 0.00 2.20 0.00 0.00 35.95 37.84 1h5d h PHE 77 CO 0.00 0.30 -0.20 -1.35 -0.60 0.00 0.00 178.31 176.46 1h5d h PRO 78 N 0.80 0.26 -0.42 1.51 0.11 -1.99 -1.98 132.00 130.29 1h5d h PRO 78 Ca 0.50 -0.08 -0.10 0.00 0.11 0.00 0.00 66.00 66.44 1h5d h PRO 78 Cb 0.64 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 31.71 1h5d h PRO 78 CO -0.33 0.46 -0.14 0.28 -0.21 0.00 0.00 178.00 178.06 1h5d h VAL 79 N 0.24 1.26 -0.42 3.15 2.07 -1.64 -1.16 116.25 119.76 1h5d h VAL 79 Ca 0.04 -1.21 -0.12 0.00 0.82 0.00 0.00 66.70 66.23 1h5d h VAL 79 Cb 0.50 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 31.34 1h5d h VAL 79 CO 0.03 0.41 -0.21 0.40 0.02 0.00 0.00 177.57 178.22 1h5d h ILE 80 N 0.69 1.27 -0.85 4.57 1.08 -1.02 -2.03 117.51 121.22 1h5d h ILE 80 Ca 0.11 -1.34 -0.02 0.00 -0.39 0.00 0.00 64.86 63.22 1h5d h ILE 80 Cb 0.63 1.18 -0.04 0.00 -3.07 0.00 0.00 36.82 35.51 1h5d h ILE 80 CO 0.04 0.45 0.45 0.44 -0.69 0.00 0.00 178.15 178.84 1h5d h ASP 81 N 0.73 1.07 0.18 1.72 3.32 -0.92 -0.83 116.42 121.68 1h5d h ASP 81 Ca 0.10 -0.10 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 1h5d h ASP 81 Cb 0.74 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 40.02 1h5d h ASP 81 CO 0.06 0.87 -0.08 -0.09 -1.72 0.00 0.00 179.24 178.28 1h5d h ARG 82 N 1.19 -0.23 -0.15 3.56 2.43 -0.82 -1.21 114.38 119.15 1h5d h ARG 82 Ca 0.30 0.02 -0.07 0.00 -0.81 0.00 0.00 59.98 59.41 1h5d h ARG 82 Cb 0.05 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.64 1h5d h ARG 82 CO -0.05 -0.03 -0.23 0.00 -1.51 0.00 0.00 179.97 178.15 1h5d h MET 83 N -0.39 0.27 -0.48 0.20 -0.00 -1.26 -1.66 114.93 111.61 1h5d h MET 83 Ca -0.02 -0.09 -0.05 0.00 -0.00 0.00 0.00 59.70 59.54 1h5d h MET 83 Cb 0.30 -0.02 -0.02 0.00 -0.00 0.00 0.00 31.60 31.86 1h5d h MET 83 CO 0.04 0.49 0.12 -0.22 -0.00 0.00 0.00 176.91 177.34 1h5d h LYS 84 N 0.25 0.77 -0.62 -0.10 1.63 -0.99 0.61 116.57 118.11 1h5d h LYS 84 Ca 0.04 -0.18 -0.03 0.00 -0.85 0.00 0.00 60.65 59.63 1h5d h LYS 84 Cb 0.55 -0.10 -0.03 0.00 -0.60 0.00 0.00 32.23 32.05 1h5d h LYS 84 CO 0.04 0.75 0.28 0.00 -3.45 0.00 0.00 179.45 177.06 1h5d h ALA 85 N 0.99 0.80 -0.50 5.00 0.00 -0.88 0.17 119.26 124.84 1h5d h ALA 85 Ca 0.15 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 1h5d h ALA 85 Cb 0.32 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1h5d h ALA 85 CO 0.00 0.39 0.02 0.00 0.00 0.00 0.00 179.25 179.66 1h5d h ALA 86 N 1.11 1.09 -0.06 0.00 0.00 -1.02 -1.35 119.26 119.02 1h5d h ALA 86 Ca 0.21 -0.26 -0.20 0.00 0.00 0.00 0.00 54.91 54.65 1h5d h ALA 86 Cb 0.16 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1h5d h ALA 86 CO -0.02 0.58 -0.81 0.28 0.00 0.00 0.00 179.25 179.28 1h5d h VAL 87 N 0.77 1.37 -0.20 0.00 2.07 -0.51 -2.50 116.25 117.25 1h5d h VAL 87 Ca 0.15 -2.21 -0.06 0.00 0.82 0.00 0.00 66.70 65.40 1h5d h VAL 87 Cb 0.44 2.19 -0.01 0.00 -1.52 0.00 0.00 31.29 32.39 1h5d h VAL 87 CO 0.02 0.67 -0.15 -0.33 0.02 0.00 0.00 177.57 177.79 1h5d h GLU 88 N 0.30 0.33 -0.14 1.57 4.39 -0.40 0.51 114.58 121.14 1h5d h GLU 88 Ca -0.05 -0.09 -0.04 0.00 0.34 0.00 0.00 59.36 59.53 1h5d h GLU 88 Cb 1.41 -0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 30.02 1h5d h GLU 88 CO 0.14 0.48 -0.05 1.03 -1.16 0.00 0.00 179.01 179.45 1h5d h SER 89 N 0.31 0.28 0.23 1.42 0.87 -1.14 -1.80 113.55 113.72 1h5d h SER 89 Ca 0.06 -0.40 -0.18 0.00 -1.23 0.00 0.00 61.79 60.04 1h5d h SER 89 Cb 0.46 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.33 1h5d h SER 89 CO 0.03 0.62 -0.69 0.00 -0.53 0.00 0.00 176.83 176.25 1h5d h ALA 90 N 0.67 0.63 -2.19 6.23 0.00 -1.15 -3.40 119.26 120.05 1h5d h ALA 90 Ca 0.03 -0.59 -0.53 0.00 0.00 0.00 0.00 54.91 53.83 1h5d h ALA 90 Cb 0.50 -0.06 -0.35 0.00 0.00 0.00 0.00 17.79 17.88 1h5d h ALA 90 CO 0.02 0.75 -0.90 0.00 0.00 0.00 0.00 179.25 179.12 1h5d n PRO 92 N 3.01 1.20 -4.28 0.00 -0.02 -0.68 -2.94 135.00 131.30 1h5d n PRO 92 Ca 0.26 0.43 -0.34 0.00 -2.02 0.00 0.00 63.50 61.83 1h5d n PRO 92 Cb 0.48 -2.01 -0.06 0.00 -0.02 0.00 0.00 33.50 31.89 1h5d n PRO 92 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1h5d n ARG 93 N 2.19 -1.98 -0.02 -0.52 1.74 -1.26 -4.86 116.66 111.96 1h5d n ARG 93 Ca 0.17 0.24 -0.04 0.00 -0.77 0.00 0.00 57.85 57.45 1h5d n ARG 93 Cb 0.22 -4.47 -0.01 0.00 -1.02 0.00 0.00 32.46 27.17 1h5d n ARG 93 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1h5d n THR 94 N -4.36 0.24 -3.33 0.55 -1.04 -1.15 -5.00 114.28 100.19 1h5d n THR 94 Ca -0.10 -0.05 -0.39 0.00 -2.04 0.00 0.00 64.05 61.46 1h5d n THR 94 Cb 0.58 -1.56 -0.08 0.00 -1.82 0.00 0.00 70.33 67.45 1h5d n THR 94 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1h5d s VAL 95 N -2.08 5.14 0.72 12.58 1.01 -1.26 -5.04 120.40 131.47 1h5d s VAL 95 Ca -0.06 0.73 -0.13 0.00 0.00 0.00 0.00 61.98 62.53 1h5d s VAL 95 Cb 0.02 -3.76 0.03 0.00 0.00 0.00 0.00 36.38 32.67 1h5d s VAL 95 CO 0.07 0.15 1.10 -0.94 0.00 0.00 0.00 175.10 175.49 1h5d s SER 96 N 1.44 4.76 0.28 3.32 1.04 -1.26 -4.82 113.70 118.46 1h5d s SER 96 Ca 0.19 1.93 0.03 0.00 0.48 0.00 0.00 55.95 58.58 1h5d s SER 96 Cb -0.15 -2.54 0.40 0.00 0.10 0.00 0.00 66.02 63.83 1h5d s SER 96 CO 0.09 -1.87 1.70 0.00 0.98 0.00 0.00 173.24 174.15 1h5d h ALA 98 N 1.30 0.36 -0.39 0.00 0.00 -1.86 -0.08 119.26 118.59 1h5d h ALA 98 Ca 0.05 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.80 1h5d h ALA 98 Cb 0.73 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 1h5d h ALA 98 CO 0.06 -0.17 -0.28 -0.44 0.00 0.00 0.00 179.25 178.41 1h5d h ASP 99 N 0.38 0.92 -0.53 0.00 3.32 -1.76 -2.51 116.42 116.24 1h5d h ASP 99 Ca 0.10 -0.44 0.06 0.00 0.02 0.00 0.00 57.03 56.77 1h5d h ASP 99 Cb -0.04 -0.26 -0.05 0.00 0.22 0.00 0.00 39.33 39.20 1h5d h ASP 99 CO -0.02 1.16 0.25 0.25 -1.72 0.00 0.00 179.24 179.16 1h5d h LEU 100 N 0.69 0.33 -1.06 1.55 5.85 -0.77 -0.13 115.31 121.77 1h5d h LEU 100 Ca 0.07 0.04 -0.09 0.00 0.84 0.00 0.00 57.88 58.74 1h5d h LEU 100 Cb 0.86 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.86 1h5d h LEU 100 CO 0.08 0.23 -0.32 0.25 -0.34 0.00 0.00 178.44 178.33 1h5d h LEU 101 N 0.48 0.26 -0.28 2.25 5.85 -0.97 0.11 115.31 123.00 1h5d h LEU 101 Ca 0.24 -0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.81 1h5d h LEU 101 Cb 0.19 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 1h5d h LEU 101 CO -0.19 0.58 -0.07 0.74 -0.34 0.00 0.00 178.44 179.15 1h5d h THR 102 N 0.22 1.28 -0.57 1.05 2.02 -0.86 -0.90 112.91 115.15 1h5d h THR 102 Ca 0.03 -1.11 -0.07 0.00 0.77 0.00 0.00 66.41 66.03 1h5d h THR 102 Cb 0.69 1.43 -0.02 0.00 -1.74 0.00 0.00 68.15 68.51 1h5d h THR 102 CO 0.05 0.35 0.08 0.40 0.37 0.00 0.00 175.52 176.77 1h5d h ILE 103 N 0.30 1.26 -0.82 3.11 2.04 -0.85 -2.10 117.51 120.44 1h5d h ILE 103 Ca 0.07 -1.00 0.04 0.00 1.00 0.00 0.00 64.86 64.97 1h5d h ILE 103 Cb 0.56 0.79 -0.05 0.00 -0.74 0.00 0.00 36.82 37.37 1h5d h ILE 103 CO 0.03 0.37 0.52 0.00 0.00 0.00 0.00 178.15 179.07 1h5d h ALA 104 N 1.00 1.10 -0.38 1.87 0.00 -0.83 0.98 119.26 123.00 1h5d h ALA 104 Ca 0.17 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 1h5d h ALA 104 Cb 0.44 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1h5d h ALA 104 CO 0.01 0.33 0.10 0.00 0.00 0.00 0.00 179.25 179.70 1h5d h ALA 105 N 1.35 0.50 -0.33 0.00 0.00 -0.86 -0.15 119.26 119.77 1h5d h ALA 105 Ca 0.34 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 1h5d h ALA 105 Cb 0.04 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1h5d h ALA 105 CO -0.13 0.16 0.05 0.37 0.00 0.00 0.00 179.25 179.71 1h5d h GLN 106 N 0.47 0.55 -0.39 0.00 -0.00 -0.88 -1.91 115.11 112.94 1h5d h GLN 106 Ca 0.12 -0.15 -0.04 0.00 -0.00 0.00 0.00 58.65 58.58 1h5d h GLN 106 Cb 0.29 -0.06 -0.02 0.00 0.00 0.00 0.00 27.48 27.69 1h5d h GLN 106 CO -0.00 0.64 0.07 1.96 0.00 0.00 0.00 178.83 181.49 1h5d h GLN 107 N 0.38 0.59 -0.39 1.69 