#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h5l s LEU 2 N 0.00 4.42 -0.00 1.08 1.43 -1.26 -4.97 118.68 119.37 1h5l s LEU 2 Ca 0.00 2.24 0.01 0.00 -1.03 0.00 0.00 54.13 55.35 1h5l s LEU 2 Cb 0.00 -3.80 -0.00 0.00 0.03 0.00 0.00 46.19 42.42 1h5l s LEU 2 CO 0.00 -0.29 -0.03 0.28 0.23 0.00 0.00 176.35 176.53 1h5l s THR 3 N -1.30 0.26 0.55 5.49 -1.32 -0.07 -4.68 115.64 114.57 1h5l s THR 3 Ca 0.49 -0.19 0.36 0.00 -1.21 0.00 0.00 61.69 61.14 1h5l s THR 3 Cb -0.30 -0.23 0.39 0.00 -1.51 0.00 0.00 72.50 70.84 1h5l s THR 3 CO 0.38 0.04 2.25 -0.65 -2.21 0.00 0.00 174.62 174.43 1h5l h PRO 4 N 5.97 0.00 -0.29 7.08 0.11 -1.84 0.11 132.00 143.15 1h5l h PRO 4 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 1h5l h PRO 4 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1h5l h PRO 4 CO 0.50 0.02 0.00 0.25 -0.21 0.00 0.00 178.00 178.56 1h5l n THR 5 N -3.42 0.37 -0.33 -1.15 -2.24 -1.26 -4.61 114.28 101.64 1h5l n THR 5 Ca -0.02 -0.52 0.27 0.00 -2.27 0.00 0.00 64.05 61.51 1h5l n THR 5 Cb 0.13 0.56 0.52 0.00 -2.10 0.00 0.00 70.33 69.44 1h5l n THR 5 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 1h5l h PHE 6 N 3.03 0.89 -0.40 4.78 3.57 -1.76 -0.71 116.94 126.33 1h5l h PHE 6 Ca 0.00 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.54 1h5l h PHE 6 Cb 0.67 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 39.19 1h5l h PHE 6 CO 0.19 -0.28 0.00 0.66 -2.23 0.00 0.00 178.31 176.64 1h5l n TYR 7 N -5.12 1.00 0.30 0.41 4.01 -1.26 -4.64 117.16 111.86 1h5l n TYR 7 Ca 0.34 -0.69 0.19 0.00 -0.16 0.00 0.00 57.90 57.58 1h5l n TYR 7 Cb 1.10 -0.22 0.91 0.00 -0.31 0.00 0.00 39.34 40.83 1h5l n TYR 7 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 1h5l h ASP 8 N 2.57 0.00 0.00 7.72 3.32 -1.40 -0.16 116.42 128.48 1h5l h ASP 8 Ca 0.00 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 56.84 1h5l h ASP 8 Cb 1.26 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.77 1h5l h ASP 8 CO 0.17 0.00 -1.78 0.59 -1.72 0.00 0.00 179.24 176.50 1h5l n ASN 9 N -2.91 2.58 0.11 6.45 3.02 -1.26 -4.29 115.26 118.96 1h5l n ASN 9 Ca -0.01 -0.03 -0.01 0.00 -0.03 0.00 0.00 54.58 54.50 1h5l n ASN 9 Cb 0.15 -0.26 0.01 0.00 -0.61 0.00 0.00 39.78 39.07 1h5l n ASN 9 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1h5l h SER 10 N -0.10 0.00 0.00 6.41 4.64 -1.83 -3.41 113.55 119.26 1h5l h SER 10 Ca -0.32 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 60.79 1h5l h SER 10 Cb 1.44 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.39 1h5l h SER 10 CO -0.08 0.71 -0.44 0.00 -0.87 0.00 0.00 176.83 176.15 1h5l h PRO 12 N 3.57 0.00 -0.24 0.00 0.13 -1.55 -2.24 132.00 131.67 1h5l h PRO 12 Ca -0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.99 1h5l h PRO 12 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1h5l h PRO 12 CO 0.23 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.09 1h5l n ASN 13 N -3.63 2.14 -0.09 1.44 5.03 -1.26 -4.49 115.26 114.40 1h5l n ASN 13 Ca -0.00 -1.81 -0.06 0.00 0.87 0.00 0.00 54.58 53.58 1h5l n ASN 13 Cb 0.25 -0.16 0.01 0.00 -1.02 0.00 0.00 39.78 38.86 1h5l n ASN 13 CO 0.00 0.00 0.00 1.62 -1.83 0.00 0.00 177.26 177.05 1h5l h VAL 14 N 2.77 0.82 -0.92 2.41 3.04 -1.76 -1.39 116.25 121.21 1h5l h VAL 14 Ca 0.00 -0.05 0.01 0.00 -1.01 0.00 0.00 66.70 65.65 1h5l h VAL 14 Cb 0.61 0.65 -0.05 0.00 -2.01 0.00 0.00 31.29 30.50 1h5l h VAL 14 CO 0.00 0.03 0.61 -1.28 -1.01 0.00 0.00 177.57 175.92 1h5l h SER 15 N 0.15 1.05 -0.27 3.17 0.87 -1.84 -1.37 113.55 115.31 1h5l h SER 15 Ca 0.15 -0.03 -0.11 0.00 -1.23 0.00 0.00 61.79 60.58 1h5l h SER 15 Cb 0.18 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 61.87 1h5l h SER 15 CO -0.22 0.76 -0.22 0.78 -0.53 0.00 0.00 176.83 177.41 1h5l h ASN 16 N 1.24 0.76 -0.51 6.23 2.35 -1.76 -1.13 115.58 122.76 1h5l h ASN 16 Ca 0.34 -0.27 -0.10 0.00 -0.55 0.00 0.00 56.30 55.72 1h5l h ASN 16 Cb -0.14 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.01 1h5l h ASN 16 CO -0.08 0.96 -0.08 0.40 -1.65 0.00 0.00 177.43 176.98 1h5l h ILE 17 N 0.65 1.27 -0.32 2.81 2.04 -0.83 -0.83 117.51 122.30 1h5l h ILE 17 Ca 0.09 -1.21 -0.02 0.00 1.00 0.00 0.00 64.86 64.72 1h5l h ILE 17 Cb 0.72 1.01 -0.01 0.00 -0.74 0.00 0.00 36.82 37.80 1h5l h ILE 17 CO 0.06 0.42 0.11 0.58 0.00 0.00 0.00 178.15 179.32 1h5l h VAL 18 N 0.81 1.20 -0.15 1.67 2.07 -1.11 -2.24 116.25 118.50 1h5l h VAL 18 Ca 0.13 -0.62 0.01 0.00 0.82 0.00 0.00 66.70 67.04 1h5l h VAL 18 Cb 0.63 1.01 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 1h5l h VAL 18 CO 0.04 0.21 0.06 -0.09 0.02 0.00 0.00 177.57 177.82 1h5l h ARG 19 N 0.36 0.14 -0.95 1.57 2.43 -1.06 -2.32 114.38 114.55 1h5l h ARG 19 Ca 0.10 -0.01 0.08 0.00 -0.81 0.00 0.00 59.98 59.35 1h5l h ARG 19 Cb 0.22 -0.03 -0.07 0.00 -0.42 0.00 0.00 29.97 29.68 1h5l h ARG 19 CO -0.01 0.09 0.61 -0.44 -1.51 0.00 0.00 179.97 178.72 1h5l h ASP 20 N 0.14 0.93 -0.35 -3.80 3.32 -1.03 0.02 116.42 115.65 1h5l h ASP 20 Ca 0.06 0.02 -0.03 0.00 0.02 0.00 0.00 57.03 57.10 1h5l h ASP 20 Cb 0.03 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 1h5l h ASP 20 CO -0.06 0.57 0.10 0.74 -1.72 0.00 0.00 179.24 178.87 1h5l h THR 21 N 1.04 1.21 -0.51 0.35 2.02 -1.04 -1.86 112.91 114.14 1h5l h THR 21 Ca 0.43 -0.71 -0.12 0.00 0.77 0.00 0.00 66.41 66.78 1h5l h THR 21 Cb 0.29 1.02 -0.02 0.00 -1.74 0.00 0.00 68.15 67.70 1h5l h THR 21 CO -0.18 0.24 -0.15 0.40 0.37 0.00 0.00 175.52 176.20 1h5l h ILE 22 N 0.41 1.27 -0.35 3.11 2.04 -0.86 -1.52 117.51 121.61 1h5l h ILE 22 Ca 0.11 -1.31 0.02 0.00 1.00 0.00 0.00 64.86 64.69 1h5l h ILE 22 Cb 0.27 1.06 -0.03 0.00 -0.74 0.00 0.00 36.82 37.38 1h5l h ILE 22 CO -0.00 0.46 0.19 0.58 0.00 0.00 0.00 178.15 179.37 1h5l h VAL 23 N 0.86 1.01 -0.58 1.67 2.07 -0.92 0.14 116.25 120.50 1h5l h VAL 23 Ca 0.12 -0.13 -0.00 0.00 0.82 0.00 0.00 66.70 67.51 1h5l h VAL 23 Cb 0.72 0.59 -0.03 0.00 -1.52 0.00 0.00 31.29 31.05 1h5l h VAL 23 CO 0.06 0.07 0.35 -1.13 0.02 0.00 0.00 177.57 176.94 1h5l h ASN 24 N 0.39 0.69 0.12 0.57 -1.24 -1.20 -2.94 115.58 111.97 1h5l h ASN 24 Ca 0.14 -0.05 -0.13 0.00 0.71 0.00 0.00 56.30 56.97 1h5l h ASN 24 Cb 0.03 -0.17 -0.01 0.00 0.73 0.00 0.00 38.32 38.89 1h5l h ASN 24 CO -0.08 0.54 -0.45 -0.08 -1.29 0.00 0.00 177.43 176.07 1h5l h GLU 25 N 0.78 0.40 -0.09 6.67 4.57 -0.91 -3.10 114.58 122.90 1h5l h GLU 25 Ca 0.21 -0.21 0.03 0.00 -1.18 0.00 0.00 59.36 58.20 1h5l h GLU 25 Cb -0.03 0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 28.57 1h5l h GLU 25 CO -0.04 0.78 0.10 -0.07 -1.18 0.00 0.00 179.01 178.60 1h5l h LEU 26 N 0.33 0.00 -0.58 1.64 3.38 -0.79 0.75 115.31 120.04 1h5l h LEU 26 Ca 0.02 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.92 1h5l h LEU 26 Cb 0.92 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.65 1h5l h LEU 26 CO 0.08 0.00 0.09 0.03 0.09 0.00 0.00 178.44 178.73 1h5l h ARG 27 N 0.00 0.96 0.00 1.13 3.08 -1.57 -3.07 114.38 114.91 1h5l h ARG 27 Ca 0.04 -0.26 -0.10 0.00 0.07 0.00 0.00 59.98 59.73 1h5l h ARG 27 Cb 0.24 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.16 1h5l h ARG 27 CO -0.00 0.92 -1.62 -1.13 -1.07 0.00 0.00 179.97 177.07 1h5l n SER 28 N -4.32 0.48 -3.53 7.04 3.41 -0.85 -4.74 113.62 111.11 1h5l n SER 28 Ca 0.03 0.20 -0.29 0.00 -0.26 0.00 0.00 58.87 58.54 1h5l n SER 28 Cb 0.27 0.91 -0.13 0.00 -0.26 0.00 0.00 64.21 65.01 1h5l n SER 28 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1h5l s ASP 29 N -5.24 3.22 0.00 4.04 2.15 0.20 -4.99 116.67 116.05 1h5l s ASP 29 Ca -0.05 -2.11 0.08 0.00 0.43 0.00 0.00 52.55 50.90 1h5l s ASP 29 Cb 0.10 -0.53 0.39 0.00 -0.30 0.00 0.00 42.92 42.58 1h5l s ASP 29 CO 0.84 -0.33 1.22 -0.81 -0.17 0.00 0.00 175.17 175.92 1h5l n PRO 30 N 4.16 0.05 0.01 4.34 -0.04 -1.16 -2.33 135.00 140.03 1h5l n PRO 30 Ca 0.08 0.30 0.11 0.00 -0.04 0.00 0.00 63.50 63.95 1h5l n PRO 30 Cb 0.37 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.36 1h5l n PRO 30 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 1h5l n ARG 