1.08 -0.73 -1.65 115.11 116.08 1h5d h GLN 107 Ca 0.10 -0.11 -0.02 0.00 -1.45 0.00 0.00 58.65 57.17 1h5d h GLN 107 Cb 0.35 -0.09 -0.02 0.00 -0.05 0.00 0.00 27.48 27.67 1h5d h GLN 107 CO 0.01 0.57 0.15 0.77 -0.95 0.00 0.00 178.83 179.37 1h5d h SER 108 N 0.58 0.54 -0.49 1.46 0.02 -0.72 0.10 113.55 115.03 1h5d h SER 108 Ca 0.13 -0.17 -0.01 0.00 -0.84 0.00 0.00 61.79 60.90 1h5d h SER 108 Cb 0.26 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.64 1h5d h SER 108 CO 0.00 0.56 0.26 0.58 -1.14 0.00 0.00 176.83 177.09 1h5d h VAL 109 N 0.48 1.18 -0.42 2.27 2.07 -0.94 -1.81 116.25 119.08 1h5d h VAL 109 Ca 0.13 -0.46 -0.05 0.00 0.82 0.00 0.00 66.70 67.14 1h5d h VAL 109 Cb 0.19 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 30.53 1h5d h VAL 109 CO -0.01 0.19 0.06 0.74 0.02 0.00 0.00 177.57 178.57 1h5d h THR 110 N 0.65 1.24 0.00 2.57 2.02 -1.10 0.28 112.91 118.57 1h5d h THR 110 Ca 0.17 -0.89 -0.03 0.00 0.77 0.00 0.00 66.41 66.44 1h5d h THR 110 Cb 0.06 1.01 -0.00 0.00 -1.74 0.00 0.00 68.15 67.48 1h5d h THR 110 CO -0.03 0.31 -0.14 -0.07 0.37 0.00 0.00 175.52 175.96 1h5d h LEU 111 N 0.55 0.00 -0.41 2.58 3.38 -0.63 -1.08 115.31 119.70 1h5d h LEU 111 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1h5d h LEU 111 Cb 0.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1h5d h LEU 111 CO 0.01 0.14 0.00 0.00 0.09 0.00 0.00 178.44 178.68 1h5d n ALA 112 N -2.49 2.59 0.00 1.53 0.00 -0.70 -4.87 120.51 116.58 1h5d n ALA 112 Ca -0.03 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.14 1h5d n ALA 112 Cb 0.21 -1.25 0.00 0.00 0.00 0.00 0.00 19.45 18.41 1h5d n ALA 112 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1h5d n GLY 113 N 0.95 0.75 0.14 0.00 0.00 -0.41 -0.48 105.19 106.14 1h5d n GLY 113 Ca 0.16 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.17 1h5d n GLY 113 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h5d n GLY 114 N -1.68 -0.71 3.73 -0.02 0.00 0.96 -4.78 105.19 102.68 1h5d n GLY 114 Ca 0.00 -1.74 -0.31 0.00 0.00 0.00 0.00 46.02 43.98 1h5d n GLY 114 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1h5d s PRO 115 N -2.96 1.73 -0.10 1.61 0.04 -1.26 -4.47 135.00 129.58 1h5d s PRO 115 Ca 0.03 1.25 0.04 0.00 0.04 0.00 0.00 61.00 62.36 1h5d s PRO 115 Cb -0.00 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.71 1h5d s PRO 115 CO 0.02 -2.04 -0.23 0.45 0.04 0.00 0.00 177.00 175.24 1h5d s SER 116 N -3.16 3.03 0.19 6.66 0.15 -1.26 -3.90 113.70 115.42 1h5d s SER 116 Ca 0.63 -0.55 -0.21 0.00 0.70 0.00 0.00 55.95 56.52 1h5d s SER 116 Cb -0.19 -1.39 0.05 0.00 -1.71 0.00 0.00 66.02 62.78 1h5d s SER 116 CO 0.57 0.14 0.60 -1.66 1.20 0.00 0.00 173.24 174.09 1h5d s TRP 117 N 0.43 -0.36 -0.32 3.44 -2.14 -1.26 -5.13 118.94 113.60 1h5d s TRP 117 Ca -0.17 0.06 -0.14 0.00 2.66 0.00 0.00 56.10 58.51 1h5d s TRP 117 Cb -0.18 0.55 -0.02 0.00 -3.10 0.00 0.00 33.47 30.72 1h5d s TRP 117 CO 0.07 -0.95 0.33 1.03 -2.66 0.00 0.00 176.95 174.78 1h5d s ARG 118 N -3.82 3.70 0.45 3.25 0.52 -1.26 -4.98 118.95 116.82 1h5d s ARG 118 Ca 0.05 -0.33 -0.21 0.00 -0.52 0.00 0.00 55.73 54.72 1h5d s ARG 118 Cb -0.02 -3.75 -0.09 0.00 0.52 0.00 0.00 34.95 31.61 1h5d s ARG 118 CO -0.06 -0.42 1.03 0.14 0.02 0.00 0.00 175.30 176.00 1h5d s VAL 119 N 1.97 3.84 0.46 3.52 -7.23 -1.26 -4.82 120.40 116.88 1h5d s VAL 119 Ca 0.11 1.22 -0.24 0.00 -1.81 0.00 0.00 61.98 61.26 1h5d s VAL 119 Cb -0.16 -3.54 -0.07 0.00 0.56 0.00 0.00 36.38 33.17 1h5d s VAL 119 CO 0.11 -0.17 1.29 -2.84 -0.31 0.00 0.00 175.10 173.17 1h5d s PRO 120 N -3.01 3.67 0.29 4.82 0.02 -1.26 -4.14 135.00 135.40 1h5d s PRO 120 Ca 0.64 2.08 0.03 0.00 0.02 0.00 0.00 61.00 63.77 1h5d s PRO 120 Cb -0.17 -2.52 -0.06 0.00 0.02 0.00 0.00 34.50 31.77 1h5d s PRO 120 CO 0.21 -0.71 0.06 -0.51 -0.33 0.00 0.00 177.00 175.72 1h5d s LEU 121 N -2.90 2.02 0.00 -5.54 1.43 0.80 -4.77 118.68 109.71 1h5d s LEU 121 Ca 0.63 -1.35 0.00 0.00 -1.03 0.00 0.00 54.13 52.38 1h5d s LEU 121 Cb -0.36 -0.25 0.00 0.00 0.03 0.00 0.00 46.19 45.61 1h5d s LEU 121 CO 0.45 -0.63 0.00 0.61 0.23 0.00 0.00 176.35 177.01 1h5d n GLY 122 N -0.58 0.55 3.78 -3.19 0.00 -1.26 -0.93 105.19 103.56 1h5d n GLY 122 Ca -0.02 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.66 1h5d n GLY 122 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1h5d s ARG 123 N 0.00 3.19 0.31 1.61 0.52 -1.26 -4.48 118.95 118.85 1h5d s ARG 123 Ca 0.00 1.45 0.08 0.00 -0.52 0.00 0.00 55.73 56.75 1h5d s ARG 123 Cb 0.00 -2.00 -0.06 0.00 0.52 0.00 0.00 34.95 33.41 1h5d s ARG 123 CO 0.00 -0.95 -0.08 1.03 0.02 0.00 0.00 175.30 175.32 1h5d s ARG 124 N -3.68 1.68 0.10 3.54 0.52 0.53 -4.51 118.95 117.14 1h5d s ARG 124 Ca 0.69 -1.86 -0.22 0.00 -0.52 0.00 0.00 55.73 53.83 1h5d s ARG 124 Cb -0.21 -1.42 -0.07 0.00 0.52 0.00 0.00 34.95 33.77 1h5d s ARG 124 CO 0.33 0.09 0.65 -0.51 0.02 0.00 0.00 175.30 175.88 1h5d s ASP 125 N -3.52 7.18 0.78 0.23 1.01 0.58 -4.43 116.67 118.50 1h5d s ASP 125 Ca 0.31 1.40 -0.13 0.00 0.71 0.00 0.00 52.55 54.84 1h5d s ASP 125 Cb 0.03 -2.41 0.07 0.00 1.01 0.00 0.00 42.92 41.62 1h5d s ASP 125 CO 0.14 0.24 1.16 -0.94 0.21 0.00 0.00 175.17 175.98 1h5d s SER 126 N -1.06 3.95 0.00 0.27 1.04 -0.11 -1.96 113.70 115.83 1h5d s SER 126 Ca 0.32 2.19 0.23 0.00 0.48 0.00 0.00 55.95 59.17 1h5d s SER 126 Cb -0.21 -2.57 0.46 0.00 0.10 0.00 0.00 66.02 63.81 1h5d s SER 126 CO 0.22 -2.42 1.43 0.18 0.98 0.00 0.00 173.24 173.63 1h5d n LEU 127 N -3.25 3.57 -3.72 2.42 4.77 -1.26 -4.81 117.00 114.72 1h5d n LEU 127 Ca 0.12 -1.59 -0.05 0.00 -0.03 0.00 0.00 56.01 54.46 1h5d n LEU 127 Cb 0.51 -0.29 -0.02 0.00 -2.33 0.00 0.00 43.42 41.29 1h5d n LEU 127 CO 0.49 0.79 0.67 0.00 -1.33 0.00 0.00 177.39 178.01 1h5d s GLN 128 N -1.40 1.23 0.20 3.23 -2.07 -1.26 -4.98 119.66 114.60 1h5d s GLN 128 Ca 0.41 -0.65 0.08 0.00 -1.82 0.00 0.00 55.36 53.38 1h5d s GLN 128 Cb 0.23 0.44 -0.04 0.00 -1.09 0.00 0.00 33.01 32.55 1h5d s GLN 128 CO 0.32 -0.56 -0.00 0.00 -1.32 0.00 0.00 175.29 173.73 1h5d s ALA 129 N -3.37 3.18 -0.60 2.60 0.00 -1.26 -4.75 121.76 117.56 1h5d s ALA 129 Ca 0.11 -1.45 0.04 0.00 0.00 0.00 0.00 51.96 50.66 1h5d s ALA 129 Cb -0.02 -0.92 0.16 0.00 0.00 0.00 0.00 23.12 22.34 1h5d s ALA 129 CO 0.01 0.42 0.42 -0.06 0.00 0.00 0.00 175.76 176.54 1h5d s PHE 130 N -1.88 2.82 0.06 0.00 0.40 -1.26 -4.78 117.98 113.33 1h5d s PHE 130 Ca 0.28 -3.01 -0.24 0.00 -0.60 0.00 0.00 56.93 53.36 1h5d s PHE 130 Cb -0.08 -2.22 -0.16 0.00 0.51 0.00 0.00 43.02 41.06 1h5d s PHE 130 CO 0.19 -0.65 1.61 1.25 0.70 0.00 0.00 175.22 178.32 1h5d h LEU 131 N 5.65 -0.04 -1.00 -0.37 5.85 -1.84 -1.15 115.31 122.42 1h5d h LEU 131 Ca 0.14 -0.12 0.01 0.00 0.84 0.00 0.00 57.88 58.75 1h5d h LEU 131 Cb 0.82 0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.81 1h5d h LEU 131 CO 0.61 0.10 0.65 0.44 -0.34 0.00 0.00 178.44 179.90 1h5d h ASP 132 N -0.17 1.15 -0.19 1.25 3.32 -1.93 -1.12 116.42 118.73 1h5d h ASP 132 Ca -0.00 -0.04 -0.09 0.00 0.02 0.00 0.00 57.03 56.92 1h5d h ASP 132 Cb 0.15 -0.29 -0.02 0.00 0.22 0.00 0.00 39.33 39.40 1h5d h ASP 132 CO 0.01 0.84 -0.16 0.25 -1.72 0.00 0.00 179.24 178.46 1h5d h LEU 133 N 1.36 0.59 -0.52 1.55 5.85 -1.95 -1.91 115.31 120.28 1h5d h LEU 133 Ca 0.36 -0.18 -0.08 0.00 0.84 0.00 0.00 57.88 58.83 1h5d h LEU 133 Cb -0.14 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 40.71 1h5d h LEU 133 CO -0.08 0.77 0.02 0.00 -0.34 0.00 0.00 178.44 178.81 1h5d h ALA 134 N 1.29 0.69 -0.13 1.25 0.00 -0.38 0.30 119.26 122.29 1h5d h ALA 134 Ca 0.09 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.67 1h5d h ALA 134 Cb 0.59 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1h5d h ALA 134 CO 0.04 0.49 -0.16 -0.91 0.00 0.00 0.00 179.25 178.71 1h5d h ASN 135 N 0.77 0.20 0.22 0.00 2.35 -0.91 -1.96 115.58 116.25 1h5d h ASN 135 Ca 0.15 -0.04 -0.34 0.00 -0.55 0.00 0.00 56.30 55.51 1h5d h ASN 135 Cb 0.50 -0.05 0.02 0.00 0.05 0.00 0.00 38.32 38.84 1h5d h ASN 135 CO 0.02 0.38 -1.62 0.00 -1.65 0.00 0.00 177.43 174.56 1h5d h ALA 136 N 1.65 0.01 0.00 -0.83 0.00 -1.00 -3.40 119.26 115.69 1h5d h ALA 136 Ca 0.04 -1.01 -0.21 0.00 0.00 0.00 0.00 54.91 53.72 1h5d h ALA 136 Cb 0.40 0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.49 1h5d h ALA 136 CO 0.03 0.87 -1.34 -0.91 0.00 0.00 0.00 179.25 177.89 1h5d h ASN 137 N 0.11 0.00 -3.07 0.00 4.21 -0.34 -3.46 115.58 113.02 1h5d h ASN 137 Ca -0.31 0.00 -0.55 0.00 1.21 0.00 0.00 56.30 56.66 1h5d h ASN 137 Cb 2.12 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 39.31 1h5d h ASN 137 CO 0.22 0.78 0.70 -0.76 -1.29 0.00 0.00 177.43 177.08 1h5d s LEU 138 N -6.12 4.30 0.68 1.61 1.43 -0.74 -4.94 118.68 114.90 1h5d s LEU 138 Ca -0.02 1.88 -0.14 0.00 -1.03 0.00 0.00 54.13 54.82 1h5d s LEU 138 Cb 0.08 -3.56 0.01 0.00 0.03 0.00 0.00 46.19 42.76 1h5d s LEU 138 CO 0.81 -0.59 1.10 -2.16 0.23 0.00 0.00 176.35 175.75 1h5d s PRO 139 N 2.09 2.70 0.15 1.29 0.04 -1.26 -4.97 135.00 135.04 1h5d s PRO 139 Ca 0.57 1.33 0.09 0.00 0.04 0.00 0.00 61.00 63.03 1h5d s PRO 139 Cb -0.26 -1.94 -0.04 0.00 0.04 0.00 0.00 34.50 32.30 1h5d s PRO 139 CO 0.24 -1.32 -0.14 0.00 0.04 0.00 0.00 177.00 175.81 1h5d s ALA 140 N -2.48 2.81 0.64 8.56 0.00 -1.26 -4.99 121.76 125.04 1h5d s ALA 140 Ca 0.65 -1.43 0.38 0.00 0.00 0.00 0.00 51.96 51.56 1h5d s ALA 140 Cb -0.20 -0.67 2.14 0.00 0.00 0.00 0.00 23.12 24.40 1h5d s ALA 140 CO 0.45 0.52 2.28 -1.00 0.00 0.00 0.00 175.76 178.01 1h5d h PRO 141 N 3.27 0.00 -0.29 0.00 0.13 -1.97 -1.51 132.00 131.64 1h5d h PRO 141 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1h5d h PRO 141 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1h5d h PRO 141 CO 0.51 0.00 0.00 1.97 -0.23 0.00 0.00 178.00 180.25 1h5d n PHE 142 N -3.33 0.37 -2.17 1.56 1.16 -1.26 -1.78 117.46 112.01 1h5d n PHE 142 Ca -0.03 -0.19 -0.38 0.00 -1.87 0.00 0.00 57.45 54.99 1h5d n PHE 142 Cb 0.12 0.00 -0.00 0.00 -1.61 0.00 0.00 39.48 37.99 1h5d n PHE 142 CO 0.00 0.00 0.00 -0.06 -1.87 0.00 0.00 176.76 174.83 1h5d s PHE 143 N -1.63 2.81 0.79 2.97 0.40 -0.57 -4.97 117.98 117.78 1h5d s PHE 143 Ca 0.31 1.50 -0.10 0.00 -0.60 0.00 0.00 56.93 58.04 1h5d s PHE 143 Cb 0.17 -3.47 0.08 0.00 0.51 0.00 0.00 43.02 40.31 1h5d s PHE 143 CO 0.24 -1.74 1.14 0.95 0.70 0.00 0.00 175.22 176.51 1h5d s THR 144 N -1.47 2.09 0.20 0.64 -4.23 -1.26 -4.42 115.64 107.19 1h5d s THR 144 Ca 0.63 -0.09 -0.10 0.00 -1.18 0.00 0.00 61.69 60.95 1h5d s THR 144 Cb -0.31 -2.99 0.14 0.00 1.34 0.00 0.00 72.50 70.67 1h5d s THR 144 CO 0.38 0.00 1.84 0.25 -0.54 0.00 0.00 174.62 176.55 1h5d h LEU 145 N -0.95 0.88 -1.29 4.79 5.85 -1.96 -0.10 115.31 122.55 1h5d h LEU 145 Ca -0.45 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.20 1h5d h LEU 145 Cb 1.32 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 42.09 1h5d h LEU 145 CO 0.62 0.69 0.46 -0.65 -0.34 0.00 0.00 178.44 179.22 1h5d h PRO 146 N 0.99 0.94 -0.27 5.25 0.11 -1.94 -0.10 132.00 136.99 1h5d h PRO 146 Ca 0.26 -0.06 -0.13 0.00 0.11 0.00 0.00 66.00 66.17 1h5d h PRO 146 Cb -0.02 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 30.87 1h5d h PRO 146 CO -0.05 0.63 -0.38 1.96 -0.21 0.00 0.00 178.00 179.95 1h5d h GLN 147 N 0.97 0.62 -0.33 1.05 4.20 -1.70 -0.35 115.11 119.57 1h5d h GLN 147 Ca 0.26 -0.31 -0.04 0.00 0.06 0.00 0.00 58.65 58.62 1h5d h GLN 147 Cb -0.10 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.67 1h5d h GLN 147 CO -0.05 0.91 0.05 -0.07 -0.67 0.00 0.00 178.83 178.99 1h5d h LEU 148 N 0.52 0.53 -0.66 1.46 3.38 -0.34 -0.54 115.31 119.66 1h5d h LEU 148 Ca 0.05 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 57.75 1h5d h LEU 148 Cb 0.89 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.47 1h5d h LEU 148 CO 0.08 0.66 0.37 0.11 0.09 0.00 0.00 178.44 179.75 1h5d h LYS 149 N 0.38 0.91 -0.56 1.13 1.57 -0.90 -1.95 116.57 117.15 1h5d h LYS 149 Ca 0.10 -0.10 0.02 0.00 -1.87 0.00 0.00 60.65 58.80 1h5d h LYS 149 Cb 0.35 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.45 1h5d h LYS 149 CO 0.01 0.67 0.35 -0.44 -0.57 0.00 0.00 179.45 179.47 1h5d h ASP 150 N 0.89 0.58 -0.77 0.86 3.32 -0.79 -0.52 116.42 120.00 1h5d h ASP 150 Ca 0.23 -0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.26 1h5d h ASP 150 Cb 0.02 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 39.40 1h5d h ASP 150 CO -0.04 0.41 0.42 0.77 -1.72 0.00 0.00 179.24 179.09 1h5d h SER 151 N 0.70 0.96 -0.20 6.45 4.64 -0.62 0.62 113.55 126.11 1h5d h SER 151 Ca 0.22 -0.10 -0.08 0.00 -0.47 0.00 0.00 61.79 61.36 1h5d h SER 151 Cb -0.01 -0.24 -0.00 0.00 -0.31 0.00 0.00 62.40 61.83 1h5d h SER 151 CO -0.08 0.78 -0.19 -0.26 -0.87 0.00 0.00 176.83 176.21 1h5d h PHE 152 N 1.06 0.57 -0.46 4.77 -1.00 -1.08 -3.05 116.94 117.75 1h5d h PHE 152 Ca 0.27 -0.17 -0.02 0.00 2.81 0.00 0.00 57.97 60.86 1h5d h PHE 152 Cb 0.03 -0.12 -0.02 0.00 3.61 0.00 0.00 35.95 39.45 1h5d h PHE 152 CO 0.00 0.83 0.21 0.00 -1.61 0.00 0.00 178.31 177.74 1h5d h ARG 153 N 0.15 0.65 -0.48 1.51 3.08 -0.87 -0.87 114.38 117.54 1h5d h ARG 153 Ca 0.03 -0.08 0.05 0.00 0.07 0.00 0.00 59.98 60.05 1h5d h ARG 153 Cb 0.73 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.63 1h5d h ARG 153 CO 0.05 0.52 0.32 -0.97 -1.07 0.00 0.00 179.97 178.82 1h5d h ASN 154 N 0.65 0.40 -0.04 7.04 -1.24 -0.76 -1.77 115.58 119.86 1h5d h ASN 154 Ca 0.16 -0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.17 1h5d h ASN 154 Cb 0.09 -0.09 0.00 0.00 0.73 0.00 0.00 38.32 39.05 1h5d h ASN 154 CO -0.02 0.27 0.00 1.33 -1.29 0.00 0.00 177.43 177.72 1h5d n VAL 155 N -4.48 0.02 0.00 2.57 0.24 -0.92 -4.95 118.33 110.82 1h5d n VAL 155 Ca 0.06 -0.43 0.00 0.00 -2.04 0.00 0.00 64.34 61.93 1h5d n VAL 155 Cb 0.21 1.14 0.00 0.00 -1.47 0.00 0.00 33.84 33.72 1h5d n VAL 155 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1h5d n GLY 156 N 1.30 0.90 3.31 7.63 0.00 -0.66 -4.86 105.19 112.80 1h5d n GLY 156 Ca 0.16 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.72 1h5d n GLY 156 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1h5d s LEU 157 N 0.00 6.45 0.29 0.99 1.43 -0.38 -4.91 118.68 122.54 1h5d s LEU 157 Ca 0.00 -2.32 0.15 0.00 -1.03 0.00 0.00 54.13 50.93 1h5d s LEU 157 Cb 0.00 -2.19 0.14 0.00 0.03 0.00 0.00 46.19 44.17 1h5d s LEU 157 CO 0.00 -0.68 1.48 0.78 0.23 0.00 0.00 176.35 178.16 1h5d h ASN 158 N 8.21 0.00 -3.56 2.29 2.35 -1.87 -2.89 115.58 120.11 1h5d h ASN 158 Ca -0.07 0.00 -0.52 0.00 -0.55 0.00 0.00 56.30 55.17 1h5d h ASN 158 Cb 1.06 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.42 1h5d h ASN 158 CO 0.87 0.51 0.40 -0.13 -1.65 0.00 0.00 177.43 177.42 1h5d s ARG 159 N -3.04 4.67 0.52 0.81 0.52 -1.26 -4.93 118.95 116.24 1h5d s ARG 159 Ca 0.03 1.53 0.23 0.00 -0.52 0.00 0.00 55.73 57.00 1h5d s ARG 159 Cb 0.08 -3.35 1.39 0.00 0.52 0.00 0.00 34.95 33.59 1h5d s ARG 159 CO 0.74 0.17 2.10 0.77 0.02 0.00 0.00 175.30 179.10 1h5d h SER 160 N 5.47 0.00 -0.18 0.23 0.02 -1.96 0.58 113.55 117.71 1h5d h SER 160 Ca -0.43 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.45 1h5d h SER 160 Cb 1.21 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.73 1h5d h SER 160 CO 0.72 0.10 -0.10 -1.28 -1.14 0.00 0.00 176.83 175.12 1h5d h SER 161 N 0.00 0.53 0.10 3.07 0.87 -1.93 0.14 113.55 116.33 1h5d h SER 161 Ca -0.00 -0.13 -0.00 0.00 -1.23 0.00 0.00 61.79 60.42 1h5d h SER 161 Cb 0.21 -0.14 -0.00 0.00 -0.44 0.00 0.00 62.40 62.03 1h5d h SER 161 CO 0.01 0.67 -0.07 0.44 -0.53 0.00 0.00 176.83 177.35 1h5d h ASP 162 N 0.51 -0.18 -0.19 6.23 3.32 -1.26 0.86 116.42 125.70 1h5d h ASP 162 Ca 0.09 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.15 1h5d h ASP 162 Cb 0.49 0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.09 1h5d h ASP 