31 N -1.41 0.19 -0.11 0.54 0.63 -1.26 -4.51 116.66 110.72 1h5l n ARG 31 Ca 0.03 -0.01 0.12 0.00 -0.92 0.00 0.00 57.85 57.07 1h5l n ARG 31 Cb 0.09 -1.55 0.49 0.00 0.45 0.00 0.00 32.46 31.93 1h5l n ARG 31 CO 0.00 0.00 0.00 0.97 -2.51 0.00 0.00 177.63 176.09 1h5l h ILE 32 N 0.00 0.88 -0.40 5.15 6.09 -1.83 -1.64 117.51 125.76 1h5l h ILE 32 Ca 0.00 -0.15 -0.04 0.00 -1.37 0.00 0.00 64.86 63.30 1h5l h ILE 32 Cb 0.65 0.40 -0.02 0.00 0.47 0.00 0.00 36.82 38.32 1h5l h ILE 32 CO 0.00 0.08 0.10 0.00 -3.07 0.00 0.00 178.15 175.26 1h5l h ALA 33 N 1.67 0.53 -0.32 0.18 0.00 -1.83 -0.37 119.26 119.13 1h5l h ALA 33 Ca 0.31 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1h5l h ALA 33 Cb 0.61 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1h5l h ALA 33 CO -0.09 0.21 0.13 0.00 0.00 0.00 0.00 179.25 179.49 1h5l h ALA 34 N 0.95 0.42 -0.82 0.00 0.00 -1.71 -2.29 119.26 115.81 1h5l h ALA 34 Ca 0.13 -0.13 0.05 0.00 0.00 0.00 0.00 54.91 54.96 1h5l h ALA 34 Cb 0.31 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 17.92 1h5l h ALA 34 CO 0.00 0.02 0.51 0.77 0.00 0.00 0.00 179.25 180.55 1h5l h SER 35 N 0.37 0.82 -0.49 0.00 0.02 -1.05 -1.99 113.55 111.22 1h5l h SER 35 Ca 0.11 0.01 -0.12 0.00 -0.84 0.00 0.00 61.79 60.94 1h5l h SER 35 Cb 0.19 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.55 1h5l h SER 35 CO -0.01 0.54 -0.18 0.40 -1.14 0.00 0.00 176.83 176.45 1h5l h ILE 36 N 0.96 1.27 -0.84 3.27 2.04 -0.89 -1.81 117.51 121.51 1h5l h ILE 36 Ca 0.35 -1.33 -0.02 0.00 1.00 0.00 0.00 64.86 64.85 1h5l h ILE 36 Cb 0.11 1.10 -0.04 0.00 -0.74 0.00 0.00 36.82 37.25 1h5l h ILE 36 CO -0.15 0.46 0.45 0.25 0.00 0.00 0.00 178.15 179.16 1h5l h LEU 37 N 0.84 1.05 -1.01 1.44 5.85 -1.09 -2.10 115.31 120.29 1h5l h LEU 37 Ca 0.12 -0.10 -0.07 0.00 0.84 0.00 0.00 57.88 58.66 1h5l h LEU 37 Cb 0.75 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.49 1h5l h LEU 37 CO 0.06 0.86 -0.05 -0.09 -0.34 0.00 0.00 178.44 178.88 1h5l h ARG 38 N 1.17 0.66 -0.82 1.25 2.43 -1.14 -2.25 114.38 115.67 1h5l h ARG 38 Ca 0.29 -0.18 -0.01 0.00 -0.81 0.00 0.00 59.98 59.27 1h5l h ARG 38 Cb 0.04 -0.08 -0.04 0.00 -0.42 0.00 0.00 29.97 29.48 1h5l h ARG 38 CO -0.05 0.71 0.46 -0.07 -1.51 0.00 0.00 179.97 179.51 1h5l h LEU 39 N 0.61 1.02 -0.71 3.80 3.38 -0.67 -0.37 115.31 122.39 1h5l h LEU 39 Ca 0.12 -0.09 -0.06 0.00 0.09 0.00 0.00 57.88 57.93 1h5l h LEU 39 Cb 0.46 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 1h5l h LEU 39 CO 0.02 0.82 0.20 -0.74 0.09 0.00 0.00 178.44 178.83 1h5l h HIS 40 N 1.15 1.16 0.24 1.13 2.76 -1.08 -0.42 115.15 120.08 1h5l h HIS 40 Ca 0.29 -0.13 -0.01 0.00 -2.20 0.00 0.00 60.37 58.32 1h5l h HIS 40 Cb 0.02 -0.33 0.00 0.00 1.55 0.00 0.00 27.41 28.65 1h5l h HIS 40 CO 0.00 0.93 -0.11 0.35 -1.30 0.00 0.00 177.93 177.80 1h5l h PHE 41 N 1.05 -0.29 0.00 5.26 3.57 -0.88 -0.79 116.94 124.85 1h5l h PHE 41 Ca 0.22 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.72 1h5l h PHE 41 Cb 0.33 0.10 0.00 0.00 2.79 0.00 0.00 35.95 39.17 1h5l h PHE 41 CO 0.03 -0.15 0.00 0.45 -2.23 0.00 0.00 178.31 176.41 1h5l h HIS 42 N -0.36 0.00 0.03 0.41 3.86 -0.92 -1.88 115.15 116.28 1h5l h HIS 42 Ca -0.03 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.18 1h5l h HIS 42 Cb 0.28 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.75 1h5l h HIS 42 CO -0.05 0.00 -0.01 0.22 0.86 0.00 0.00 177.93 178.95 1h5l h ASP 43 N 0.00 -0.03 -0.18 2.45 3.58 -0.49 -3.35 116.42 118.40 1h5l h ASP 43 Ca 0.00 -0.68 -0.00 0.00 0.42 0.00 0.00 57.03 56.77 1h5l h ASP 43 Cb 0.32 0.01 -0.01 0.00 1.72 0.00 0.00 39.33 41.37 1h5l h ASP 43 CO 0.00 0.77 0.11 0.00 -2.88 0.00 0.00 179.24 177.24 1h5l n PHE 45 N -4.49 0.00 -3.76 0.00 3.01 -0.73 -2.86 117.46 108.63 1h5l n PHE 45 Ca -0.00 0.00 -0.30 0.00 1.01 0.00 0.00 57.45 58.16 1h5l n PHE 45 Cb 0.09 -0.01 -0.15 0.00 -0.01 0.00 0.00 39.48 39.40 1h5l n PHE 45 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1h5l s VAL 46 N -2.02 1.00 -1.28 -4.37 1.01 -0.88 -4.69 120.40 109.16 1h5l s VAL 46 Ca 0.45 -1.46 0.00 0.00 0.00 0.00 0.00 61.98 60.97 1h5l s VAL 46 Cb 0.21 -1.75 0.00 0.00 0.00 0.00 0.00 36.38 34.84 1h5l s VAL 46 CO 0.36 -0.65 0.00 -3.20 0.00 0.00 0.00 175.10 171.60 1h5l n ASN 47 N 4.80 -4.95 0.00 3.32 5.15 -1.26 -4.76 115.26 117.55 1h5l n ASN 47 Ca -0.02 0.30 0.00 0.00 -0.60 0.00 0.00 54.58 54.26 1h5l n ASN 47 Cb 0.42 -3.52 0.00 0.00 -0.53 0.00 0.00 39.78 36.15 1h5l n ASN 47 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1h5l n GLY 48 N -0.83 -0.63 3.57 8.20 0.00 -1.13 -4.64 105.19 109.71 1h5l n GLY 48 Ca -0.12 -1.73 -0.41 0.00 0.00 0.00 0.00 46.02 43.76 1h5l n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1h5l n ASP 50 N 8.96 1.37 -1.75 0.00 5.75 -1.26 -4.73 116.55 124.89 1h5l n ASP 50 Ca 0.38 -2.35 -0.21 0.00 -0.01 0.00 0.00 54.79 52.60 1h5l n ASP 50 Cb 0.49 -0.24 -0.07 0.00 -1.03 0.00 0.00 41.12 40.27 1h5l n ASP 50 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1h5l n ALA 51 N -0.71 -0.37 0.08 2.12 0.00 -1.26 -0.99 120.51 119.37 1h5l n ALA 51 Ca 0.07 0.31 0.01 0.00 0.00 0.00 0.00 53.44 53.83 1h5l n ALA 51 Cb 0.57 -2.09 0.35 0.00 0.00 0.00 0.00 19.45 18.28 1h5l n ALA 51 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1h5l h SER 52 N 0.00 0.32 0.50 0.00 4.64 -1.86 -2.45 113.55 114.70 1h5l h SER 52 Ca -0.44 -0.07 -0.01 0.00 -0.47 0.00 0.00 61.79 60.80 1h5l h SER 52 Cb 1.36 -0.08 -0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1h5l h SER 52 CO 0.62 0.45 -0.07 -0.29 -0.87 0.00 0.00 176.83 176.68 1h5l h ILE 53 N 0.33 0.29 0.00 0.95 2.10 -1.89 -2.69 117.51 116.60 1h5l h ILE 53 Ca 0.07 -0.45 0.00 0.00 1.08 0.00 0.00 64.86 65.56 1h5l h ILE 53 Cb 0.37 1.34 0.00 0.00 -1.09 0.00 0.00 36.82 37.44 1h5l h ILE 53 CO 0.02 0.07 0.00 -0.07 -1.08 0.00 0.00 178.15 177.09 1h5l h LEU 54 N 0.00 0.00 -9.80 2.19 3.38 -1.71 -3.42 115.31 105.95 1h5l h LEU 54 Ca -0.00 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.45 1h5l h LEU 54 Cb 0.34 0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.12 1h5l h LEU 54 CO 0.01 0.00 0.57 -0.76 0.09 0.00 0.00 178.44 178.35 1h5l s LEU 55 N -4.94 4.47 0.64 1.67 1.43 -1.01 -4.01 118.68 116.93 1h5l s LEU 55 Ca 0.09 2.45 -0.00 0.00 -1.03 0.00 0.00 54.13 55.64 1h5l s LEU 55 Cb 0.10 -3.63 0.08 0.00 0.03 0.00 0.00 46.19 42.77 1h5l s LEU 55 CO 0.61 -0.37 0.89 -1.81 0.23 0.00 0.00 176.35 175.89 1h5l s ASP 56 N -0.45 4.84 0.59 2.29 1.01 -0.33 -4.47 116.67 120.15 1h5l s ASP 56 Ca 0.49 -0.11 -0.19 0.00 0.71 0.00 0.00 52.55 53.44 1h5l s ASP 56 Cb -0.36 -0.54 -0.04 0.00 1.01 0.00 0.00 42.92 42.99 1h5l s ASP 56 CO 0.45 -1.49 1.11 0.59 0.21 0.00 0.00 175.17 176.04 1h5l n ASN 57 N -2.61 1.43 -4.09 0.27 3.02 -1.26 -4.65 115.26 107.37 1h5l n ASN 57 Ca 0.11 0.86 -0.10 0.00 -0.03 0.00 0.00 54.58 55.42 1h5l n ASN 57 Cb 0.60 -1.46 -0.09 0.00 -0.61 0.00 0.00 39.78 38.23 1h5l n ASN 57 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1h5l s THR 58 N -1.43 0.07 -0.89 3.41 -4.23 -0.94 -4.99 115.64 106.65 1h5l s THR 58 Ca 0.76 -1.73 0.20 0.00 -1.18 0.00 0.00 61.69 59.73 1h5l s THR 58 Cb -0.42 -2.04 0.18 0.00 1.34 0.00 0.00 72.50 71.56 1h5l s THR 58 CO 0.47 -0.33 1.63 0.35 -0.54 0.00 0.00 174.62 176.19 1h5l n THR 59 N -0.17 0.74 -0.08 3.99 -2.24 -1.26 -3.25 114.28 112.00 1h5l n THR 59 Ca -0.05 0.16 -0.08 0.00 -2.27 0.00 0.00 64.05 61.81 1h5l n THR 59 Cb 0.64 -0.90 -0.16 0.00 -2.10 0.00 0.00 70.33 67.81 1h5l n THR 59 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1h5l n SER 60 N -1.69 0.11 -3.84 3.42 3.41 -1.26 -4.99 113.62 108.78 1h5l n SER 60 Ca 0.04 0.05 -0.12 0.00 -0.26 0.00 0.00 58.87 58.58 1h5l n SER 60 Cb 0.23 0.96 -0.11 0.00 -0.26 0.00 0.00 64.21 65.03 1h5l n SER 60 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1h5l s PHE 61 N -2.60 -0.08 0.45 7.33 -0.12 -1.20 -5.14 117.98 116.62 1h5l s PHE 61 Ca -0.09 0.19 -0.14 0.00 -0.05 0.00 0.00 56.93 56.83 1h5l s PHE 61 Cb 0.07 0.01 -0.07 0.00 -0.63 0.00 0.00 43.02 42.40 1h5l s PHE 61 CO 0.84 -0.18 0.88 1.03 -0.05 0.00 0.00 175.22 177.73 1h5l s ARG 62 N -0.59 3.89 0.33 1.99 1.81 -1.26 -2.21 118.95 122.90 1h5l s ARG 62 Ca -0.07 0.74 -0.25 0.00 -1.72 0.00 0.00 55.73 54.43 1h5l s ARG 62 Cb -0.04 -2.27 -0.10 0.00 -0.45 0.00 0.00 34.95 32.09 1h5l s ARG 62 CO 0.01 -0.13 0.92 -0.08 -0.68 0.00 0.00 175.30 175.34 1h5l s THR 63 N -2.46 4.28 -0.83 0.02 -1.32 -1.26 -4.17 115.64 109.90 1h5l s THR 63 Ca 0.55 1.71 0.18 0.00 -1.21 0.00 0.00 61.69 62.92 1h5l s THR 63 Cb -0.10 -3.93 0.16 0.00 -1.51 0.00 0.00 72.50 67.12 1h5l s THR 63 CO 0.30 0.08 1.55 -0.62 -2.21 0.00 0.00 174.62 173.72 1h5l n GLU 64 N 0.39 0.07 0.22 7.08 1.02 -1.26 -2.41 120.64 125.74 1h5l n GLU 64 Ca 0.02 0.30 0.15 0.00 -0.02 0.00 0.00 57.16 57.62 1h5l n GLU 64 Cb 0.51 -1.62 0.71 0.00 -0.02 0.00 0.00 31.44 31.01 1h5l n GLU 64 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 1h5l h LYS 65 N 0.00 0.00 -0.66 3.49 1.57 -1.85 -1.45 116.57 117.67 1h5l h LYS 65 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1h5l h LYS 65 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.60 1h5l h LYS 65 CO 0.00 0.00 0.00 -0.25 -0.57 0.00 0.00 179.45 178.63 1h5l n ASP 66 N -2.64 4.58 -4.80 0.86 8.00 -1.01 -2.53 116.55 119.00 1h5l n ASP 66 Ca -0.00 -2.41 -0.33 0.00 0.71 0.00 0.00 54.79 52.77 1h5l n ASP 66 Cb 0.18 -0.57 0.01 0.00 -0.02 0.00 0.00 41.12 40.72 1h5l n ASP 66 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1h5l s ALA 67 N -1.80 2.74 0.54 2.24 0.00 -0.55 -4.70 121.76 120.24 1h5l s ALA 67 Ca 0.49 0.41 0.20 0.00 0.00 0.00 0.00 51.96 53.07 1h5l s ALA 67 Cb 0.31 -3.24 1.44 0.00 0.00 0.00 0.00 23.12 21.64 1h5l s ALA 67 CO 0.24 -0.80 2.18 0.74 0.00 0.00 0.00 175.76 178.13 1h5l h PHE 68 N 0.49 0.00 -0.00 0.00 0.04 -1.91 0.28 116.94 115.84 1h5l h PHE 68 Ca -0.47 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.30 1h5l h PHE 68 Cb 1.22 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.37 1h5l h PHE 68 CO 0.58 0.00 -0.32 0.41 -0.60 0.00 0.00 178.31 178.38 1h5l n GLY 69 N -1.48 -1.32 0.04 -1.45 0.00 -1.26 -4.33 105.19 95.40 1h5l n GLY 69 Ca -0.03 -0.27 -0.06 0.00 0.00 0.00 0.00 46.02 45.67 1h5l n GLY 69 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1h5l n ASN 70 N -1.48 3.31 -4.65 1.61 3.02 -0.40 -4.55 115.26 112.13 1h5l n ASN 70 Ca 0.06 -0.04 -0.48 0.00 -0.03 0.00 0.00 54.58 54.09 1h5l n ASN 70 Cb 0.34 -0.01 -0.05 0.00 -0.61 0.00 0.00 39.78 39.45 1h5l n ASN 70 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1h5l n ALA 71 N -2.68 0.72 -3.39 5.41 0.00 0.84 -0.57 120.51 120.84 1h5l n ALA 71 Ca -0.15 0.44 -0.24 0.00 0.00 0.00 0.00 53.44 53.49 1h5l n ALA 71 Cb 0.68 -2.30 0.01 0.00 0.00 0.00 0.00 19.45 17.83 1h5l n ALA 71 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1h5l n ASN 72 N 3.70 -4.46 0.16 0.00 5.15 -1.26 -4.69 115.26 113.86 1h5l n ASN 72 Ca 0.18 -0.44 0.00 0.00 -0.60 0.00 0.00 54.58 53.72 1h5l n ASN 72 Cb 0.26 -3.64 0.00 0.00 -0.53 0.00 0.00 39.78 35.87 1h5l n ASN 72 CO 0.00 0.00 0.00 -0.24 1.40 0.00 0.00 177.26 178.42 1h5l n SER 73 N -2.44 -1.61 -4.77 1.20 2.88 -0.46 -5.10 113.62 103.32 1h5l n SER 73 Ca -0.03 0.59 -0.40 0.00 -1.33 0.00 0.00 58.87 57.70 1h5l n SER 73 Cb 0.56 1.64 0.00 0.00 -0.75 0.00 0.00 64.21 65.66 1h5l n SER 73 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1h5l s ALA 74 N -1.95 3.43 0.26 -1.46 0.00 0.26 -5.00 121.76 117.30 1h5l s ALA 74 Ca 0.00 1.49 -0.13 0.00 0.00 0.00 0.00 51.96 53.32 1h5l s ALA 74 Cb 0.00 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.54 1h5l s ALA 74 CO 0.00 -1.06 0.51 -0.98 0.00 0.00 0.00 175.76 174.23 1h5l s ARG 75 N -2.21 1.62 0.00 0.00 1.70 -1.26 -4.95 118.95 113.84 1h5l s ARG 75 Ca 0.56 -1.26 0.00 0.00 -0.47 0.00 0.00 55.73 54.55 1h5l s ARG 75 Cb -0.44 0.49 0.00 0.00 -0.57 0.00 0.00 34.95 34.42 1h5l s ARG 75 CO 0.59 -0.68 0.00 0.41 -1.08 0.00 0.00 175.30 174.54 1h5l n GLY 76 N -0.41 0.63 0.34 3.88 0.00 -1.26 -4.59 105.19 103.80 1h5l n GLY 76 Ca -0.02 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.06 1h5l n GLY 76 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1h5l h PHE 77 N 0.00 1.04 -0.35 1.61 0.04 -1.98 -1.34 116.94 115.96 1h5l h PHE 77 Ca 0.00 0.03 -0.05 0.00 2.80 0.00 0.00 57.97 60.75 1h5l h PHE 77 Cb 0.00 -0.32 -0.02 0.00 2.20 0.00 0.00 35.95 37.81 1h5l h PHE 77 CO 0.00 0.40 -0.01 -1.35 -0.60 0.00 0.00 178.31 176.75 1h5l h PRO 78 N 0.91 0.56 -0.63 1.51 0.11 -1.99 -1.88 132.00 130.58 1h5l h PRO 78 Ca 0.47 -0.13 -0.06 0.00 0.11 0.00 0.00 66.00 66.40 1h5l h PRO 78 Cb 0.49 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 31.50 1h5l h PRO 78 CO -0.27 0.59 0.14 0.28 -0.21 0.00 0.00 178.00 178.52 1h5l h VAL 79 N 0.53 1.25 -0.61 3.15 2.07 -1.68 -0.63 116.25 120.32 1h5l h VAL 79 Ca 0.11 -0.92 -0.10 0.00 0.82 0.00 0.00 66.70 66.61 1h5l h VAL 79 Cb 0.36 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 30.72 1h5l h VAL 79 CO 0.01 0.35 0.00 0.40 0.02 0.00 0.00 177.57 178.35 1h5l h ILE 80 N 0.94 1.27 -0.97 4.57 1.08 -1.00 -1.95 117.51 121.45 1h5l h ILE 80 Ca 0.20 -1.16 0.01 0.00 -0.39 0.00 0.00 64.86 63.52 1h5l h ILE 80 Cb 0.35 0.79 -0.05 0.00 -3.07 0.00 0.00 36.82 34.85 1h5l h ILE 80 CO 0.00 0.42 0.64 0.44 -0.69 0.00 0.00 178.15 178.97 1h5l h ASP 81 N 0.98 1.11 0.21 1.72 3.32 -0.71 -0.22 116.42 122.84 1h5l h ASP 81 Ca 0.17 -0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.19 1h5l h ASP 81 Cb 0.56 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.84 1h5l h ASP 81 CO 0.03 0.80 -0.10 -0.09 -1.72 0.00 0.00 179.24 178.16 1h5l h ARG 82 N 1.31 -0.28 -0.38 3.56 2.43 -0.70 -1.44 114.38 118.88 1h5l h ARG 82 Ca 0.36 0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 59.49 1h5l h ARG 82 Cb -0.15 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.45 1h5l h ARG 82 CO -0.08 -0.08 -0.01 0.00 -1.51 0.00 0.00 179.97 178.29 1h5l h MET 83 N -0.43 0.60 -0.44 0.20 -0.00 -1.16 -1.83 114.93 111.88 1h5l h MET 83 Ca -0.03 -0.14 -0.01 0.00 -0.00 0.00 0.00 59.70 59.52 1h5l h MET 83 Cb 0.33 -0.08 -0.02 0.00 -0.00 0.00 0.00 31.60 31.83 1h5l h MET 83 CO 0.05 0.63 0.25 -0.22 -0.00 0.00 0.00 176.91 177.63 1h5l h LYS 84 N 0.57 0.60 -0.81 -0.10 1.63 -0.88 0.47 116.57 118.06 1h5l h LYS 84 Ca 0.12 -0.06 -0.02 0.00 -0.85 0.00 0.00 60.65 59.84 1h5l h LYS 84 Cb 0.38 -0.12 -0.04 0.00 -0.60 0.00 0.00 32.23 31.85 1h5l h LYS 84 CO 0.01 0.46 0.44 0.00 -3.45 0.00 0.00 179.45 176.91 1h5l h ALA 85 N 1.11 1.04 -0.57 5.00 0.00 -0.92 0.14 119.26 125.06 1h5l h ALA 85 Ca 0.16 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 1h5l h ALA 85 Cb 0.02 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 1h5l h ALA 85 CO -0.03 0.57 -0.01 0.00 0.00 0.00 0.00 179.25 179.78 1h5l h ALA 86 N 1.23 0.91 -0.16 0.00 0.00 -0.89 -1.61 119.26 118.73 1h5l h ALA 86 Ca 0.29 -0.30 -0.17 0.00 0.00 0.00 0.00 54.91 54.72 1h5l h ALA 86 Cb 0.05 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 1h5l h ALA 86 CO -0.04 0.65 -0.62 0.28 0.00 0.00 0.00 179.25 179.51 1h5l h VAL 87 N 0.91 1.33 -0.19 0.00 2.07 -0.50 -2.48 116.25 117.39 1h5l h VAL 87 Ca 0.16 -1.89 -0.05 0.00 0.82 0.00 0.00 66.70 65.74 1h5l h VAL 87 Cb 0.54 1.87 -0.01 0.00 -1.52 0.00 0.00 31.29 32.16 1h5l h VAL 87 CO 0.03 0.59 -0.12 -0.33 0.02 0.00 0.00 177.57 177.75 1h5l h GLU 88 N 0.42 0.30 -0.23 1.57 4.39 -0.51 0.47 114.58 120.98 1h5l h GLU 88 Ca -0.01 -0.07 -0.09 0.00 0.34 0.00 0.00 59.36 59.53 1h5l h GLU 88 Cb 1.18 -0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 29.79 1h5l h GLU 88 CO 0.12 0.43 -0.22 1.03 -1.16 0.00 0.00 179.01 179.21 1h5l h SER 89 N 0.28 0.59 0.13 1.42 0.87 -1.11 -1.77 113.55 113.97 1h5l h SER 89 Ca 0.06 -0.47 -0.22 0.00 -1.23 0.00 0.00 61.79 59.93 1h5l h SER 89 Cb 0.39 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 62.19 1h5l h SER 89 CO 0.02 0.94 -0.83 0.00 -0.53 0.00 0.00 176.83 176.43 1h5l h ALA 90 N 0.67 0.40 -2.26 6.23 0.00 -1.09 -3.40 119.26 119.82 1h5l h ALA 90 Ca 0.04 -0.64 -0.54 0.00 0.00 0.00 