162 CO 0.03 -0.12 0.07 0.25 -1.72 0.00 0.00 179.24 177.75 1h5d h LEU 163 N -0.18 0.26 -0.34 1.55 5.85 -1.26 -1.15 115.31 120.04 1h5d h LEU 163 Ca -0.00 -0.17 -0.11 0.00 0.84 0.00 0.00 57.88 58.43 1h5d h LEU 163 Cb 0.16 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 1h5d h LEU 163 CO -0.00 0.36 -0.21 0.58 -0.34 0.00 0.00 178.44 178.83 1h5d h VAL 164 N 0.14 1.29 -0.17 1.05 2.07 -0.91 -2.14 116.25 117.57 1h5d h VAL 164 Ca 0.06 -1.35 -0.05 0.00 0.82 0.00 0.00 66.70 66.18 1h5d h VAL 164 Cb 0.19 1.41 -0.00 0.00 -1.52 0.00 0.00 31.29 31.36 1h5d h VAL 164 CO -0.00 0.44 -0.09 0.00 0.02 0.00 0.00 177.57 177.94 1h5d h ALA 165 N 0.77 0.25 0.00 1.67 0.00 -0.84 -3.16 119.26 117.94 1h5d h ALA 165 Ca 0.07 -0.28 -0.07 0.00 0.00 0.00 0.00 54.91 54.63 1h5d h ALA 165 Cb 0.76 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1h5d h ALA 165 CO 0.06 0.07 -0.34 -0.07 0.00 0.00 0.00 179.25 178.97 1h5d h LEU 166 N 0.05 0.00 -1.87 0.00 3.38 -1.26 -1.44 115.31 114.17 1h5d h LEU 166 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1h5d h LEU 166 Cb 0.57 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.32 1h5d h LEU 166 CO 0.03 0.34 0.00 0.28 0.09 0.00 0.00 178.44 179.17 1h5d h SER 167 N 0.00 0.00 0.17 -0.43 0.02 -1.35 -0.69 113.55 111.27 1h5d h SER 167 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1h5d h SER 167 Cb 0.65 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.19 1h5d h SER 167 CO 0.04 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.34 1h5d n GLY 168 N -0.63 -0.60 0.16 -3.77 0.00 -0.54 -1.40 105.19 98.41 1h5d n GLY 168 Ca -0.01 -0.03 0.12 0.00 0.00 0.00 0.00 46.02 46.10 1h5d n GLY 168 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1h5d h GLY 169 N 1.21 0.00 -1.92 -0.02 0.00 -1.30 -1.06 103.07 99.98 1h5d h GLY 169 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 1h5d h GLY 169 CO 0.00 0.00 0.02 1.42 0.00 0.00 0.00 176.54 177.98 1h5d n HIS 170 N -2.31 0.73 1.34 5.60 8.25 -0.49 -3.64 115.22 124.70 1h5d n HIS 170 Ca 0.00 -0.29 0.15 0.00 -0.26 0.00 0.00 57.72 57.31 1h5d n HIS 170 Cb 0.13 -0.26 0.73 0.00 1.12 0.00 0.00 29.99 31.71 1h5d n HIS 170 CO 0.00 0.00 0.00 -2.37 0.64 0.00 0.00 176.34 174.61 1h5d n THR 171 N 0.19 0.00 -3.96 1.59 5.66 -0.40 -3.90 114.28 113.47 1h5d n THR 171 Ca 0.10 0.00 -0.12 0.00 -3.05 0.00 0.00 64.05 60.99 1h5d n THR 171 Cb 0.59 -0.50 -0.01 0.00 -1.55 0.00 0.00 70.33 68.86 1h5d n THR 171 CO 0.00 0.00 0.00 0.72 -3.05 0.00 0.00 175.07 172.74 1h5d s PHE 172 N -2.66 0.58 0.00 1.09 -0.71 -1.24 -4.48 117.98 110.57 1h5d s PHE 172 Ca 0.26 -1.02 0.00 0.00 -1.04 0.00 0.00 56.93 55.13 1h5d s PHE 172 Cb 0.20 0.35 0.00 0.00 -1.21 0.00 0.00 43.02 42.36 1h5d s PHE 172 CO 0.47 -1.32 0.00 0.41 -1.34 0.00 0.00 175.22 173.45 1h5d n GLY 173 N -0.54 0.03 3.58 1.99 0.00 -1.12 -4.69 105.19 104.44 1h5d n GLY 173 Ca -0.03 -1.88 -0.24 0.00 0.00 0.00 0.00 46.02 43.87 1h5d n GLY 173 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h5d s LYS 174 N -1.50 2.09 -0.01 1.61 -0.14 -1.26 -2.26 119.74 118.26 1h5d s LYS 174 Ca 0.00 -1.49 -0.00 0.00 -1.36 0.00 0.00 55.97 53.12 1h5d s LYS 174 Cb 0.00 -2.05 0.02 0.00 -1.68 0.00 0.00 37.83 34.12 1h5d s LYS 174 CO 0.00 0.37 0.02 1.21 -0.76 0.00 0.00 175.35 176.19 1h5d s ASN 175 N -3.50 0.03 0.37 2.83 2.47 0.30 -4.87 114.94 112.57 1h5d s ASN 175 Ca 0.30 0.03 -0.25 0.00 0.42 0.00 0.00 52.86 53.36 1h5d s ASN 175 Cb -0.06 -0.03 -0.09 0.00 -1.45 0.00 0.00 41.25 39.62 1h5d s ASN 175 CO 0.18 -0.07 1.07 -1.10 -3.72 0.00 0.00 177.10 173.45 1h5d s GLN 176 N 0.61 4.26 0.42 0.43 -0.21 -1.26 -0.45 119.66 123.46 1h5d s GLN 176 Ca -0.05 1.60 0.17 0.00 0.02 0.00 0.00 55.36 57.10 1h5d s GLN 176 Cb -0.07 -2.69 1.07 0.00 1.00 0.00 0.00 33.01 32.32 1h5d s GLN 176 CO -0.02 -0.07 1.87 0.00 -2.12 0.00 0.00 175.29 174.95 1h5d h ARG 178 N 0.41 0.48 0.00 0.00 0.11 -1.34 -1.27 114.38 112.77 1h5d h ARG 178 Ca 0.45 -0.03 0.00 0.00 0.10 0.00 0.00 59.98 60.50 1h5d h ARG 178 Cb 1.09 -0.11 0.00 0.00 1.11 0.00 0.00 29.97 32.06 1h5d h ARG 178 CO -0.16 0.32 0.00 1.19 0.10 0.00 0.00 179.97 181.42 1h5d n PHE 179 N -4.69 0.00 -0.32 4.08 3.72 -0.69 -3.52 117.46 116.03 1h5d n PHE 179 Ca 0.25 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.65 1h5d n PHE 179 Cb 0.78 -0.26 0.00 0.00 -0.94 0.00 0.00 39.48 39.06 1h5d n PHE 179 CO 0.00 0.00 0.00 0.44 -0.05 0.00 0.00 176.76 177.15 1h5d n ILE 180 N -1.26 0.11 -0.30 4.37 -5.35 -0.52 -4.78 119.36 111.63 1h5d n ILE 180 Ca 0.13 -0.39 0.10 0.00 -0.27 0.00 0.00 62.75 62.32 1h5d n ILE 180 Cb 0.20 1.22 0.32 0.00 -1.74 0.00 0.00 39.64 39.64 1h5d n ILE 180 CO 0.00 0.00 0.00 0.24 -1.76 0.00 0.00 176.55 175.03 1h5d h MET 181 N 0.00 0.79 -0.37 6.28 2.86 -1.51 -1.30 114.93 121.68 1h5d h MET 181 Ca 0.00 -0.05 -0.07 0.00 -2.06 0.00 0.00 59.70 57.52 1h5d h MET 181 Cb 0.24 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.71 1h5d h MET 181 CO 0.00 0.52 -0.05 0.38 1.06 0.00 0.00 176.91 178.83 1h5d h ASP 182 N 0.81 0.68 -0.24 1.22 2.03 -1.84 -1.58 116.42 117.51 1h5d h ASP 182 Ca 0.46 -0.34 -0.01 0.00 -0.73 0.00 0.00 57.03 56.41 1h5d h ASP 182 Cb 0.61 -0.18 -0.01 0.00 -0.83 0.00 0.00 39.33 38.91 1h5d h ASP 182 CO -0.22 0.86 0.13 0.03 -1.03 0.00 0.00 179.24 179.00 1h5d h ARG 183 N 0.49 0.38 0.10 4.15 3.08 -1.54 -0.86 114.38 120.19 1h5d h ARG 183 Ca 0.10 -0.04 -0.27 0.00 0.07 0.00 0.00 59.98 59.84 1h5d h ARG 183 Cb 0.54 -0.08 -0.00 0.00 0.08 0.00 0.00 29.97 30.50 1h5d h ARG 183 CO 0.03 0.30 -1.28 -0.07 -1.07 0.00 0.00 179.97 177.88 1h5d h LEU 184 N 0.38 0.35 0.00 3.04 3.38 -1.00 0.20 115.31 121.66 1h5d h LEU 184 Ca 0.10 -0.40 0.00 0.00 0.09 0.00 0.00 57.88 57.67 1h5d h LEU 184 Cb 0.05 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.69 1h5d h LEU 184 CO -0.01 1.32 -0.67 -1.22 0.09 0.00 0.00 178.44 177.94 1h5d n TYR 185 N -3.48 0.00 -3.19 1.13 4.01 -0.62 -4.42 117.16 110.59 1h5d n TYR 185 Ca -0.09 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.55 1h5d n TYR 185 Cb 1.02 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 40.01 1h5d n TYR 185 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 1h5d s ASN 186 N -2.50 -0.23 -0.17 7.72 2.47 -0.46 -3.66 114.94 118.10 1h5d s ASN 186 Ca 0.00 -1.50 -0.21 0.00 0.42 0.00 0.00 52.86 51.57 1h5d s ASN 186 Cb 0.00 1.20 -0.03 0.00 -1.45 0.00 0.00 41.25 40.97 1h5d s ASN 186 CO 0.00 -0.18 0.62 0.12 -3.72 0.00 0.00 177.10 173.94 1h5d s PHE 187 N 1.31 3.42 -1.49 0.43 5.36 0.40 -4.20 117.98 123.21 1h5d s PHE 187 Ca 0.21 0.97 -0.07 0.00 -0.96 0.00 0.00 56.93 57.08 1h5d s PHE 187 Cb -0.07 -2.77 0.05 0.00 -0.34 0.00 0.00 43.02 39.90 1h5d s PHE 187 CO -0.06 -0.09 0.65 0.45 -1.46 0.00 0.00 175.22 174.70 1h5d n SER 188 N 4.70 -1.95 -2.42 6.13 2.88 -1.26 -1.38 113.62 120.32 1h5d n SER 188 Ca -0.02 -0.94 -0.15 0.00 -1.33 0.00 0.00 58.87 56.43 1h5d n SER 188 Cb 0.50 -3.28 -0.01 0.00 -0.75 0.00 0.00 64.21 60.68 1h5d n SER 188 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1h5d n ASN 189 N -2.89 -4.46 0.01 -3.46 3.02 -1.26 -4.84 115.26 101.39 1h5d n ASN 189 Ca -0.15 0.14 0.11 0.00 -0.03 0.00 0.00 54.58 54.65 1h5d n ASN 189 Cb 0.61 -3.76 0.08 0.00 -0.61 0.00 0.00 39.78 36.09 1h5d n ASN 189 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1h5d n THR 190 N -3.54 0.08 -0.99 3.41 -2.24 -0.48 -4.93 114.28 105.59 1h5d n THR 190 Ca -0.17 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.49 1h5d n THR 190 Cb 0.63 0.37 0.00 0.00 -2.10 0.00 0.00 70.33 69.23 1h5d n THR 190 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1h5d n GLY 191 N 1.44 0.34 3.29 3.38 0.00 -1.26 -4.95 105.19 107.43 1h5d n GLY 191 Ca 0.04 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.90 1h5d n GLY 191 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1h5d s LEU 192 N 0.00 2.54 0.80 0.99 1.43 -1.24 -4.73 118.68 118.47 1h5d s LEU 192 Ca 0.00 -1.02 -0.11 0.00 -1.03 0.00 0.00 54.13 51.97 1h5d s LEU 192 Cb 0.00 -0.48 0.07 0.00 0.03 0.00 0.00 46.19 45.81 1h5d s LEU 192 CO 0.00 -0.27 1.09 -2.16 0.23 0.00 0.00 176.35 175.24 1h5d s PRO 193 N -3.71 2.06 -0.04 1.29 0.04 -1.26 -0.46 135.00 132.93 1h5d s PRO 193 Ca 0.19 0.94 -0.30 0.00 0.04 0.00 0.00 61.00 61.87 1h5d s PRO 193 Cb 0.01 -1.89 -0.07 0.00 0.04 0.00 0.00 34.50 32.59 1h5d s PRO 193 CO 0.03 -1.71 1.97 0.34 0.04 0.00 0.00 177.00 177.66 1h5d s ASP 194 N -3.56 6.27 0.38 6.66 -1.08 0.70 -4.77 116.67 121.27 1h5d s ASP 194 Ca 0.61 2.41 0.26 0.00 -0.52 0.00 0.00 52.55 55.31 1h5d s ASP 194 Cb -0.16 -2.53 1.36 0.00 -1.46 0.00 0.00 42.92 40.13 1h5d s ASP 194 CO 0.56 -1.23 1.79 1.55 0.52 0.00 0.00 175.17 178.35 1h5d h PRO 195 N 11.39 0.00 -0.19 4.34 0.13 -1.91 -1.80 132.00 143.95 1h5d h PRO 195 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1h5d h PRO 195 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1h5d h PRO 195 CO 0.95 0.00 0.00 0.25 -0.23 0.00 0.00 178.00 178.97 1h5d n THR 196 N -2.41 0.25 -3.62 1.56 -2.24 -1.26 -4.78 114.28 101.79 1h5d n THR 196 Ca -0.01 -0.35 -0.38 0.00 -2.27 0.00 0.00 64.05 61.04 1h5d n THR 196 Cb 0.07 0.31 -0.11 0.00 -2.10 0.00 0.00 70.33 68.50 1h5d n THR 196 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1h5d s LEU 197 N -1.45 4.04 0.04 3.22 2.96 -0.68 -4.71 118.68 122.10 1h5d s LEU 197 Ca 0.30 0.02 -0.37 0.00 -0.22 0.00 0.00 54.13 53.86 1h5d s LEU 197 Cb 0.16 -2.11 -0.17 0.00 0.50 0.00 0.00 46.19 44.57 1h5d s LEU 197 CO 0.24 -0.01 1.38 -3.20 -1.32 0.00 0.00 176.35 173.43 1h5d n ASN 198 N 4.82 1.68 0.24 3.68 2.85 0.26 -4.77 115.26 124.02 1h5d n ASN 198 Ca -0.14 1.12 0.07 0.00 -0.11 0.00 0.00 54.58 55.52 1h5d n ASN 198 Cb 0.52 -1.18 0.59 0.00 1.24 0.00 0.00 39.78 40.95 1h5d n ASN 198 CO 0.00 0.00 0.00 0.71 -2.11 0.00 0.00 177.26 175.86 1h5d h THR 199 N 3.53 1.00 -0.10 -0.44 1.35 -1.94 0.16 112.91 116.49 1h5d h THR 199 Ca -0.48 -0.40 -0.14 0.00 -0.55 0.00 0.00 66.41 64.85 1h5d h THR 199 Cb 1.34 1.22 0.01 0.00 -1.73 0.00 0.00 68.15 68.98 1h5d h THR 199 CO 0.79 0.11 -0.47 0.74 -0.25 0.00 0.00 175.52 176.44 1h5d h THR 200 N 0.00 1.38 -0.11 6.82 2.02 -1.99 -2.92 112.91 118.11 1h5d h THR 200 Ca -0.00 -1.81 -0.08 0.00 0.77 0.00 0.00 66.41 65.28 1h5d h THR 200 Cb 0.21 2.22 -0.01 0.00 -1.74 0.00 0.00 68.15 68.83 1h5d h THR 200 CO 0.01 0.54 -0.31 0.22 0.37 0.00 0.00 175.52 176.36 1h5d h TYR 201 N 0.07 0.22 -0.57 3.16 3.20 -1.83 -2.57 116.97 118.65 1h5d h TYR 201 Ca -0.03 -0.05 0.05 0.00 3.14 0.00 0.00 58.73 61.84 1h5d h TYR 201 Cb 1.12 -0.06 -0.05 0.00 1.54 0.00 0.00 36.73 39.28 1h5d h TYR 201 CO 0.12 0.49 0.30 1.25 -1.64 0.00 0.00 178.16 178.68 1h5d h LEU 202 N 0.18 0.43 -0.34 2.82 5.85 -0.60 0.35 115.31 124.00 1h5d h LEU 202 Ca 0.02 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.77 1h5d h LEU 202 Cb 0.64 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.60 1h5d h LEU 202 CO 0.05 0.29 0.20 1.56 -0.34 0.00 0.00 178.44 180.19 1h5d h GLN 203 N 0.57 0.47 -0.15 1.25 7.50 -1.27 -0.49 115.11 122.99 1h5d h GLN 203 Ca 0.26 -0.05 0.01 0.00 0.50 0.00 0.00 58.65 59.36 1h5d h GLN 203 Cb 0.16 -0.10 -0.01 0.00 0.05 0.00 0.00 27.48 27.58 1h5d h GLN 203 CO -0.17 0.38 0.07 1.15 -1.50 0.00 0.00 178.83 178.76 1h5d h THR 204 N 0.44 1.00 -0.47 -0.54 2.02 -1.19 -2.07 112.91 112.09 1h5d h THR 204 Ca 0.12 -0.06 -0.04 0.00 0.77 0.00 0.00 66.41 67.20 1h5d h THR 204 Cb 0.04 0.82 -0.02 0.00 -1.74 0.00 0.00 68.15 67.25 1h5d h THR 204 CO -0.02 0.03 0.12 -0.07 0.37 0.00 0.00 175.52 175.94 1h5d h LEU 205 N 0.16 0.65 -1.37 2.58 3.38 -0.77 -1.86 115.31 118.09 1h5d h LEU 205 Ca 0.06 -0.10 -0.06 0.00 0.09 0.00 0.00 57.88 57.86 1h5d h LEU 205 Cb 0.01 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 1h5d h LEU 205 CO -0.04 0.65 -0.28 0.03 0.09 0.00 0.00 178.44 178.88 1h5d h ARG 206 N 0.69 0.05 -0.01 1.13 3.08 -0.76 0.19 114.38 118.75 1h5d h ARG 206 Ca 0.16 -0.02 -0.14 0.00 0.07 0.00 0.00 59.98 60.05 1h5d h ARG 206 Cb 0.25 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.28 1h5d h ARG 206 CO -0.00 0.33 -0.67 0.78 -1.07 0.00 0.00 179.97 179.34 1h5d h GLY 207 N 0.90 0.07 1.60 0.04 0.00 -0.65 -2.29 103.07 102.74 1h5d h GLY 207 Ca 0.01 -0.10 -0.24 0.00 0.00 0.00 0.00 47.33 47.00 1h5d h GLY 207 CO 0.04 0.09 -1.26 1.41 0.00 0.00 0.00 176.54 176.81 1h5d h LEU 208 N 0.04 0.00 -6.10 3.11 3.38 -0.97 -3.39 115.31 111.37 1h5d h LEU 208 Ca -0.01 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 57.38 1h5d h LEU 208 Cb 1.18 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 41.53 1h5d h LEU 208 CO 0.09 0.98 -0.81 0.00 0.09 0.00 0.00 178.44 178.79 1h5d s PRO 210 N -1.95 2.30 0.33 0.00 0.04 -0.87 -4.65 135.00 130.21 1h5d s PRO 210 Ca 0.38 1.72 -0.29 0.00 0.04 0.00 0.00 61.00 62.85 1h5d s PRO 210 Cb 0.16 -1.86 -0.11 0.00 0.04 0.00 0.00 34.50 32.74 1h5d s PRO 210 CO -0.05 -1.70 1.45 -1.17 0.04 0.00 0.00 177.00 175.57 1h5d s LEU 211 N -5.02 4.36 -0.91 -3.56 0.20 -1.26 -1.33 118.68 111.15 1h5d s LEU 211 Ca 0.74 2.88 0.00 0.00 0.69 0.00 0.00 54.13 58.44 1h5d s LEU 211 Cb -0.28 -3.65 0.00 0.00 -0.43 0.00 0.00 46.19 41.83 1h5d s LEU 211 CO 0.44 -0.77 0.00 0.59 -0.29 0.00 0.00 176.35 176.32 1h5d n ASN 212 N 1.13 -4.58 -1.83 3.68 5.03 -1.26 -4.99 115.26 112.44 1h5d n ASN 212 Ca 0.03 0.21 0.00 0.00 0.87 0.00 0.00 54.58 55.69 1h5d n ASN 212 Cb 0.40 -2.83 0.00 0.00 -1.02 0.00 0.00 39.78 36.32 1h5d n ASN 212 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1h5d n GLY 213 N -1.21 0.56 3.58 7.41 0.00 -0.44 -4.97 105.19 110.11 1h5d n GLY 213 Ca -0.09 -1.90 -0.41 0.00 0.00 0.00 0.00 46.02 43.62 1h5d n GLY 213 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1h5d s ASN 214 N -1.00 5.76 0.46 1.61 3.04 -1.26 -4.85 114.94 118.69 1h5d s ASN 214 Ca 0.00 0.78 0.31 0.00 0.04 0.00 0.00 52.86 53.99 1h5d s ASN 214 Cb 0.00 -2.53 1.33 0.00 -1.54 0.00 0.00 41.25 38.51 1h5d s ASN 214 CO 0.00 -1.91 1.92 -0.07 -3.04 0.00 0.00 177.10 174.00 1h5d h LEU 215 N 14.39 0.00 -0.71 3.21 3.38 -1.94 -2.64 115.31 131.00 1h5d h LEU 215 Ca -0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1h5d h LEU 215 Cb 1.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 1h5d h LEU 215 CO 1.12 0.00 -0.12 -1.20 0.09 0.00 0.00 178.44 178.33 1h5d n SER 216 N -2.78 1.21 -4.75 -0.43 7.64 -1.26 -0.97 113.62 112.28 1h5d n SER 216 Ca 0.01 -1.18 -0.40 0.00 1.01 0.00 0.00 58.87 58.31 1h5d n SER 216 Cb 0.25 0.05 0.02 0.00 -1.01 0.00 0.00 64.21 63.52 1h5d n SER 216 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1h5d n ALA 217 N -0.26 1.87 -2.86 -0.43 0.00 -0.99 -4.70 120.51 113.14 1h5d n ALA 217 Ca 0.16 0.24 -0.36 0.00 0.00 0.00 0.00 53.44 53.48 1h5d n ALA 217 Cb 0.34 -2.37 -0.06 0.00 0.00 0.00 0.00 19.45 17.36 1h5d n ALA 217 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1h5d s LEU 218 N -2.56 4.28 0.05 0.00 1.43 -1.26 -0.78 118.68 119.84 1h5d s LEU 218 Ca 0.62 0.41 0.06 0.00 -1.03 0.00 0.00 54.13 54.18 1h5d s LEU 218 Cb -0.46 -2.12 -0.02 0.00 0.03 0.00 0.00 46.19 43.62 1h5d s LEU 218 CO 0.57 0.38 -0.16 0.54 0.23 0.00 0.00 176.35 177.91 1h5d s VAL 219 N -1.06 1.28 0.20 -1.59 0.11 0.41 -4.91 120.40 114.83 1h5d s VAL 219 Ca 0.17 -1.15 -0.30 0.00 -2.93 0.00 0.00 61.98 57.77 1h5d s VAL 219 Cb -0.12 -1.16 -0.08 0.00 -1.53 0.00 0.00 36.38 33.48 1h5d s VAL 219 CO 0.06 -0.00 1.20 -1.81 -3.33 0.00 0.00 175.10 171.22 1h5d s ASP 220 N -1.33 7.07 0.25 3.54 1.01 -1.26 -0.54 116.67 125.40 1h5d s ASP 220 Ca 0.03 2.27 -0.02 0.00 0.71 0.00 0.00 52.55 55.53 1h5d s ASP 220 Cb -0.09 -2.61 0.30 0.00 1.01 0.00 0.00 42.92 41.53 1h5d s ASP 220 CO 0.02 -0.38 1.70 -0.26 0.21 0.00 0.00 175.17 176.46 1h5d h PHE 221 N 5.10 0.78 -3.74 4.23 0.04 -1.73 -3.40 116.94 118.22 1h5d h PHE 221 Ca -0.45 -0.15 -0.68 0.00 2.80 0.00 0.00 57.97 59.50 