0.00 54.91 53.77 1h5l h ALA 90 Cb 0.77 -0.02 -0.36 0.00 0.00 0.00 0.00 17.79 18.18 1h5l h ALA 90 CO 0.05 0.74 -0.90 0.00 0.00 0.00 0.00 179.25 179.15 1h5l n PRO 92 N 3.15 1.48 -4.29 0.00 -0.02 -0.66 -2.97 135.00 131.69 1h5l n PRO 92 Ca 0.25 0.53 -0.36 0.00 -2.02 0.00 0.00 63.50 61.89 1h5l n PRO 92 Cb 0.47 -2.05 -0.05 0.00 -0.02 0.00 0.00 33.50 31.85 1h5l n PRO 92 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1h5l n ARG 93 N 1.62 -2.34 -0.03 -0.52 1.74 -1.26 -4.85 116.66 111.03 1h5l n ARG 93 Ca 0.13 0.29 -0.06 0.00 -0.77 0.00 0.00 57.85 57.44 1h5l n ARG 93 Cb 0.28 -4.79 -0.02 0.00 -1.02 0.00 0.00 32.46 26.91 1h5l n ARG 93 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1h5l n THR 94 N -4.32 0.35 -3.36 0.55 -1.04 -1.16 -5.00 114.28 100.30 1h5l n THR 94 Ca 0.01 -0.06 -0.39 0.00 -2.04 0.00 0.00 64.05 61.57 1h5l n THR 94 Cb 0.52 -1.58 -0.08 0.00 -1.82 0.00 0.00 70.33 67.37 1h5l n THR 94 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1h5l s VAL 95 N -2.11 5.17 0.67 12.58 1.01 -1.26 -5.04 120.40 131.43 1h5l s VAL 95 Ca -0.08 0.73 -0.14 0.00 0.00 0.00 0.00 61.98 62.49 1h5l s VAL 95 Cb 0.03 -3.74 0.01 0.00 0.00 0.00 0.00 36.38 32.67 1h5l s VAL 95 CO 0.10 0.22 1.10 -0.94 0.00 0.00 0.00 175.10 175.57 1h5l s SER 96 N 1.19 5.10 0.31 3.32 1.04 -1.26 -4.81 113.70 118.58 1h5l s SER 96 Ca 0.19 1.92 0.05 0.00 0.48 0.00 0.00 55.95 58.58 1h5l s SER 96 Cb -0.15 -2.54 0.51 0.00 0.10 0.00 0.00 66.02 63.94 1h5l s SER 96 CO 0.08 -1.63 1.77 0.00 0.98 0.00 0.00 173.24 174.44 1h5l h ALA 98 N 1.41 0.58 -0.32 0.00 0.00 -1.86 -0.72 119.26 118.36 1h5l h ALA 98 Ca 0.05 -0.07 -0.17 0.00 0.00 0.00 0.00 54.91 54.72 1h5l h ALA 98 Cb 0.61 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 1h5l h ALA 98 CO 0.04 0.08 -0.49 -0.44 0.00 0.00 0.00 179.25 178.45 1h5l h ASP 99 N 0.60 0.97 -0.55 0.00 3.32 -1.73 -2.63 116.42 116.41 1h5l h ASP 99 Ca 0.16 -0.51 0.05 0.00 0.02 0.00 0.00 57.03 56.75 1h5l h ASP 99 Cb 0.02 -0.28 -0.05 0.00 0.22 0.00 0.00 39.33 39.24 1h5l h ASP 99 CO -0.03 1.30 0.27 0.25 -1.72 0.00 0.00 179.24 179.30 1h5l h LEU 100 N 0.68 0.37 -0.92 1.55 5.85 -0.73 -0.42 115.31 121.69 1h5l h LEU 100 Ca 0.03 0.04 -0.09 0.00 0.84 0.00 0.00 57.88 58.69 1h5l h LEU 100 Cb 1.09 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 42.08 1h5l h LEU 100 CO 0.11 0.25 -0.22 0.25 -0.34 0.00 0.00 178.44 178.49 1h5l h LEU 101 N 0.51 0.54 -0.37 2.25 5.85 -1.12 0.22 115.31 123.19 1h5l h LEU 101 Ca 0.25 -0.18 -0.05 0.00 0.84 0.00 0.00 57.88 58.74 1h5l h LEU 101 Cb 0.18 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 1h5l h LEU 101 CO -0.19 0.76 0.03 0.74 -0.34 0.00 0.00 178.44 179.45 1h5l h THR 102 N 0.48 1.25 -0.47 1.05 2.02 -0.98 -0.70 112.91 115.56 1h5l h THR 102 Ca 0.07 -0.93 -0.06 0.00 0.77 0.00 0.00 66.41 66.27 1h5l h THR 102 Cb 0.65 1.12 -0.02 0.00 -1.74 0.00 0.00 68.15 68.16 1h5l h THR 102 CO 0.05 0.31 0.06 0.40 0.37 0.00 0.00 175.52 176.71 1h5l h ILE 103 N 0.47 1.25 -0.92 3.11 2.04 -0.87 -2.20 117.51 120.39 1h5l h ILE 103 Ca 0.11 -0.94 0.05 0.00 1.00 0.00 0.00 64.86 65.07 1h5l h ILE 103 Cb 0.42 0.94 -0.06 0.00 -0.74 0.00 0.00 36.82 37.38 1h5l h ILE 103 CO 0.01 0.33 0.59 0.00 0.00 0.00 0.00 178.15 179.08 1h5l h ALA 104 N 0.95 1.23 -0.29 1.87 0.00 -0.77 0.14 119.26 122.40 1h5l h ALA 104 Ca 0.14 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1h5l h ALA 104 Cb 0.41 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1h5l h ALA 104 CO 0.01 0.41 0.09 0.00 0.00 0.00 0.00 179.25 179.77 1h5l h ALA 105 N 1.40 0.38 -0.17 0.00 0.00 -0.86 0.15 119.26 120.16 1h5l h ALA 105 Ca 0.38 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 1h5l h ALA 105 Cb 0.07 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1h5l h ALA 105 CO -0.14 0.01 0.06 0.37 0.00 0.00 0.00 179.25 179.55 1h5l h GLN 106 N 0.31 0.26 -0.56 0.00 -0.00 -0.83 -1.67 115.11 112.60 1h5l h GLN 106 Ca 0.09 -0.05 -0.02 0.00 -0.00 0.00 0.00 58.65 58.68 1h5l h GLN 106 Cb 0.24 -0.04 -0.03 0.00 0.00 0.00 0.00 27.48 27.66 1h5l h GLN 106 CO -0.00 0.35 0.28 1.96 0.00 0.00 0.00 178.83 181.41 1h5l h GLN 107 N 0.11 0.79 -0.44 1.69 1.08 -0.68 -1.70 115.11 115.97 1h5l h GLN 107 Ca 0.06 -0.09 -0.02 0.00 -1.45 0.00 0.00 58.65 57.15 1h5l h GLN 107 Cb 0.19 -0.15 -0.02 0.00 -0.05 0.00 0.00 27.48 27.45 1h5l h GLN 107 CO -0.00 0.61 0.21 0.77 -0.95 0.00 0.00 178.83 179.46 1h5l h SER 108 N 0.79 0.57 -0.43 1.46 0.02 -0.63 0.12 113.55 115.46 1h5l h SER 108 Ca 0.20 -0.13 -0.01 0.00 -0.84 0.00 0.00 61.79 61.01 1h5l h SER 108 Cb 0.07 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.45 1h5l h SER 108 CO -0.03 0.54 0.24 0.58 -1.14 0.00 0.00 176.83 177.03 1h5l h VAL 109 N 0.56 1.15 -0.39 2.27 2.07 -0.78 -1.98 116.25 119.16 1h5l h VAL 109 Ca 0.15 -0.37 -0.05 0.00 0.82 0.00 0.00 66.70 67.25 1h5l h VAL 109 Cb 0.12 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 1h5l h VAL 109 CO -0.02 0.16 0.05 0.74 0.02 0.00 0.00 177.57 178.52 1h5l h THR 110 N 0.56 1.24 0.00 2.57 2.02 -1.09 0.24 112.91 118.45 1h5l h THR 110 Ca 0.15 -0.89 -0.00 0.00 0.77 0.00 0.00 66.41 66.44 1h5l h THR 110 Cb 0.04 1.07 -0.00 0.00 -1.74 0.00 0.00 68.15 67.51 1h5l h THR 110 CO -0.03 0.30 -0.02 -0.07 0.37 0.00 0.00 175.52 176.07 1h5l h LEU 111 N 0.49 0.00 -0.55 2.58 3.38 -0.60 -0.17 115.31 120.44 1h5l h LEU 111 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1h5l h LEU 111 Cb 0.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1h5l h LEU 111 CO 0.01 0.02 0.00 0.00 0.09 0.00 0.00 178.44 178.56 1h5l n ALA 112 N -2.52 2.56 0.00 1.53 0.00 -0.76 -4.87 120.51 116.46 1h5l n ALA 112 Ca -0.03 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.09 1h5l n ALA 112 Cb 0.11 -1.19 0.00 0.00 0.00 0.00 0.00 19.45 18.37 1h5l n ALA 112 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1h5l n GLY 113 N 0.96 0.81 0.81 0.00 0.00 -0.08 -0.45 105.19 107.24 1h5l n GLY 113 Ca 0.15 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.11 1h5l n GLY 113 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1h5l n GLY 114 N -1.78 -0.59 3.73 -0.02 0.00 0.81 -4.78 105.19 102.55 1h5l n GLY 114 Ca 0.00 -1.77 -0.31 0.00 0.00 0.00 0.00 46.02 43.94 1h5l n GLY 114 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1h5l s PRO 115 N -3.40 1.72 -0.10 1.61 0.04 -1.26 -4.44 135.00 129.18 1h5l s PRO 115 Ca 0.15 1.37 0.04 0.00 0.04 0.00 0.00 61.00 62.60 1h5l s PRO 115 Cb -0.01 -1.82 0.00 0.00 0.04 0.00 0.00 34.50 32.71 1h5l s PRO 115 CO 0.10 -2.07 -0.24 0.45 0.04 0.00 0.00 177.00 175.28 1h5l s SER 116 N -3.00 3.07 0.20 6.66 0.15 -1.26 -3.94 113.70 115.57 1h5l s SER 116 Ca 0.64 -0.56 -0.21 0.00 0.70 0.00 0.00 55.95 56.52 1h5l s SER 116 Cb -0.20 -1.40 0.05 0.00 -1.71 0.00 0.00 66.02 62.76 1h5l s SER 116 CO 0.56 0.15 0.62 -1.66 1.20 0.00 0.00 173.24 174.11 1h5l s TRP 117 N 0.37 -0.37 -0.31 3.44 -2.14 -1.26 -5.13 118.94 113.53 1h5l s TRP 117 Ca -0.18 0.07 -0.14 0.00 2.66 0.00 0.00 56.10 58.51 1h5l s TRP 117 Cb -0.18 0.57 -0.03 0.00 -3.10 0.00 0.00 33.47 30.74 1h5l s TRP 117 CO 0.08 -0.96 0.33 1.03 -2.66 0.00 0.00 176.95 174.77 1h5l s ARG 118 N -3.82 3.75 0.45 3.25 0.52 -1.26 -4.98 118.95 116.87 1h5l s ARG 118 Ca 0.05 -0.28 -0.21 0.00 -0.52 0.00 0.00 55.73 54.77 1h5l s ARG 118 Cb -0.02 -3.74 -0.09 0.00 0.52 0.00 0.00 34.95 31.62 1h5l s ARG 118 CO -0.06 -0.40 1.02 0.14 0.02 0.00 0.00 175.30 176.03 1h5l s VAL 119 N 1.98 3.88 0.46 3.52 -7.23 -1.26 -4.82 120.40 116.93 1h5l s VAL 119 Ca 0.12 1.25 -0.24 0.00 -1.81 0.00 0.00 61.98 61.29 1h5l s VAL 119 Cb -0.16 -3.55 -0.07 0.00 0.56 0.00 0.00 36.38 33.16 1h5l s VAL 119 CO 0.11 -0.18 1.30 -2.84 -0.31 0.00 0.00 175.10 173.19 1h5l s PRO 120 N -3.00 3.65 0.24 4.82 0.02 -1.26 -4.12 135.00 135.35 1h5l s PRO 120 Ca 0.64 2.13 0.03 0.00 0.02 0.00 0.00 61.00 63.81 1h5l s PRO 120 Cb -0.17 -2.53 -0.05 0.00 0.02 0.00 0.00 34.50 31.78 1h5l s PRO 120 CO 0.21 -0.75 0.04 -0.51 -0.33 0.00 0.00 177.00 175.66 1h5l s LEU 121 N -2.91 2.00 0.00 -5.54 1.43 0.36 -4.78 118.68 109.24 1h5l s LEU 121 Ca 0.63 -1.28 0.00 0.00 -1.03 0.00 0.00 54.13 52.45 1h5l s LEU 121 Cb -0.37 -0.16 0.00 0.00 0.03 0.00 0.00 46.19 45.69 1h5l s LEU 121 CO 0.46 -0.60 0.00 0.61 0.23 0.00 0.00 176.35 177.05 1h5l n GLY 122 N -0.44 0.73 3.79 -3.19 0.00 -1.26 -0.89 105.19 103.93 1h5l n GLY 122 Ca -0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.66 1h5l n GLY 122 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1h5l s ARG 123 N 0.00 3.22 0.32 1.61 0.52 -1.26 -4.47 118.95 118.89 1h5l s ARG 123 Ca 0.00 1.32 0.08 0.00 -0.52 0.00 0.00 55.73 56.61 1h5l s ARG 123 Cb 0.00 -2.01 -0.06 0.00 0.52 0.00 0.00 34.95 33.40 1h5l s ARG 123 CO 0.00 -0.91 -0.07 1.03 0.02 0.00 0.00 175.30 175.37 1h5l s ARG 124 N -3.91 1.72 0.09 3.54 0.52 0.61 -4.51 118.95 117.02 1h5l s ARG 124 Ca 0.66 -1.89 -0.20 0.00 -0.52 0.00 0.00 55.73 53.77 1h5l s ARG 124 Cb -0.18 -1.47 -0.07 0.00 0.52 0.00 0.00 34.95 33.75 1h5l s ARG 124 CO 0.35 0.08 0.61 -0.51 0.02 0.00 0.00 175.30 175.85 1h5l s ASP 125 N -3.55 7.13 0.83 0.23 1.01 0.59 -4.42 116.67 118.49 1h5l s ASP 125 Ca 0.32 1.33 -0.11 0.00 0.71 0.00 0.00 52.55 54.80 1h5l s ASP 125 Cb 0.04 -2.39 0.09 0.00 1.01 0.00 0.00 42.92 41.67 1h5l s ASP 125 CO 0.15 0.26 1.13 -0.94 0.21 0.00 0.00 175.17 175.99 1h5l s SER 126 N -1.11 3.76 0.00 0.27 1.04 -0.16 -1.81 113.70 115.68 1h5l s SER 126 Ca 0.30 2.08 0.21 0.00 0.48 0.00 0.00 55.95 59.02 1h5l s SER 126 Cb -0.20 -2.55 0.44 0.00 0.10 0.00 0.00 66.02 63.80 1h5l s SER 126 CO 0.20 -2.54 1.38 0.18 0.98 0.00 0.00 173.24 173.45 1h5l n LEU 127 N -3.68 3.44 -3.74 2.42 4.77 -1.26 -4.80 117.00 114.16 1h5l n LEU 127 Ca 0.11 -1.61 -0.05 0.00 -0.03 0.00 0.00 56.01 54.43 1h5l n LEU 127 Cb 0.52 -0.28 -0.02 0.00 -2.33 0.00 0.00 43.42 41.32 1h5l n LEU 127 CO 0.50 0.77 0.66 0.00 -1.33 0.00 0.00 177.39 178.00 1h5l s GLN 128 N -1.32 1.26 0.24 3.23 -2.07 -1.26 -4.98 119.66 114.76 1h5l s GLN 128 Ca 0.38 -0.67 0.08 0.00 -1.82 0.00 0.00 55.36 53.33 1h5l s GLN 128 Cb 0.22 0.45 -0.04 0.00 -1.09 0.00 0.00 33.01 32.54 1h5l s GLN 128 CO 0.30 -0.57 0.07 0.00 -1.32 0.00 0.00 175.29 173.76 1h5l s ALA 129 N -3.39 3.33 -0.56 2.60 0.00 -1.26 -4.75 121.76 117.73 1h5l s ALA 129 Ca 0.11 -1.51 0.05 0.00 0.00 0.00 0.00 51.96 50.60 1h5l s ALA 129 Cb -0.02 -1.01 0.17 0.00 0.00 0.00 0.00 23.12 22.26 1h5l s ALA 129 CO 0.01 0.31 0.43 1.19 0.00 0.00 0.00 175.76 177.69 1h5l n PHE 130 N -0.85 1.20 0.01 0.00 3.01 -1.26 -4.82 117.46 114.76 1h5l n PHE 130 Ca -0.07 -3.82 -0.12 0.00 1.01 0.00 0.00 57.45 54.45 1h5l n PHE 130 Cb 0.58 -0.19 -0.07 0.00 -0.01 0.00 0.00 39.48 39.79 1h5l n PHE 130 CO 0.00 0.00 0.00 1.25 1.01 0.00 0.00 176.76 179.02 1h5l h LEU 131 N 5.47 0.07 -0.80 4.37 5.85 -1.83 -0.82 115.31 127.61 1h5l h LEU 131 Ca 0.21 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.82 1h5l h LEU 131 Cb 0.83 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.80 1h5l h LEU 131 CO 0.55 0.15 0.50 0.44 -0.34 0.00 0.00 178.44 179.75 1h5l h ASP 132 N -0.02 0.95 -0.32 1.25 3.32 -1.93 -0.98 116.42 118.68 1h5l h ASP 132 Ca 0.02 -0.05 -0.06 0.00 0.02 0.00 0.00 57.03 56.96 1h5l h ASP 132 Cb 0.10 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.40 1h5l h ASP 132 CO -0.00 0.71 0.01 0.25 -1.72 0.00 0.00 179.24 178.49 1h5l h LEU 133 N 1.09 0.62 -0.43 1.55 5.85 -1.94 -1.75 115.31 120.31 1h5l h LEU 133 Ca 0.29 -0.13 -0.10 0.00 0.84 0.00 0.00 57.88 58.78 1h5l h LEU 133 Cb -0.08 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 40.78 1h5l h LEU 133 CO -0.06 0.69 -0.11 0.00 -0.34 0.00 0.00 178.44 178.62 1h5l h ALA 134 N 1.39 0.60 -0.05 1.25 0.00 -0.36 0.25 119.26 122.33 1h5l h ALA 134 Ca 0.13 -0.33 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 1h5l h ALA 134 Cb 0.38 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1h5l h ALA 134 CO 0.01 0.49 -0.14 -0.91 0.00 0.00 0.00 179.25 178.70 1h5l h ASN 135 N 0.67 0.07 0.19 0.00 2.35 -0.84 -1.84 115.58 116.17 1h5l h ASN 135 Ca 0.11 -0.01 -0.33 0.00 -0.55 0.00 0.00 56.30 55.51 1h5l h ASN 135 Cb 0.64 -0.02 0.01 0.00 0.05 0.00 0.00 38.32 39.01 1h5l h ASN 135 CO 0.04 0.22 -1.63 0.00 -1.65 0.00 0.00 177.43 174.42 1h5l h ALA 136 N 1.79 0.09 0.00 -0.83 0.00 -0.99 -3.40 119.26 115.91 1h5l h ALA 136 Ca 0.01 -1.07 -0.14 0.00 0.00 0.00 0.00 54.91 53.72 1h5l h ALA 136 Cb 0.30 0.40 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 1h5l h ALA 136 CO 0.02 0.91 -1.21 -0.91 0.00 0.00 0.00 179.25 178.06 1h5l h ASN 137 N 0.04 0.00 -3.14 0.00 4.21 -0.42 -3.46 115.58 112.80 1h5l h ASN 137 Ca -0.32 0.00 -0.55 0.00 1.21 0.00 0.00 56.30 56.65 1h5l h ASN 137 Cb 2.05 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 39.24 1h5l h ASN 137 CO 0.18 0.50 0.63 -0.76 -1.29 0.00 0.00 177.43 176.69 1h5l s LEU 138 N -5.85 4.31 0.77 1.61 1.43 -0.70 -4.94 118.68 115.31 1h5l s LEU 138 Ca -0.01 1.86 -0.11 0.00 -1.03 0.00 0.00 54.13 54.84 1h5l s LEU 138 Cb 0.09 -3.57 0.05 0.00 0.03 0.00 0.00 46.19 42.79 1h5l s LEU 138 CO 0.80 -0.52 1.09 -2.16 0.23 0.00 0.00 176.35 175.79 1h5l s PRO 139 N 1.76 2.27 0.16 1.29 0.04 -1.26 -4.97 135.00 134.30 1h5l s PRO 139 Ca 0.56 1.18 0.11 0.00 0.04 0.00 0.00 61.00 62.90 1h5l s PRO 139 Cb -0.26 -1.90 -0.04 0.00 0.04 0.00 0.00 34.50 32.34 1h5l s PRO 139 CO 0.25 -1.63 -0.24 0.00 0.04 0.00 0.00 177.00 175.41 1h5l s ALA 140 N -2.87 2.50 0.64 8.56 0.00 -1.26 -4.99 121.76 124.34 1h5l s ALA 140 Ca 0.61 -1.55 0.43 0.00 0.00 0.00 0.00 51.96 51.45 1h5l s ALA 140 Cb -0.17 -0.38 2.33 0.00 0.00 0.00 0.00 23.12 24.90 1h5l s ALA 140 CO 0.55 0.48 2.35 -1.00 0.00 0.00 0.00 175.76 178.15 1h5l h PRO 141 N 3.48 0.00 -0.32 0.00 0.13 -1.97 -1.68 132.00 131.64 1h5l h PRO 141 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1h5l h PRO 141 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1h5l h PRO 141 CO 0.45 0.00 0.00 1.97 -0.23 0.00 0.00 178.00 180.19 1h5l n PHE 142 N -3.18 0.42 -2.16 1.56 1.16 -1.26 -2.06 117.46 111.93 1h5l n PHE 142 Ca -0.03 -0.21 -0.38 0.00 -1.87 0.00 0.00 57.45 54.96 1h5l n PHE 142 Cb 0.08 0.00 -0.00 0.00 -1.61 0.00 0.00 39.48 37.95 1h5l n PHE 142 CO 0.00 0.00 0.00 -0.06 -1.87 0.00 0.00 176.76 174.83 1h5l s PHE 143 N -1.58 2.81 0.77 2.97 0.40 -0.63 -4.97 117.98 117.75 1h5l s PHE 143 Ca 0.32 1.50 -0.10 0.00 -0.60 0.00 0.00 56.93 58.04 1h5l s PHE 143 Cb 0.17 -3.48 0.08 0.00 0.51 0.00 0.00 43.02 40.30 1h5l s PHE 143 CO 0.24 -1.76 1.12 0.95 0.70 0.00 0.00 175.22 176.47 1h5l s THR 144 N -1.45 2.11 0.20 0.64 -4.23 -1.26 -4.41 115.64 107.24 1h5l s THR 144 Ca 0.63 -0.12 -0.10 0.00 -1.18 0.00 0.00 61.69 60.92 1h5l s THR 144 Cb -0.32 -2.99 0.14 0.00 1.34 0.00 0.00 72.50 70.67 1h5l s THR 144 CO 0.39 0.00 1.85 0.25 -0.54 0.00 0.00 174.62 176.57 1h5l h LEU 145 N -0.90 0.87 -1.16 4.79 5.85 -1.95 0.03 115.31 122.84 1h5l h LEU 145 Ca -0.45 -0.05 0.03 0.00 0.84 0.00 0.00 57.88 58.25 1h5l h LEU 145 Cb 1.32 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 42.08 1h5l h LEU 145 CO 0.62 0.67 0.58 -0.65 -0.34 0.00 0.00 178.44 179.31 1h5l h PRO 146 N 1.00 1.06 -0.25 5.25 0.11 -1.94 0.45 132.00 137.68 1h5l h PRO 146 Ca 0.26 -0.06 -0.13 0.00 0.11 0.00 0.00 66.00 66.18 1h5l h PRO 146 Cb -0.05 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 30.81 1h5l h PRO 146 CO -0.05 0.70 -0.40 1.96 -0.21 0.00 0.00 178.00 180.00 1h5l h GLN 147 N 1.10 0.59 -0.28 1.05 4.20 -1.72 0.31 115.11 120.37 1h5l h GLN 147 Ca 0.35 -0.30 -0.03 0.00 0.06 0.00 0.00 58.65 58.73 1h5l h GLN 147 Cb 0.02 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.79 1h5l h GLN 147 CO -0.10 0.89 0.06 -0.07 -0.67 0.00 0.00 178.83 178.94 1h5l h LEU 148 N 0.49 0.42 -0.66 1.46 3.38 -0.25 -0.46 115.31 119.68 1h5l h LEU 148 Ca 0.04 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 1h5l h LEU 148 Cb 0.91 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.52 1h5l h LEU 148 CO 0.08 0.55 0.39 0.11 0.09 0.00 0.00 178.44 179.66 1h5l h LYS 149 N 0.28 0.91 -0.52 1.13 1.57 -0.77 -2.12 116.57 117.05 1h5l h LYS 149 Ca 0.09 -0.09 