1h5d h PHE 221 Cb 1.21 -0.20 -0.35 0.00 2.20 0.00 0.00 35.95 38.81 1h5d h PHE 221 CO 0.62 0.81 -0.71 0.34 -0.60 0.00 0.00 178.31 178.77 1h5d s ASP 222 N -6.73 4.81 0.49 2.17 2.15 -1.25 -4.35 116.67 113.97 1h5d s ASP 222 Ca -0.09 -1.53 0.32 0.00 0.43 0.00 0.00 52.55 51.68 1h5d s ASP 222 Cb 0.14 -1.68 1.34 0.00 -0.30 0.00 0.00 42.92 42.42 1h5d s ASP 222 CO 0.81 -0.30 1.94 0.17 -0.17 0.00 0.00 175.17 177.63 1h5d h LEU 223 N 7.89 0.00 0.06 -1.34 -0.00 -1.90 -2.54 115.31 117.48 1h5d h LEU 223 Ca -0.17 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.71 1h5d h LEU 223 Cb 1.05 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.71 1h5d h LEU 223 CO 0.54 0.00 -0.03 0.03 -0.00 0.00 0.00 178.44 178.98 1h5d h ARG 224 N 0.00 -0.07 -2.75 0.17 3.08 -1.93 -3.42 114.38 109.45 1h5d h ARG 224 Ca 0.00 0.01 -0.60 0.00 0.07 0.00 0.00 59.98 59.45 1h5d h ARG 224 Cb 0.45 0.02 -0.40 0.00 0.08 0.00 0.00 29.97 30.12 1h5d h ARG 224 CO 0.00 -0.05 -0.78 0.95 -1.07 0.00 0.00 179.97 179.02 1h5d s THR 225 N -1.78 1.45 0.44 2.04 -4.23 -1.24 -5.01 115.64 107.31 1h5d s THR 225 Ca -0.01 -3.17 0.27 0.00 -1.18 0.00 0.00 61.69 57.59 1h5d s THR 225 Cb 0.00 -1.98 0.46 0.00 1.34 0.00 0.00 72.50 72.33 1h5d s THR 225 CO 0.03 -1.08 1.70 -0.65 -0.54 0.00 0.00 174.62 174.09 1h5d h PRO 226 N 5.82 0.19 0.00 3.99 0.11 -1.70 -2.90 132.00 137.52 1h5d h PRO 226 Ca 0.16 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.26 1h5d h PRO 226 Cb 0.86 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.93 1h5d h PRO 226 CO 0.51 0.13 0.00 0.25 -0.21 0.00 0.00 178.00 178.68 1h5d n THR 227 N -4.58 0.35 -3.84 -1.15 -2.24 -1.26 -2.81 114.28 98.74 1h5d n THR 227 Ca 0.31 -0.66 -0.35 0.00 -2.27 0.00 0.00 64.05 61.08 1h5d n THR 227 Cb 1.21 0.84 -0.08 0.00 -2.10 0.00 0.00 70.33 70.21 1h5d n THR 227 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1h5d s ILE 228 N -0.35 5.27 -0.64 2.28 1.01 -1.09 -4.87 121.20 122.81 1h5d s ILE 228 Ca 0.00 0.13 -0.26 0.00 0.00 0.00 0.00 60.65 60.53 1h5d s ILE 228 Cb 0.00 -3.37 0.04 0.00 0.01 0.00 0.00 42.46 39.14 1h5d s ILE 228 CO 0.00 0.49 1.11 0.12 0.00 0.00 0.00 174.94 176.66 1h5d s PHE 229 N -0.01 2.57 0.23 3.97 2.19 0.37 -4.55 117.98 122.74 1h5d s PHE 229 Ca 0.09 -0.02 -0.02 0.00 0.33 0.00 0.00 56.93 57.31 1h5d s PHE 229 Cb -0.11 -4.40 0.01 0.00 -1.31 0.00 0.00 43.02 37.21 1h5d s PHE 229 CO -0.00 -1.69 0.33 -0.40 1.83 0.00 0.00 175.22 175.29 1h5d n ASP 230 N 8.34 -0.92 -0.43 6.13 5.68 -1.26 -3.61 116.55 130.47 1h5d n ASP 230 Ca 0.03 -2.18 0.06 0.00 -0.50 0.00 0.00 54.79 52.19 1h5d n ASP 230 Cb 0.48 1.69 0.19 0.00 -1.14 0.00 0.00 41.12 42.35 1h5d n ASP 230 CO 0.00 0.00 0.00 -0.46 -1.33 0.00 0.00 177.20 175.41 1h5d n ASN 231 N -1.76 1.25 0.20 -1.12 6.94 -1.26 -4.19 115.26 115.32 1h5d n ASN 231 Ca -0.00 -1.90 0.12 0.00 -0.02 0.00 0.00 54.58 52.78 1h5d n ASN 231 Cb 0.37 -0.14 0.69 0.00 -2.36 0.00 0.00 39.78 38.34 1h5d n ASN 231 CO 0.00 0.00 0.00 0.11 -1.03 0.00 0.00 177.26 176.34 1h5d h LYS 232 N 1.44 0.00 -0.95 -3.83 1.79 -1.94 -1.95 116.57 111.13 1h5d h LYS 232 Ca 0.00 0.00 0.17 0.00 -2.18 0.00 0.00 60.65 58.64 1h5d h LYS 232 Cb 0.33 0.00 -0.10 0.00 -1.58 0.00 0.00 32.23 30.87 1h5d h LYS 232 CO 0.00 0.00 0.54 -0.92 -1.08 0.00 0.00 179.45 177.99 1h5d h TYR 233 N 0.00 0.96 0.00 -1.35 3.20 -1.90 -0.83 116.97 117.05 1h5d h TYR 233 Ca 0.06 0.03 -0.15 0.00 3.14 0.00 0.00 58.73 61.81 1h5d h TYR 233 Cb 0.25 -0.28 -0.02 0.00 1.54 0.00 0.00 36.73 38.22 1h5d h TYR 233 CO 0.00 0.22 -0.73 1.88 -1.64 0.00 0.00 178.16 177.89 1h5d h TYR 234 N 0.72 0.00 -0.50 -3.82 0.05 -1.69 -2.75 116.97 108.98 1h5d h TYR 234 Ca 0.53 0.00 -0.10 0.00 0.05 0.00 0.00 58.73 59.22 1h5d h TYR 234 Cb 0.79 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.51 1h5d h TYR 234 CO -0.04 0.73 -0.07 0.28 -1.05 0.00 0.00 178.16 178.01 1h5d h VAL 235 N 0.00 1.26 -0.32 -2.88 2.07 -1.21 -2.45 116.25 112.72 1h5d h VAL 235 Ca -0.01 -1.17 -0.00 0.00 0.82 0.00 0.00 66.70 66.34 1h5d h VAL 235 Cb 1.36 0.95 -0.02 0.00 -1.52 0.00 0.00 31.29 32.06 1h5d h VAL 235 CO 0.10 0.41 0.19 0.78 0.02 0.00 0.00 177.57 179.07 1h5d h ASN 236 N 0.82 0.38 -0.85 0.57 2.35 -1.10 -2.69 115.58 115.06 1h5d h ASN 236 Ca 0.14 -0.05 0.07 0.00 -0.55 0.00 0.00 56.30 55.91 1h5d h ASN 236 Cb 0.59 -0.10 -0.06 0.00 0.05 0.00 0.00 38.32 38.80 1h5d h ASN 236 CO 0.04 0.32 0.53 -0.07 -1.65 0.00 0.00 177.43 176.59 1h5d h LEU 237 N 0.41 0.82 -2.51 1.61 3.38 -1.22 0.20 115.31 118.00 1h5d h LEU 237 Ca 0.11 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 1h5d h LEU 237 Cb 0.00 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.60 1h5d h LEU 237 CO -0.02 0.52 -0.02 -0.33 0.09 0.00 0.00 178.44 178.68 1h5d h GLU 238 N 0.95 0.00 -0.54 1.13 5.08 -1.11 -0.59 114.58 119.50 1h5d h GLU 238 Ca 0.38 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.74 1h5d h GLU 238 Cb 0.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.45 1h5d h GLU 238 CO -0.18 0.02 0.00 0.39 -1.00 0.00 0.00 179.01 178.23 1h5d n GLU 239 N -3.62 3.48 -2.79 2.33 1.02 -0.26 -4.94 120.64 115.86 1h5d n GLU 239 Ca -0.03 -2.75 -0.18 0.00 -0.02 0.00 0.00 57.16 54.19 1h5d n GLU 239 Cb 0.10 -1.78 0.02 0.00 -0.02 0.00 0.00 31.44 29.76 1h5d n GLU 239 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1h5d n GLN 240 N 0.78 -3.58 -0.50 3.49 1.13 -0.23 -4.58 117.38 113.89 1h5d n GLN 240 Ca 0.23 0.74 0.05 0.00 -1.94 0.00 0.00 57.00 56.08 1h5d n GLN 240 Cb 0.81 -5.22 0.22 0.00 0.11 0.00 0.00 30.24 26.16 1h5d n GLN 240 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1h5d n LYS 241 N -3.27 2.26 -2.18 -1.09 5.02 0.54 -0.57 118.16 118.87 1h5d n LYS 241 Ca -0.11 -2.92 -0.40 0.00 -2.02 0.00 0.00 58.31 52.86 1h5d n LYS 241 Cb 0.61 -1.77 -0.02 0.00 -0.02 0.00 0.00 35.03 33.82 1h5d n LYS 241 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1h5d s GLY 242 N -2.32 2.97 -0.04 0.72 0.00 -1.26 -4.70 107.32 102.69 1h5d s GLY 242 Ca 0.41 1.16 -0.21 0.00 0.00 0.00 0.00 44.72 46.08 1h5d s GLY 242 CO 0.05 1.77 0.89 -2.00 0.00 0.00 0.00 173.10 173.80 1h5d h LEU 243 N 3.18 -0.25-10.25 0.66 5.85 -1.93 -3.43 115.31 109.13 1h5d h LEU 243 Ca -0.49 -0.27 -0.45 0.00 0.84 0.00 0.00 57.88 57.51 1h5d h LEU 243 Cb 1.23 0.07 -0.00 0.00 0.37 0.00 0.00 40.66 42.32 1h5d h LEU 243 CO 0.65 0.25 -0.38 0.27 -0.34 0.00 0.00 178.44 178.89 1h5d s ILE 244 N -3.59 4.69 0.19 4.05 -4.36 -1.26 -4.95 121.20 115.97 1h5d s ILE 244 Ca -0.12 -0.97 -0.13 0.00 -0.26 0.00 0.00 60.65 59.17 1h5d s ILE 244 Cb 0.01 -3.65 0.13 0.00 1.25 0.00 0.00 42.46 40.20 1h5d s ILE 244 CO 0.45 -0.26 1.69 -0.61 0.24 0.00 0.00 174.94 176.45 1h5d h GLN 245 N 1.02 0.14 0.00 0.37 4.15 -1.87 -0.97 115.11 117.95 1h5d h GLN 245 Ca -0.49 -0.01 -0.00 0.00 0.77 0.00 0.00 58.65 58.92 1h5d h GLN 245 Cb 1.24 -0.03 -0.00 0.00 0.21 0.00 0.00 27.48 28.90 1h5d h GLN 245 CO 0.57 0.09 -0.00 0.66 -1.93 0.00 0.00 178.83 178.22 1h5d h SER 246 N 0.14 0.00 0.20 -0.69 4.64 -1.56 -1.32 113.55 114.97 1h5d h SER 246 Ca 0.25 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.56 1h5d h SER 246 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 1h5d h SER 246 CO -0.40 0.00 -0.10 0.44 -0.87 0.00 0.00 176.83 175.91 1h5d h ASP 247 N 0.00 -0.23 0.11 4.97 3.32 -1.50 -3.34 116.42 119.75 1h5d h ASP 247 Ca -0.00 -0.20 -0.02 0.00 0.02 0.00 0.00 57.03 56.83 1h5d h ASP 247 Cb 0.01 0.06 -0.00 0.00 0.22 0.00 0.00 39.33 39.61 1h5d h ASP 247 CO 0.00 0.31 -0.08 -0.61 -1.72 0.00 0.00 179.24 177.13 1h5d h GLN 248 N -0.99 0.00 -0.06 3.56 5.75 -1.24 -2.52 115.11 119.60 1h5d h GLN 248 Ca -0.03 0.00 0.02 0.00 -0.15 0.00 0.00 58.65 58.49 1h5d h GLN 248 Cb 0.42 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 28.97 1h5d h GLN 248 CO 0.05 0.08 0.05 0.93 -2.65 0.00 0.00 178.83 177.29 1h5d h GLU 249 N 0.00 0.00 0.00 1.69 4.39 -1.36 0.12 114.58 119.42 1h5d h GLU 249 Ca -0.00 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 1h5d h GLU 249 Cb 0.16 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.81 1h5d h GLU 249 CO 0.01 0.00 -0.13 -0.07 -1.16 0.00 0.00 179.01 177.66 1h5d h LEU 250 N 0.00 0.00 0.00 1.33 3.38 -1.59 -1.95 115.31 116.48 1h5d h LEU 250 Ca 0.03 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.79 1h5d h LEU 250 Cb 0.13 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 1h5d h LEU 250 CO -0.00 0.13 -1.77 0.33 0.09 0.00 0.00 178.44 177.22 1h5d n PHE 251 N -3.90 0.00 0.59 1.13 7.35 -0.48 -3.58 117.46 118.58 1h5d n PHE 251 Ca -0.02 0.00 0.07 0.00 -0.76 0.00 0.00 57.45 56.73 1h5d n PHE 251 Cb 0.23 -0.56 -0.08 0.00 0.35 0.00 0.00 39.48 39.42 1h5d n PHE 251 CO 0.00 0.00 0.00 0.43 -0.76 0.00 0.00 176.76 176.43 1h5d n SER 252 N -2.45 0.74 -4.75 -2.13 7.64 -0.09 -4.86 113.62 107.73 1h5d n SER 252 Ca -0.19 -0.75 -0.38 0.00 1.01 0.00 0.00 58.87 58.56 1h5d n SER 252 Cb 0.86 1.06 0.03 0.00 -1.01 0.00 0.00 64.21 65.15 1h5d n SER 252 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1h5d s SER 253 N -2.41 5.43 0.51 6.43 0.15 -0.74 -4.87 113.70 118.21 1h5d s SER 253 Ca 0.04 2.66 0.34 0.00 0.70 0.00 0.00 55.95 59.69 1h5d s SER 253 Cb 0.10 -2.63 1.69 0.00 -1.71 0.00 0.00 66.02 63.48 1h5d s SER 253 CO 0.57 -1.45 2.03 -0.65 1.20 0.00 0.00 173.24 174.94 1h5d h PRO 254 N 1.54 0.00 -0.69 5.44 0.11 -1.96 -0.73 132.00 135.72 1h5d h PRO 254 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1h5d h PRO 254 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1h5d h PRO 254 CO 0.58 0.00 0.00 -1.71 -0.21 0.00 0.00 178.00 176.66 1h5d n ASN 255 N -2.79 4.65 -1.10 -2.05 4.05 -1.26 -4.53 115.26 112.22 1h5d n ASN 255 Ca -0.01 -2.35 0.03 0.00 0.45 0.00 0.00 54.58 52.71 1h5d n ASN 255 Cb 0.15 -0.57 0.18 0.00 1.23 0.00 0.00 39.78 40.77 1h5d n ASN 255 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1h5d n ALA 256 N 1.29 3.09 -0.21 5.20 0.00 -0.28 -4.39 120.51 125.22 1h5d n ALA 256 Ca 0.26 -0.85 0.09 0.00 0.00 0.00 0.00 53.44 52.94 1h5d n ALA 256 Cb 0.84 -1.05 0.37 0.00 0.00 0.00 0.00 19.45 19.61 1h5d n ALA 256 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1h5d h THR 257 N 1.81 0.94 0.00 0.00 2.02 -1.82 -0.25 112.91 115.61 1h5d h THR 257 Ca 0.00 -0.24 -0.14 0.00 0.77 0.00 0.00 66.41 66.80 1h5d h THR 257 Cb 1.13 0.17 -0.02 0.00 -1.74 0.00 0.00 68.15 67.69 1h5d h THR 257 CO 0.21 0.13 -1.13 -2.24 0.37 0.00 0.00 175.52 172.86 1h5d h ASP 258 N 0.71 0.00 0.72 4.18 2.03 -1.97 -3.38 116.42 118.70 1h5d h ASP 258 Ca 0.36 0.00 -0.19 0.00 -0.73 0.00 0.00 57.03 56.47 1h5d h ASP 258 Cb 0.46 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 38.93 1h5d h ASP 258 CO -0.14 0.51 -1.41 0.71 -1.03 0.00 0.00 179.24 177.89 1h5d h THR 259 N 0.00 0.65 -0.25 1.15 1.35 -1.66 -3.38 112.91 110.76 1h5d h THR 259 Ca -0.11 -2.23 0.03 0.00 -0.55 0.00 0.00 66.41 63.56 1h5d h THR 259 Cb 1.49 2.18 -0.03 0.00 -1.73 0.00 0.00 68.15 70.05 1h5d h THR 259 CO 0.05 0.37 0.06 0.40 -0.25 0.00 0.00 175.52 176.15 1h5d h ILE 260 N 0.00 0.90 0.00 6.82 2.04 -1.12 -0.71 117.51 125.44 1h5d h ILE 260 Ca -0.18 -0.06 -0.02 0.00 1.00 0.00 0.00 64.86 65.61 1h5d h ILE 260 Cb 1.68 0.72 -0.00 0.00 -0.74 0.00 0.00 36.82 38.48 1h5d h ILE 260 CO 0.06 0.03 -0.09 1.55 0.00 0.00 0.00 178.15 179.70 1h5d h PRO 261 N 0.16 0.00 -0.14 2.37 0.13 -1.78 -0.73 132.00 132.02 1h5d h PRO 261 Ca 0.11 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 65.10 1h5d h PRO 261 Cb 0.11 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.24 1h5d h PRO 261 CO -0.14 0.09 -0.49 -0.07 -0.23 0.00 0.00 178.00 177.16 1h5d h LEU 262 N 0.00 0.67 -0.37 1.56 3.38 -1.57 -1.12 115.31 117.86 1h5d h LEU 262 Ca -0.00 -0.61 0.01 0.00 0.09 0.00 0.00 57.88 57.37 1h5d h LEU 262 Cb 0.16 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 1h5d h LEU 262 CO 0.01 1.16 0.22 0.58 0.09 0.00 0.00 178.44 180.50 1h5d h VAL 263 N 0.21 1.04 -0.55 1.22 2.07 -0.52 -0.97 116.25 118.75 1h5d h VAL 263 Ca -0.02 -0.15 -0.02 0.00 0.82 0.00 0.00 66.70 67.33 1h5d h VAL 263 Cb 1.11 0.56 -0.03 0.00 -1.52 0.00 0.00 31.29 31.42 1h5d h VAL 263 CO 0.10 0.08 0.26 0.03 0.02 0.00 0.00 177.57 178.07 1h5d h ARG 264 N 0.45 0.80 -0.64 1.57 3.08 -1.14 -0.97 114.38 117.52 1h5d h ARG 264 Ca 0.14 -0.12 -0.05 0.00 0.07 0.00 0.00 59.98 60.03 1h5d h ARG 264 Cb -0.00 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 29.88 1h5d h ARG 264 CO -0.06 0.66 0.20 0.66 -1.07 0.00 0.00 179.97 180.35 1h5d h SER 265 N 0.75 0.91 1.00 7.04 4.64 -0.85 -0.61 113.55 126.41 1h5d h SER 265 Ca 0.19 -0.16 -0.13 0.00 -0.47 0.00 0.00 61.79 61.22 1h5d h SER 265 Cb 0.12 -0.24 -0.02 0.00 -0.31 0.00 0.00 62.40 61.96 1h5d h SER 265 CO -0.02 0.85 -0.64 -0.26 -0.87 0.00 0.00 176.83 175.89 1h5d h PHE 266 N 0.94 0.00 0.00 4.77 0.04 -0.98 -2.46 116.94 119.25 1h5d h PHE 266 Ca 0.21 0.00 -0.18 0.00 2.80 0.00 0.00 57.97 60.80 1h5d h PHE 266 Cb 0.27 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.40 1h5d h PHE 266 CO 0.02 0.64 -0.86 0.00 -0.60 0.00 0.00 178.31 177.51 1h5d h ALA 267 N 1.36 0.59 0.00 2.45 0.00 -0.85 -3.29 119.26 119.52 1h5d h ALA 267 Ca -0.01 -0.77 -0.17 0.00 0.00 0.00 0.00 54.91 53.96 1h5d h ALA 267 Cb 1.31 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 1h5d h ALA 267 CO 0.08 1.04 -0.83 -0.91 0.00 0.00 0.00 179.25 178.64 1h5d h ASN 268 N 0.01 0.00 -3.26 0.00 -0.26 -1.03 -3.46 115.58 107.59 1h5d h ASN 268 Ca -0.01 0.00 -0.33 0.00 -0.56 0.00 0.00 56.30 55.39 1h5d h ASN 268 Cb 1.51 0.00 -0.37 0.00 -1.06 0.00 0.00 38.32 38.39 1h5d h ASN 268 CO 0.11 0.83 -0.70 -0.55 -1.06 0.00 0.00 177.43 176.06 1h5d s SER 269 N -6.63 0.89 0.19 5.81 0.15 -0.94 -5.01 113.70 108.16 1h5d s SER 269 Ca 0.02 0.17 -0.12 0.00 0.70 0.00 0.00 55.95 56.72 1h5d s SER 269 Cb 0.09 0.02 0.10 0.00 -1.71 0.00 0.00 66.02 64.52 1h5d s SER 269 CO 0.79 -0.24 1.83 0.74 1.20 0.00 0.00 173.24 177.57 1h5d h THR 270 N 6.39 1.18 -0.54 6.45 2.02 -1.88 -1.80 112.91 124.73 1h5d h THR 270 Ca -0.16 -0.39 0.03 0.00 0.77 0.00 0.00 66.41 66.67 1h5d h THR 270 Cb 1.12 0.31 -0.04 0.00 -1.74 0.00 0.00 68.15 67.80 1h5d h THR 270 CO 0.18 0.18 0.31 -0.61 0.37 0.00 0.00 175.52 175.95 1h5d h GLN 271 N 0.85 0.59 -0.59 6.66 4.15 -1.95 0.17 115.11 124.99 1h5d h GLN 271 Ca 0.23 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.60 1h5d h GLN 271 Cb -0.04 -0.13 -0.03 0.00 0.21 0.00 0.00 27.48 27.49 1h5d h GLN 271 CO -0.04 0.39 0.31 1.15 -1.93 0.00 0.00 178.83 178.71 1h5d h THR 272 N 0.60 1.20 0.41 2.39 2.02 -1.79 -0.91 112.91 116.83 1h5d h THR 272 Ca 0.23 -0.52 -0.02 0.00 0.77 0.00 0.00 66.41 66.87 1h5d h THR 272 Cb 0.07 0.45 0.00 0.00 -1.74 0.00 0.00 68.15 66.94 1h5d h THR 272 CO -0.12 0.22 -0.20 0.15 0.37 0.00 0.00 175.52 175.94 1h5d h PHE 273 N 0.80 -0.51 -0.80 3.16 3.57 -0.73 -1.98 116.94 120.45 1h5d h PHE 273 Ca 0.21 -0.01 0.12 0.00 3.53 0.00 0.00 57.97 61.81 1h5d h PHE 273 Cb 0.06 0.17 -0.08 0.00 2.79 0.00 0.00 35.95 38.89 1h5d h PHE 273 CO -0.01 -0.20 0.41 0.74 -2.23 0.00 0.00 178.31 177.02 1h5d h PHE 274 N -0.78 0.74 -0.47 0.41 -1.00 -0.63 0.35 116.94 115.57 1h5d h PHE 274 Ca -0.06 0.03 -0.01 0.00 2.81 0.00 0.00 57.97 60.75 1h5d h PHE 274 Cb 0.53 -0.21 -0.02 0.00 3.61 0.00 0.00 35.95 39.86 1h5d h PHE 274 CO 0.00 0.23 0.25 -0.91 -1.61 0.00 0.00 178.31 176.28 1h5d h ASN 275 N 0.65 0.58 -0.24 2.17 2.35 -1.13 -1.47 115.58 118.50 1h5d h ASN 275 Ca 0.41 -0.09 -0.10 0.00 -0.55 0.00 0.00 56.30 55.97 1h5d h ASN 275 Cb 0.50 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 38.70 1h5d h ASN 275 CO -0.31 0.51 -0.18 0.00 -1.65 0.00 0.00 177.43 175.80 1h5d h ALA 276 N 1.10 1.00 -0.38 -0.83 0.00 -0.43 -2.07 119.26 117.64 1h5d h ALA 276 Ca 0.16 -0.34 -0.05 0.00 0.00 0.00 0.00 54.91 54.68 1h5d h ALA 276 Cb 0.06 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1h5d