0.02 0.00 -1.87 0.00 0.00 60.65 58.80 1h5l h LYS 149 Cb 0.29 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.38 1h5l h LYS 149 CO 0.00 0.65 0.32 -0.44 -0.57 0.00 0.00 179.45 179.41 1h5l h ASP 150 N 0.90 0.52 -0.74 0.86 3.32 -0.69 -1.12 116.42 119.48 1h5l h ASP 150 Ca 0.24 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.29 1h5l h ASP 150 Cb -0.01 -0.11 -0.04 0.00 0.22 0.00 0.00 39.33 39.39 1h5l h ASP 150 CO -0.04 0.37 0.46 0.77 -1.72 0.00 0.00 179.24 179.08 1h5l h SER 151 N 0.64 0.87 -0.17 6.45 4.64 -0.65 0.19 113.55 125.51 1h5l h SER 151 Ca 0.20 -0.05 -0.06 0.00 -0.47 0.00 0.00 61.79 61.42 1h5l h SER 151 Cb -0.00 -0.22 -0.00 0.00 -0.31 0.00 0.00 62.40 61.87 1h5l h SER 151 CO -0.08 0.66 -0.12 -0.26 -0.87 0.00 0.00 176.83 176.16 1h5l h PHE 152 N 1.00 0.46 -0.63 4.77 -1.00 -1.16 -3.07 116.94 117.31 1h5l h PHE 152 Ca 0.27 -0.12 0.00 0.00 2.81 0.00 0.00 57.97 60.92 1h5l h PHE 152 Cb -0.07 -0.10 -0.03 0.00 3.61 0.00 0.00 35.95 39.36 1h5l h PHE 152 CO -0.01 0.73 0.40 0.00 -1.61 0.00 0.00 178.31 177.81 1h5l h ARG 153 N 0.06 0.84 -0.39 1.51 3.08 -1.00 -0.94 114.38 117.53 1h5l h ARG 153 Ca 0.03 -0.06 0.05 0.00 0.07 0.00 0.00 59.98 60.08 1h5l h ARG 153 Cb 0.63 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 30.47 1h5l h ARG 153 CO 0.03 0.57 0.27 -0.97 -1.07 0.00 0.00 179.97 178.80 1h5l h ASN 154 N 0.86 0.26 0.01 7.04 -1.24 -0.86 -1.61 115.58 120.04 1h5l h ASN 154 Ca 0.23 -0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.24 1h5l h ASN 154 Cb -0.07 -0.06 0.00 0.00 0.73 0.00 0.00 38.32 38.92 1h5l h ASN 154 CO -0.05 0.18 -0.16 1.33 -1.29 0.00 0.00 177.43 177.44 1h5l n VAL 155 N -4.48 0.00 0.00 2.57 0.24 -0.83 -4.96 118.33 110.88 1h5l n VAL 155 Ca 0.05 -0.35 0.00 0.00 -2.04 0.00 0.00 64.34 62.00 1h5l n VAL 155 Cb 0.24 1.12 0.00 0.00 -1.47 0.00 0.00 33.84 33.73 1h5l n VAL 155 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1h5l n GLY 156 N 1.34 0.89 3.29 7.63 0.00 -0.60 -4.86 105.19 112.87 1h5l n GLY 156 Ca 0.13 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.70 1h5l n GLY 156 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1h5l s LEU 157 N 0.00 6.36 0.35 0.99 1.43 -0.42 -4.91 118.68 122.48 1h5l s LEU 157 Ca 0.00 -2.44 0.19 0.00 -1.03 0.00 0.00 54.13 50.85 1h5l s LEU 157 Cb 0.00 -2.15 0.31 0.00 0.03 0.00 0.00 46.19 44.38 1h5l s LEU 157 CO 0.00 -0.62 1.56 0.78 0.23 0.00 0.00 176.35 178.30 1h5l h ASN 158 N 8.00 0.00 -3.59 2.29 2.35 -1.86 -2.92 115.58 119.85 1h5l h ASN 158 Ca -0.03 0.00 -0.51 0.00 -0.55 0.00 0.00 56.30 55.21 1h5l h ASN 158 Cb 1.05 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.40 1h5l h ASN 158 CO 0.82 0.32 0.35 -0.13 -1.65 0.00 0.00 177.43 177.14 1h5l s ARG 159 N -3.16 4.72 0.52 0.81 0.52 -1.26 -4.93 118.95 116.16 1h5l s ARG 159 Ca 0.04 1.44 0.23 0.00 -0.52 0.00 0.00 55.73 56.93 1h5l s ARG 159 Cb 0.07 -3.36 1.40 0.00 0.52 0.00 0.00 34.95 33.58 1h5l s ARG 159 CO 0.70 0.27 2.10 0.77 0.02 0.00 0.00 175.30 179.16 1h5l h SER 160 N 5.33 0.00 0.12 0.23 0.02 -1.96 0.31 113.55 117.60 1h5l h SER 160 Ca -0.43 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.43 1h5l h SER 160 Cb 1.21 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.74 1h5l h SER 160 CO 0.71 0.10 -0.29 -1.28 -1.14 0.00 0.00 176.83 174.93 1h5l h SER 161 N 0.00 0.27 0.14 3.07 0.87 -1.93 -0.11 113.55 115.86 1h5l h SER 161 Ca -0.00 -0.09 -0.01 0.00 -1.23 0.00 0.00 61.79 60.46 1h5l h SER 161 Cb 0.22 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.11 1h5l h SER 161 CO 0.01 0.56 -0.07 0.44 -0.53 0.00 0.00 176.83 177.25 1h5l h ASP 162 N 0.24 -0.16 -0.08 6.23 3.32 -1.32 0.29 116.42 124.94 1h5l h ASP 162 Ca 0.03 -0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.02 1h5l h ASP 162 Cb 0.64 0.04 -0.00 0.00 0.22 0.00 0.00 39.33 40.23 1h5l h ASP 162 CO 0.05 -0.05 0.04 0.25 -1.72 0.00 0.00 179.24 177.81 1h5l h LEU 163 N -0.27 0.10 -0.36 1.55 5.85 -1.27 -1.17 115.31 119.74 1h5l h LEU 163 Ca -0.02 -0.10 -0.10 0.00 0.84 0.00 0.00 57.88 58.50 1h5l h LEU 163 Cb 0.21 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 1h5l h LEU 163 CO 0.03 0.18 -0.15 0.58 -0.34 0.00 0.00 178.44 178.74 1h5l h VAL 164 N 0.03 1.28 -0.22 1.05 2.07 -0.98 -1.96 116.25 117.51 1h5l h VAL 164 Ca 0.03 -1.26 -0.06 0.00 0.82 0.00 0.00 66.70 66.23 1h5l h VAL 164 Cb 0.10 1.33 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 1h5l h VAL 164 CO -0.00 0.42 -0.10 0.00 0.02 0.00 0.00 177.57 177.90 1h5l h ALA 165 N 0.80 0.31 0.00 1.67 0.00 -0.95 -3.11 119.26 117.98 1h5l h ALA 165 Ca 0.08 -0.29 -0.08 0.00 0.00 0.00 0.00 54.91 54.62 1h5l h ALA 165 Cb 0.68 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1h5l h ALA 165 CO 0.05 0.15 -0.37 -0.07 0.00 0.00 0.00 179.25 179.01 1h5l h LEU 166 N 0.17 0.00 -1.47 0.00 3.38 -1.25 -1.36 115.31 114.79 1h5l h LEU 166 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1h5l h LEU 166 Cb 0.59 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.34 1h5l h LEU 166 CO 0.03 0.37 0.00 0.28 0.09 0.00 0.00 178.44 179.21 1h5l h SER 167 N 0.00 0.00 0.20 -0.43 0.02 -1.28 -0.86 113.55 111.20 1h5l h SER 167 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1h5l h SER 167 Cb 0.68 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.22 1h5l h SER 167 CO 0.05 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.35 1h5l n GLY 168 N -0.74 -0.65 0.22 -3.77 0.00 -0.51 -1.55 105.19 98.20 1h5l n GLY 168 Ca -0.00 -0.03 0.15 0.00 0.00 0.00 0.00 46.02 46.14 1h5l n GLY 168 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1h5l h GLY 169 N 1.26 0.00 -1.76 -0.02 0.00 -1.34 -0.90 103.07 100.32 1h5l h GLY 169 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 1h5l h GLY 169 CO 0.00 0.00 0.02 1.42 0.00 0.00 0.00 176.54 177.98 1h5l n HIS 170 N -2.61 0.57 1.28 5.60 8.25 -0.59 -3.50 115.22 124.22 1h5l n HIS 170 Ca -0.01 -0.26 0.14 0.00 -0.26 0.00 0.00 57.72 57.34 1h5l n HIS 170 Cb 0.12 -0.23 0.69 0.00 1.12 0.00 0.00 29.99 31.69 1h5l n HIS 170 CO 0.00 0.00 0.00 -2.37 0.64 0.00 0.00 176.34 174.61 1h5l n THR 171 N 0.15 0.00 -3.98 1.59 5.66 -0.34 -3.86 114.28 113.50 1h5l n THR 171 Ca 0.08 -0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 60.95 1h5l n THR 171 Cb 0.53 -0.46 -0.01 0.00 -1.55 0.00 0.00 70.33 68.84 1h5l n THR 171 CO 0.00 0.00 0.00 0.72 -3.05 0.00 0.00 175.07 172.74 1h5l s PHE 172 N -2.72 0.77 0.00 1.09 -0.71 -1.23 -4.47 117.98 110.72 1h5l s PHE 172 Ca 0.23 -1.17 0.00 0.00 -1.04 0.00 0.00 56.93 54.95 1h5l s PHE 172 Cb 0.20 0.27 0.00 0.00 -1.21 0.00 0.00 43.02 42.28 1h5l s PHE 172 CO 0.49 -1.35 0.00 0.41 -1.34 0.00 0.00 175.22 173.43 1h5l n GLY 173 N -0.58 -0.20 3.52 1.99 0.00 -1.13 -4.65 105.19 104.13 1h5l n GLY 173 Ca -0.03 -1.84 -0.24 0.00 0.00 0.00 0.00 46.02 43.91 1h5l n GLY 173 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1h5l s LYS 174 N -1.42 1.86 -0.01 1.61 -0.14 -1.26 -2.26 119.74 118.11 1h5l s LYS 174 Ca 0.00 -1.61 0.00 0.00 -1.36 0.00 0.00 55.97 53.00 1h5l s LYS 174 Cb 0.00 -1.91 0.01 0.00 -1.68 0.00 0.00 37.83 34.25 1h5l s LYS 174 CO 0.00 0.35 0.01 1.21 -0.76 0.00 0.00 175.35 176.16 1h5l s ASN 175 N -3.42 0.06 0.38 2.83 2.47 0.25 -4.87 114.94 112.64 1h5l s ASN 175 Ca 0.29 0.01 -0.24 0.00 0.42 0.00 0.00 52.86 53.34 1h5l s ASN 175 Cb -0.06 -0.04 -0.09 0.00 -1.45 0.00 0.00 41.25 39.61 1h5l s ASN 175 CO 0.16 -0.05 1.02 -1.10 -3.72 0.00 0.00 177.10 173.41 1h5l s GLN 176 N 0.43 4.28 0.38 0.43 -0.21 -1.26 -0.45 119.66 123.26 1h5l s GLN 176 Ca -0.04 1.44 0.13 0.00 0.02 0.00 0.00 55.36 56.91 1h5l s GLN 176 Cb -0.05 -2.59 0.94 0.00 1.00 0.00 0.00 33.01 32.31 1h5l s GLN 176 CO -0.01 -0.02 1.85 0.00 -2.12 0.00 0.00 175.29 174.98 1h5l h ARG 178 N 0.56 0.31 0.00 0.00 0.11 -1.28 -1.07 114.38 113.01 1h5l h ARG 178 Ca 0.48 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 60.54 1h5l h ARG 178 Cb 0.98 -0.07 0.00 0.00 1.11 0.00 0.00 29.97 31.99 1h5l h ARG 178 CO -0.22 0.21 0.00 1.19 0.10 0.00 0.00 179.97 181.25 1h5l n PHE 