h ALA 276 CO -0.03 0.59 0.03 0.35 0.00 0.00 0.00 179.25 180.20 1h5d h PHE 277 N 0.61 0.70 -0.49 0.00 3.57 -0.01 -0.04 116.94 121.28 1h5d h PHE 277 Ca 0.09 -0.11 -0.04 0.00 3.53 0.00 0.00 57.97 61.45 1h5d h PHE 277 Cb 0.65 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 39.18 1h5d h PHE 277 CO 0.03 0.71 0.15 0.28 -2.23 0.00 0.00 178.31 177.26 1h5d h VAL 278 N 0.48 1.23 -0.44 1.41 2.07 -1.18 0.26 116.25 120.08 1h5d h VAL 278 Ca 0.11 -0.75 -0.01 0.00 0.82 0.00 0.00 66.70 66.87 1h5d h VAL 278 Cb 0.41 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 30.96 1h5d h VAL 278 CO 0.01 0.28 0.25 -0.08 0.02 0.00 0.00 177.57 178.05 1h5d h GLU 279 N 0.65 0.60 -0.33 1.57 4.81 -1.22 -1.18 114.58 119.48 1h5d h GLU 279 Ca 0.16 -0.06 -0.16 0.00 -0.13 0.00 0.00 59.36 59.17 1h5d h GLU 279 Cb 0.27 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.52 1h5d h GLU 279 CO -0.01 0.46 -0.42 0.00 -0.73 0.00 0.00 179.01 178.32 1h5d h ALA 280 N 1.10 0.63 -0.67 2.92 0.00 -0.81 -2.30 119.26 120.13 1h5d h ALA 280 Ca 0.15 -0.46 -0.00 0.00 0.00 0.00 0.00 54.91 54.60 1h5d h ALA 280 Cb 0.03 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 1h5d h ALA 280 CO -0.03 0.67 0.40 0.52 0.00 0.00 0.00 179.25 180.82 1h5d h MET 281 N 0.67 0.91 -0.07 0.00 2.86 -0.26 0.16 114.93 119.20 1h5d h MET 281 Ca 0.05 -0.09 -0.11 0.00 -2.06 0.00 0.00 59.70 57.49 1h5d h MET 281 Cb 1.00 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 32.45 1h5d h MET 281 CO 0.10 0.65 -0.46 -0.44 1.06 0.00 0.00 176.91 177.82 1h5d h ASP 282 N 0.91 0.17 -0.33 1.22 3.32 -1.16 0.51 116.42 121.05 1h5d h ASP 282 Ca 0.24 -0.07 -0.10 0.00 0.02 0.00 0.00 57.03 57.11 1h5d h ASP 282 Cb -0.02 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.48 1h5d h ASP 282 CO -0.04 0.60 -0.19 0.03 -1.72 0.00 0.00 179.24 177.92 1h5d h ARG 283 N 0.13 0.72 -0.53 3.56 3.08 -0.86 -2.34 114.38 118.14 1h5d h ARG 283 Ca 0.01 -0.33 -0.08 0.00 0.07 0.00 0.00 59.98 59.65 1h5d h ARG 283 Cb 0.86 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.87 1h5d h ARG 283 CO 0.07 0.93 0.01 1.98 -1.07 0.00 0.00 179.97 181.89 1h5d h MET 284 N 0.49 0.90 0.00 0.04 4.05 -0.74 -1.86 114.93 117.81 1h5d h MET 284 Ca 0.07 -0.26 0.00 0.00 -0.28 0.00 0.00 59.70 59.23 1h5d h MET 284 Cb 0.73 -0.10 0.00 0.00 -0.80 0.00 0.00 31.60 31.44 1h5d h MET 284 CO 0.05 0.89 0.00 0.41 0.23 0.00 0.00 176.91 178.49 1h5d n GLY 285 N -0.57 -0.88 1.13 1.39 0.00 0.15 -2.20 105.19 104.21 1h5d n GLY 285 Ca 0.03 -0.06 0.11 0.00 0.00 0.00 0.00 46.02 46.09 1h5d n GLY 285 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1h5d n ASN 286 N -1.37 3.51 -4.65 1.61 4.05 -0.70 -4.82 115.26 112.87 1h5d n ASN 286 Ca 0.06 -1.97 -0.43 0.00 0.45 0.00 0.00 54.58 52.69 1h5d n ASN 286 Cb 0.14 -0.32 -0.02 0.00 1.23 0.00 0.00 39.78 40.81 1h5d n ASN 286 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 1h5d s ILE 287 N -1.21 3.97 -0.28 -1.44 1.01 -0.93 -4.34 121.20 117.97 1h5d s ILE 287 Ca 0.39 1.15 -0.06 0.00 0.00 0.00 0.00 60.65 62.13 1h5d s ILE 287 Cb 0.22 -3.80 0.01 0.00 0.01 0.00 0.00 42.46 38.90 1h5d s ILE 287 CO 0.29 -0.16 0.17 0.35 0.00 0.00 0.00 174.94 175.59 1h5d n THR 288 N 5.62 -0.72 -2.56 2.92 -2.24 -1.26 -2.97 114.28 113.06 1h5d n THR 288 Ca 0.16 -0.10 -0.32 0.00 -2.27 0.00 0.00 64.05 61.52 1h5d n THR 288 Cb 0.44 -0.62 -0.04 0.00 -2.10 0.00 0.00 70.33 68.01 1h5d n THR 288 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1h5d s PRO 289 N -4.68 3.97 -0.05 -0.78 0.04 -1.26 -4.47 135.00 127.77 1h5d s PRO 289 Ca 0.09 0.90 -0.17 0.00 0.04 0.00 0.00 61.00 61.86 1h5d s PRO 289 Cb -0.05 -2.19 -0.05 0.00 0.04 0.00 0.00 34.50 32.25 1h5d s PRO 289 CO 0.24 -0.18 0.46 -0.51 0.04 0.00 0.00 177.00 177.05 1h5d s LEU 290 N -3.84 4.38 0.31 -3.56 1.43 -1.26 -4.98 118.68 111.15 1h5d s LEU 290 Ca 0.58 0.91 0.05 0.00 -1.03 0.00 0.00 54.13 54.64 1h5d s LEU 290 Cb -0.10 -2.67 -0.03 0.00 0.03 0.00 0.00 46.19 43.42 1h5d s LEU 290 CO 0.28 0.15 0.23 0.42 0.23 0.00 0.00 176.35 177.66 1h5d s THR 291 N -0.20 0.07 0.00 5.49 -4.23 -1.26 -0.35 115.64 115.17 1h5d s THR 291 Ca 0.25 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.76 1h5d s THR 291 Cb -0.16 -2.49 0.00 0.00 1.34 0.00 0.00 72.50 71.19 1h5d s THR 291 CO 0.12 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.81 1h5d n GLY 292 N -0.57 1.59 0.58 3.99 0.00 -1.26 -1.43 105.19 108.09 1h5d n GLY 292 Ca 0.05 0.26 0.06 0.00 0.00 0.00 0.00 46.02 46.40 1h5d n GLY 292 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1h5d n THR 293 N 0.00 0.30 -2.46 2.61 -2.24 -1.26 -4.99 114.28 106.24 1h5d n THR 293 Ca 0.00 -0.65 -0.41 0.00 -2.27 0.00 0.00 64.05 60.72 1h5d n THR 293 Cb 0.00 1.04 -0.04 0.00 -2.10 0.00 0.00 70.33 69.22 1h5d n THR 293 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1h5d s GLN 294 N -1.05 4.60 2.28 -0.78 -0.21 -0.52 -4.81 119.66 119.16 1h5d s GLN 294 Ca 0.19 1.81 0.00 0.00 0.02 0.00 0.00 55.36 57.37 1h5d s GLN 294 Cb 0.12 -3.22 0.00 0.00 1.00 0.00 0.00 33.01 30.91 1h5d s GLN 294 CO 0.17 0.12 0.00 0.41 -2.12 0.00 0.00 175.29 173.87 1h5d n GLY 295 N 1.54 -0.51 3.38 3.09 0.00 -1.26 -4.37 105.19 107.06 1h5d n GLY 295 Ca 0.01 -1.08 -0.22 0.00 0.00 0.00 0.00 46.02 44.72 1h5d n GLY 295 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1h5d s GLN 296 N 0.00 1.86 -0.62 1.61 -0.21 -0.83 -4.87 119.66 116.60 1h5d s GLN 296 Ca 0.00 -2.11 -0.08 0.00 0.02 0.00 0.00 55.36 53.19 1h5d s GLN 296 Cb 0.00 -0.03 0.16 0.00 1.00 0.00 0.00 33.01 34.14 1h5d s GLN 296 CO 0.00 -0.61 0.49 0.42 -2.12 0.00 0.00 175.29 173.47 1h5d s ILE 297 N -3.33 4.39 0.22 1.08 -1.09 -1.26 -0.30 121.20 120.90 1h5d s ILE 297 Ca 0.33 -2.40 -0.31 0.00 -2.23 0.00 0.00 60.65 56.04 1h5d s ILE 297 Cb 0.02 -3.82 -0.11 0.00 -1.58 0.00 0.00 42.46 36.97 1h5d s ILE 297 CO 0.23 -0.88 1.59 -0.60 -1.23 0.00 0.00 174.94 174.05 1h5d s ARG 298 N 0.52 4.18 -0.00 2.79 3.52 -1.26 -4.92 118.95 123.78 1h5d s ARG 298 Ca 0.13 2.46 -0.11 0.00 -0.13 0.00 0.00 55.73 58.07 1h5d s ARG 298 Cb -0.20 -3.10 -0.32 0.00 -1.56 0.00 0.00 34.95 29.77 1h5d s ARG 298 CO -0.04 -0.61 0.84 -0.07 -0.81 0.00 0.00 175.30 174.61 1h5d h LEU 299 N 6.07 0.66 -7.97 -0.88 3.38 -1.95 -3.42 115.31 111.21 1h5d h LEU 299 Ca -0.44 -0.84 -0.67 0.00 0.09 0.00 0.00 57.88 56.01 1h5d h LEU 299 Cb 1.21 -0.22 -0.35 0.00 0.09 0.00 0.00 40.66 41.39 1h5d h LEU 299 CO 0.87 1.69 -0.79 0.21 0.09 0.00 0.00 178.44 180.51 1h5d s ASN 300 N -7.35 4.25 0.57 -0.43 3.84 -1.26 -4.91 114.94 109.64 1h5d s ASN 300 Ca -0.12 -1.17 0.34 0.00 0.21 0.00 0.00 52.86 52.12 1h5d s ASN 300 Cb 0.05 -1.58 1.84 0.00 -0.55 0.00 0.00 41.25 41.02 1h5d s ASN 300 CO 0.89 -0.16 2.03 0.00 -2.79 0.00 0.00 177.10 177.07 1h5d h ARG 302 N 0.00 0.00 -3.85 0.00 3.08 -1.95 -3.29 114.38 108.36 1h5d h ARG 302 Ca 0.00 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.88 1h5d h ARG 302 Cb 0.21 0.00 -0.21 0.00 0.08 0.00 0.00 29.97 30.05 1h5d h ARG 302 CO 0.00 0.00 -0.65 0.14 -1.07 0.00 0.00 179.97 178.39 1h5d s VAL 303 N -3.17 0.10 0.43 2.04 -7.23 -0.69 -1.30 120.40 110.58 1h5d s VAL 303 Ca 0.08 -0.83 -0.24 0.00 -1.81 0.00 0.00 61.98 59.18 1h5d s VAL 303 Cb 0.10 -0.30 -0.08 0.00 0.56 0.00 0.00 36.38 36.66 1h5d s VAL 303 CO 0.66 -0.46 1.13 -0.69 -0.31 0.00 0.00 175.10 175.43 1h5d s VAL 304 N -1.40 3.33 0.46 1.32 1.01 -1.26 -4.47 120.40 119.39 1h5d s VAL 304 Ca -0.15 1.03 -0.24 0.00 0.00 0.00 0.00 61.98 62.61 1h5d s VAL 304 Cb -0.09 -3.53 -0.07 0.00 0.00 0.00 0.00 36.38 32.68 1h5d s VAL 304 CO -0.00 0.01 1.31 0.20 0.00 0.00 0.00 175.10 176.62 1h5d s ASN 305 N -1.39 5.90 0.00 3.32 0.01 -1.26 -5.04 114.94 116.48 1h5d s ASN 305 Ca 0.60 2.66 0.00 0.00 -0.71 0.00 0.00 52.86 55.41 1h5d s ASN 305 Cb -0.27 -2.63 0.00 0.00 0.41 0.00 0.00 41.25 38.76 1h5d s ASN 305 CO 0.33 -1.13 0.42 -1.54 -1.51 0.00 0.00 177.10 173.67