179 N -4.59 0.00 -0.24 4.08 3.72 -0.71 -3.66 117.46 116.06 1h5l n PHE 179 Ca 0.26 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.66 1h5l n PHE 179 Cb 0.96 -0.32 0.00 0.00 -0.94 0.00 0.00 39.48 39.18 1h5l n PHE 179 CO 0.00 0.00 0.00 0.44 -0.05 0.00 0.00 176.76 177.15 1h5l n ILE 180 N -1.32 0.13 -0.31 4.37 -5.35 -0.44 -4.78 119.36 111.66 1h5l n ILE 180 Ca 0.13 -0.45 0.12 0.00 -0.27 0.00 0.00 62.75 62.28 1h5l n ILE 180 Cb 0.25 1.13 0.34 0.00 -1.74 0.00 0.00 39.64 39.62 1h5l n ILE 180 CO 0.00 0.00 0.00 0.24 -1.76 0.00 0.00 176.55 175.03 1h5l h MET 181 N 0.00 0.74 -0.36 6.28 2.86 -1.54 -1.18 114.93 121.73 1h5l h MET 181 Ca 0.00 -0.04 -0.08 0.00 -2.06 0.00 0.00 59.70 57.52 1h5l h MET 181 Cb 0.20 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 31.68 1h5l h MET 181 CO 0.00 0.49 -0.07 0.38 1.06 0.00 0.00 176.91 178.77 1h5l h ASP 182 N 0.77 0.69 -0.14 1.22 2.03 -1.84 -1.64 116.42 117.51 1h5l h ASP 182 Ca 0.49 -0.35 -0.02 0.00 -0.73 0.00 0.00 57.03 56.42 1h5l h ASP 182 Cb 0.74 -0.19 -0.01 0.00 -0.83 0.00 0.00 39.33 39.04 1h5l h ASP 182 CO -0.26 0.88 0.04 0.03 -1.03 0.00 0.00 179.24 178.91 1h5l h ARG 183 N 0.48 0.29 0.07 4.15 3.08 -1.52 -0.93 114.38 120.00 1h5l h ARG 183 Ca 0.09 -0.04 -0.26 0.00 0.07 0.00 0.00 59.98 59.85 1h5l h ARG 183 Cb 0.57 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.55 1h5l h ARG 183 CO 0.03 0.28 -1.23 -0.07 -1.07 0.00 0.00 179.97 177.91 1h5l h LEU 184 N 0.29 0.24 0.00 3.04 3.38 -0.99 0.11 115.31 121.38 1h5l h LEU 184 Ca 0.07 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.76 1h5l h LEU 184 Cb 0.13 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1h5l h LEU 184 CO -0.00 1.22 -0.62 -1.22 0.09 0.00 0.00 178.44 177.91 1h5l n TYR 185 N -3.42 0.00 -3.12 1.13 4.01 -0.64 -4.45 117.16 110.66 1h5l n TYR 185 Ca -0.07 0.00 -0.06 0.00 -0.16 0.00 0.00 57.90 57.61 1h5l n TYR 185 Cb 1.00 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 40.01 1h5l n TYR 185 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 1h5l s ASN 186 N -2.14 -0.81 -0.17 7.72 2.47 -0.55 -3.71 114.94 117.75 1h5l s ASN 186 Ca 0.00 -1.35 -0.22 0.00 0.42 0.00 0.00 52.86 51.71 1h5l s ASN 186 Cb 0.00 1.53 -0.03 0.00 -1.45 0.00 0.00 41.25 41.30 1h5l s ASN 186 CO 0.00 -0.15 0.65 0.12 -3.72 0.00 0.00 177.10 174.00 1h5l s PHE 187 N 1.37 3.42 -1.49 0.43 5.36 0.76 -4.20 117.98 123.64 1h5l s PHE 187 Ca 0.21 1.01 -0.07 0.00 -0.96 0.00 0.00 56.93 57.12 1h5l s PHE 187 Cb -0.05 -2.81 0.06 0.00 -0.34 0.00 0.00 43.02 39.88 1h5l s PHE 187 CO -0.06 -0.12 0.64 0.45 -1.46 0.00 0.00 175.22 174.67 1h5l n SER 188 N 4.78 -1.91 -2.35 6.13 2.88 -1.26 -1.46 113.62 120.44 1h5l n SER 188 Ca -0.01 -0.95 -0.16 0.00 -1.33 0.00 0.00 58.87 56.42 1h5l n SER 188 Cb 0.50 -3.23 -0.01 0.00 -0.75 0.00 0.00 64.21 60.72 1h5l n SER 188 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1h5l n ASN 189 N -2.89 -4.82 0.01 -3.46 3.02 -1.26 -4.85 115.26 101.02 1h5l n ASN 189 Ca -0.15 0.12 0.11 0.00 -0.03 0.00 0.00 54.58 54.63 1h5l n ASN 189 Cb 0.61 -4.07 0.07 0.00 -0.61 0.00 0.00 39.78 35.78 1h5l n ASN 189 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1h5l n THR 190 N -3.56 0.05 -1.07 3.41 -2.24 -0.53 -4.93 114.28 105.41 1h5l n THR 190 Ca -0.19 -0.08 -0.02 0.00 -2.27 0.00 0.00 64.05 61.49 1h5l n THR 190 Cb 0.64 0.45 -0.01 0.00 -2.10 0.00 0.00 70.33 69.31 1h5l n THR 190 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1h5l n GLY 191 N 1.46 0.48 3.23 3.38 0.00 -1.26 -4.94 105.19 107.54 1h5l n GLY 191 Ca 0.04 -0.16 -0.14 0.00 0.00 0.00 0.00 46.02 45.76 1h5l n GLY 191 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1h5l s LEU 192 N -0.52 2.52 0.85 0.99 1.43 -1.24 -4.73 118.68 117.98 1h5l s LEU 192 Ca 0.00 -0.99 -0.11 0.00 -1.03 0.00 0.00 54.13 51.99 1h5l s LEU 192 Cb 0.00 -0.31 0.10 0.00 0.03 0.00 0.00 46.19 46.01 1h5l s LEU 192 CO 0.00 -0.34 1.09 -2.16 0.23 0.00 0.00 176.35 175.17 1h5l s PRO 193 N -3.67 1.62 -0.00 1.29 0.04 -1.26 -0.17 135.00 132.85 1h5l s PRO 193 Ca 0.15 0.87 -0.30 0.00 0.04 0.00 0.00 61.00 61.76 1h5l s PRO 193 Cb 0.02 -1.85 -0.08 0.00 0.04 0.00 0.00 34.50 32.64 1h5l s PRO 193 CO -0.00 -2.00 1.88 0.34 0.04 0.00 0.00 177.00 177.26 1h5l s ASP 194 N -3.50 6.48 0.44 6.66 -1.08 0.38 -4.74 116.67 121.31 1h5l s ASP 194 Ca 0.62 2.51 0.30 0.00 -0.52 0.00 0.00 52.55 55.47 1h5l s ASP 194 Cb -0.17 -2.53 1.54 0.00 -1.46 0.00 0.00 42.92 40.30 1h5l s ASP 194 CO 0.56 -1.05 1.92 1.55 0.52 0.00 0.00 175.17 178.67 1h5l h PRO 195 N 10.45 0.00 -0.12 4.34 0.13 -1.91 -1.98 132.00 142.91 1h5l h PRO 195 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1h5l h PRO 195 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1h5l h PRO 195 CO 0.95 0.00 0.00 0.25 -0.23 0.00 0.00 178.00 178.97 1h5l n THR 196 N -2.60 0.16 -3.59 1.56 -2.24 -1.26 -4.77 114.28 101.54 1h5l n THR 196 Ca -0.01 -0.26 -0.37 0.00 -2.27 0.00 0.00 64.05 61.13 1h5l n THR 196 Cb 0.11 0.22 -0.10 0.00 -2.10 0.00 0.00 70.33 68.46 1h5l n THR 196 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1h5l s LEU 197 N -1.58 4.08 0.04 3.22 2.96 -0.75 -4.71 118.68 121.95 1h5l s LEU 197 Ca 0.31 0.13 -0.37 0.00 -0.22 0.00 0.00 54.13 53.98 1h5l s LEU 197 Cb 0.16 -2.18 -0.17 0.00 0.50 0.00 0.00 46.19 44.51 1h5l s LEU 197 CO 0.25 -0.01 1.38 -3.20 -1.32 0.00 0.00 176.35 173.45 1h5l n ASN 198 N 4.65 1.67 0.26 3.68 2.85 0.40 -4.77 115.26 124.00 1h5l n ASN 198 Ca -0.13 1.12 0.11 0.00 -0.11 0.00 0.00 54.58 55.56 1h5l n ASN 198 Cb 0.52 -1.17 0.69 0.00 1.24 0.00 0.00 39.78 41.05 1h5l n ASN 198 CO 0.00 0.00 0.00 0.71 -2.11 0.00 0.00 177.26 175.86 1h5l h THR 199 N 3.55 0.70 -0.03 -0.44 1.35 -1.93 0.18 112.91 116.29 1h5l h THR 199 Ca -0.48 -0.51 -0.12 0.00 -0.55 0.00 0.00 66.41 64.75 1h5l h THR 199 Cb 1.34 1.31 0.01 0.00 -1.73 0.00 0.00 68.15 69.08 1h5l h THR 199 CO 0.80 0.12 -0.46 0.74 -0.25 0.00 0.00 175.52 176.47 1h5l h THR 200 N 0.00 1.44 -0.12 6.82 2.02 -1.99 -3.01 112.91 118.08 1h5l h THR 200 Ca -0.00 -1.94 -0.06 0.00 0.77 0.00 0.00 66.41 65.18 1h5l h THR 200 Cb 0.30 2.51 -0.01 0.00 -1.74 0.00 0.00 68.15 69.21 1h5l h THR 200 CO 0.02 0.56 -0.21 0.22 0.37 0.00 0.00 175.52 176.48 1h5l h TYR 201 N -0.16 0.21 -0.48 3.16 3.20 -1.85 -2.40 116.97 118.66 1h5l h TYR 201 Ca -0.05 -0.03 0.05 0.00 3.14 0.00 0.00 58.73 61.84 1h5l h TYR 201 Cb 1.15 -0.06 -0.05 0.00 1.54 0.00 0.00 36.73 39.32 1h5l h TYR 201 CO 0.14 0.40 0.21 1.25 -1.64 0.00 0.00 178.16 178.52 1h5l h LEU 202 N 0.18 0.27 -0.47 2.82 5.85 -0.60 -0.13 115.31 123.22 1h5l h LEU 202 Ca 0.03 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.80 1h5l h LEU 202 Cb 0.48 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.48 1h5l h LEU 202 CO 0.03 0.19 0.31 1.56 -0.34 0.00 0.00 178.44 180.19 1h5l h GLN 203 N 0.41 0.62 -0.22 1.25 7.50 -1.30 -0.60 115.11 122.78 1h5l h GLN 203 Ca 0.22 -0.04 0.00 0.00 0.50 0.00 0.00 58.65 59.33 1h5l h GLN 203 Cb 0.17 -0.14 -0.01 0.00 0.05 0.00 0.00 27.48 27.55 1h5l h GLN 203 CO -0.19 0.42 0.14 1.15 -1.50 0.00 0.00 178.83 178.85 1h5l h THR 204 N 0.64 1.07 -0.30 -0.54 2.02 -1.16 -2.11 112.91 112.53 1h5l h THR 204 Ca 0.17 -0.15 -0.07 0.00 0.77 0.00 0.00 66.41 67.13 1h5l h THR 204 Cb -0.06 0.77 -0.02 0.00 -1.74 0.00 0.00 68.15 67.10 1h5l h THR 204 CO -0.04 0.07 -0.11 -0.07 0.37 0.00 0.00 175.52 175.74 1h5l h LEU 205 N 0.29 0.48 -1.19 2.58 3.38 -0.82 -2.16 115.31 117.87 1h5l h LEU 205 Ca 0.08 -0.12 -0.07 0.00 0.09 0.00 0.00 57.88 57.86 1h5l h LEU 205 Cb -0.01 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 1h5l h LEU 205 CO -0.02 0.63 -0.24 0.03 0.09 0.00 0.00 178.44 178.93 1h5l h ARG 206 N 0.46 0.26 -0.07 1.13 3.08 -0.83 0.21 114.38 118.63 1h5l h ARG 206 Ca 0.09 -0.08 -0.12 0.00 0.07 0.00 0.00 59.98 59.93 1h5l h ARG 206 Cb 0.47 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.49 1h5l h ARG 206 CO 0.03 0.49 -0.52 0.78 -1.07 0.00 0.00 179.97 179.68 1h5l h GLY 207 N 0.95 0.21 1.69 0.04 0.00 -0.76 -2.27 103.07 102.93 1h5l h GLY 207 Ca 0.04 -0.23 -0.23 0.00 0.00 0.00 0.00 47.33 46.92 1h5l h GLY 207 CO 0.04 0.20 -1.18 1.41 0.00 0.00 0.00 176.54 177.01 1h5l h LEU 208 N 0.15 0.00 -6.21 3.11 3.38 -1.01 -3.39 115.31 111.33 1h5l h LEU 208 Ca 0.00 0.00 -0.59 0.00 0.09 0.00 0.00 57.88 57.39 1h5l h LEU 208 Cb 0.97 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 41.31 1h5l h LEU 208 CO 0.08 0.97 -0.81 0.00 0.09 0.00 0.00 178.44 178.76 1h5l s PRO 210 N -1.71 2.62 0.29 0.00 0.04 -0.86 -4.62 135.00 130.76 1h5l s PRO 210 Ca 0.36 1.63 -0.30 0.00 0.04 0.00 0.00 61.00 62.73 1h5l s PRO 210 Cb 0.13 -1.91 -0.11 0.00 0.04 0.00 0.00 34.50 32.66 1h5l s PRO 210 CO -0.08 -1.43 1.54 -1.17 0.04 0.00 0.00 177.00 175.90 1h5l s LEU 211 N -4.74 4.35 -0.52 -3.56 0.20 -1.26 -1.20 118.68 111.95 1h5l s LEU 211 Ca 0.72 2.89 0.00 0.00 0.69 0.00 0.00 54.13 58.43 1h5l s LEU 211 Cb -0.26 -3.64 0.00 0.00 -0.43 0.00 0.00 46.19 41.87 1h5l s LEU 211 CO 0.40 -0.85 0.00 0.59 -0.29 0.00 0.00 176.35 176.20 1h5l n ASN 212 N 2.00 -4.37 -1.83 3.68 5.03 -1.26 -5.00 115.26 113.51 1h5l n ASN 212 Ca 0.07 0.12 0.00 0.00 0.87 0.00 0.00 54.58 55.64 1h5l n ASN 212 Cb 0.38 -2.30 0.00 0.00 -1.02 0.00 0.00 39.78 36.84 1h5l n ASN 212 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1h5l n GLY 213 N -1.35 0.40 3.58 7.41 0.00 -0.34 -4.97 105.19 109.92 1h5l n GLY 213 Ca -0.05 -1.86 -0.41 0.00 0.00 0.00 0.00 46.02 43.69 1h5l n GLY 213 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1h5l s ASN 214 N -1.00 5.79 0.43 1.61 3.04 -1.26 -4.86 114.94 118.70 1h5l s ASN 214 Ca 0.00 0.82 0.30 0.00 0.04 0.00 0.00 52.86 54.02 1h5l s ASN 214 Cb 0.00 -2.53 1.27 0.00 -1.54 0.00 0.00 41.25 38.45 1h5l s ASN 214 CO 0.00 -1.87 1.88 -0.07 -3.04 0.00 0.00 177.10 174.00 1h5l h LEU 215 N 14.23 0.00 -0.66 3.21 3.38 -1.94 -2.59 115.31 130.95 1h5l h LEU 215 Ca -0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.67 1h5l h LEU 215 Cb 1.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 1h5l h LEU 215 CO 1.11 0.00 -0.16 -1.20 0.09 0.00 0.00 178.44 178.29 1h5l n SER 216 N -2.70 1.18 -4.74 -0.43 7.64 -1.26 -0.85 113.62 112.46 1h5l n SER 216 Ca 0.01 -1.10 -0.41 0.00 1.01 0.00 0.00 58.87 58.38 1h5l n SER 216 Cb 0.25 0.08 0.01 0.00 -1.01 0.00 0.00 64.21 63.53 1h5l n SER 216 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1h5l n ALA 217 N -0.36 1.80 -2.87 -0.43 0.00 -0.98 -4.69 120.51 112.98 1h5l n ALA 217 Ca 0.15 0.28 -0.36 0.00 0.00 0.00 0.00 53.44 53.50 1h5l n ALA 217 Cb 0.35 -2.35 -0.06 0.00 0.00 0.00 0.00 19.45 17.39 1h5l n ALA 217 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1h5l s LEU 218 N -2.13 4.33 0.05 0.00 1.43 -1.26 -0.77 118.68 120.33 1h5l s LEU 218 Ca 0.59 0.43 0.06 0.00 -1.03 0.00 0.00 54.13 54.19 1h5l s LEU 218 Cb -0.48 -2.10 -0.03 0.00 0.03 0.00 0.00 46.19 43.61 1h5l s LEU 218 CO 0.59 0.39 -0.16 -0.69 0.23 0.00 0.00 176.35 176.71 1h5l s VAL 219 N -1.05 1.30 0.20 -1.59 1.01 0.41 -4.92 120.40 115.75 1h5l s VAL 219 Ca 0.16 -1.16 -0.30 0.00 0.00 0.00 0.00 61.98 60.68 1h5l s VAL 219 Cb -0.12 -1.18 -0.08 0.00 0.00 0.00 0.00 36.38 35.00 1h5l s VAL 219 CO 0.05 -0.00 1.16 -1.81 0.00 0.00 0.00 175.10 174.50 1h5l s ASP 220 N -1.35 7.14 0.27 3.32 1.01 -1.26 -0.58 116.67 125.21 1h5l s ASP 220 Ca 0.03 2.21 0.01 0.00 0.71 0.00 0.00 52.55 55.51 1h5l s ASP 220 Cb -0.09 -2.61 0.37 0.00 1.01 0.00 0.00 42.92 41.60 1h5l s ASP 220 CO 0.02 -0.31 1.72 -0.26 0.21 0.00 0.00 175.17 176.55 1h5l h PHE 221 N 4.98 0.65 -3.73 4.23 0.04 -1.72 -3.40 116.94 118.00 1h5l h PHE 221 Ca -0.45 -0.13 -0.68 0.00 2.80 0.00 0.00 57.97 59.51 1h5l h PHE 221 Cb 1.21 -0.16 -0.35 0.00 2.20 0.00 0.00 35.95 38.85 1h5l h PHE 221 CO 0.62 0.74 -0.70 0.34 -0.60 0.00 0.00 178.31 178.71 1h5l s ASP 222 N -6.77 4.85 0.40 2.17 -1.08 -1.25 -4.38 116.67 110.61 1h5l s ASP 222 Ca -0.08 -1.54 0.28 0.00 -0.52 0.00 0.00 52.55 50.69 1h5l s ASP 222 Cb 0.14 -1.69 1.19 0.00 -1.46 0.00 0.00 42.92 41.10 1h5l s ASP 222 CO 0.80 -0.31 1.85 0.17 0.52 0.00 0.00 175.17 178.20 1h5l h LEU 223 N 7.91 0.00 0.00 -1.34 -0.00 -1.91 -2.61 115.31 117.37 1h5l h LEU 223 Ca -0.17 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.71 1h5l h LEU 223 Cb 1.05 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.71 1h5l h LEU 223 CO 0.55 0.00 -0.09 0.03 -0.00 0.00 0.00 178.44 178.93 1h5l h ARG 224 N 0.00 0.00 -2.69 0.17 3.08 -1.93 -3.43 114.38 109.58 1h5l h ARG 224 Ca 0.00 0.00 -0.60 0.00 0.07 0.00 0.00 59.98 59.45 1h5l h ARG 224 Cb 0.42 0.00 -0.40 0.00 0.08 0.00 0.00 29.97 30.07 1h5l h ARG 224 CO 0.00 0.09 -0.81 0.95 -1.07 0.00 0.00 179.97 179.13 1h5l s THR 225 N -1.71 1.22 0.42 2.04 -4.23 -1.24 -5.02 115.64 107.13 1h5l s THR 225 Ca -0.04 -3.03 0.24 0.00 -1.18 0.00 0.00 61.69 57.68 1h5l s THR 225 Cb 0.00 -1.83 0.44 0.00 1.34 0.00 0.00 72.50 72.45 1h5l s THR 225 CO 0.09 -1.10 1.71 -0.65 -0.54 0.00 0.00 174.62 174.14 1h5l h PRO 226 N 5.85 0.24 -0.00 3.99 0.11 -1.70 -2.96 132.00 137.53 1h5l h PRO 226 Ca 0.17 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.27 1h5l h PRO 226 Cb 0.87 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.93 1h5l h PRO 226 CO 0.48 0.16 0.00 0.25 -0.21 0.00 0.00 178.00 178.68 1h5l n THR 227 N -4.63 0.35 -3.88 -1.15 -2.24 -1.26 -2.85 114.28 98.62 1h5l n THR 227 Ca 0.30 -0.68 -0.35 0.00 -2.27 0.00 0.00 64.05 61.05 1h5l n THR 227 Cb 1.12 0.83 -0.08 0.00 -2.10 0.00 0.00 70.33 70.09 1h5l n THR 227 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1h5l s ILE 228 N -0.36 5.21 -0.57 2.28 1.01 -1.12 -4.87 121.20 122.77 1h5l s ILE 228 Ca 0.00 0.11 -0.25 0.00 0.00 0.00 0.00 60.65 60.51 1h5l s ILE 228 Cb 0.00 -3.33 0.04 0.00 0.01 0.00 0.00 42.46 39.18 1h5l s ILE 228 CO 0.00 0.51 1.02 0.12 0.00 0.00 0.00 174.94 176.59 1h5l s PHE 229 N -0.11 2.72 0.17 3.97 2.19 0.40 -4.52 117.98 122.81 1h5l s PHE 229 Ca 0.09 0.07 -0.03 0.00 0.33 0.00 0.00 56.93 57.39 1h5l s PHE 229 Cb -0.12 -4.22 0.01 0.00 -1.31 0.00 0.00 43.02 37.39 1h5l s PHE 229 CO 0.00 -1.45 0.28 -0.40 1.83 0.00 0.00 175.22 175.48 1h5l n ASP 230 N 7.80 -0.78 -0.56 6.13 5.68 -1.26 -3.64 116.55 129.91 1h5l n ASP 230 Ca 0.03 -1.85 0.05 0.00 -0.50 0.00 0.00 54.79 52.52 1h5l n ASP 230 Cb 0.48 1.39 0.13 0.00 -1.14 0.00 0.00 41.12 41.98 1h5l n ASP 230 CO 0.00 0.00 0.00 -0.46 -1.33 0.00 0.00 177.20 175.41 1h5l n ASN 231 N -1.69 1.61 0.27 -1.12 6.94 -1.26 -4.24 115.26 115.77 1h5l n ASN 231 Ca -0.01 -2.02 0.11 0.00 -0.02 0.00 0.00 54.58 52.64 1h5l n ASN 231 Cb 0.28 -0.21 0.74 0.00 -2.36 0.00 0.00 39.78 38.23 1h5l n ASN 231 CO 0.00 0.00 0.00 0.11 -1.03 0.00 0.00 177.26 176.34 1h5l h LYS 232 N 1.68 0.00 -0.91 -3.83 1.79 -1.94 -2.16 116.57 111.20 1h5l h LYS 232 Ca 0.00 0.00 0.15 0.00 -2.18 0.00 0.00 60.65 58.62 1h5l h LYS 232 Cb 0.42 0.00 -0.09 0.00 -1.58 0.00 0.00 32.23 30.98 1h5l h LYS 232 CO 0.01 0.00 0.52 -0.92 -1.08 0.00 0.00 179.45 177.98 1h5l h TYR 233 N 0.00 0.91 -0.01 -1.35 3.20 -1.90 -1.32 116.97 116.51 1h5l h TYR 233 Ca 0.00 0.03 -0.16 0.00 3.14 0.00 0.00 58.73 61.74 1h5l h TYR 233 Cb 0.02 -0.27 -0.02 0.00 1.54 0.00 0.00 36.73 38.00 1h5l h TYR 233 CO 0.00 0.25 -0.75 1.88 -1.64 0.00 0.00 178.16 177.90 1h5l h TYR 234 N 0.73 0.12 -0.57 -3.82 0.05 -1.73 -2.70 116.97 109.05 1h5l h TYR 234 Ca 0.49 -0.06 -0.08 0.00 0.05 0.00 0.00 58.73 59.14 1h5l h TYR 234 Cb 0.67 -0.02 -0.02 0.00 1.01 0.00 0.00 36.73 38.37 1h5l h TYR 234 CO -0.05 0.80 0.03 0.28 -1.05 0.00 0.00 178.16 178.17 1h5l h VAL 235 N 0.05 1.26 -0.33 -2.88 2.07 -1.32 -2.35 116.25 112.76 1h5l h VAL 235 Ca -0.02 -1.05 -0.00 0.00 0.82 0.00 0.00 66.70 66.45 1h5l h VAL 235 Cb 1.32 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 31.85 1h5l h VAL 235 CO 0.10 0.38 0.20 0.78 0.02 0.00 0.00 177.57 179.06 1h5l h ASN 236 N 0.89 0.39 -0.99 0.57 2.35 -1.11 -2.69 115.58 115.00 1h5l h ASN 236 Ca 0.17 -0.05 0.07 0.00 -0.55 0.00 0.00 56.30 55.94 1h5l h ASN 236 Cb 0.47 -0.10 -0.07 0.00 0.05 0.00 0.00 38.32 38.68 1h5l h ASN 236 CO 0.02 0.32 0.63 -0.07 -1.65 0.00 0.00 177.43 176.69 1h5l h LEU 237 N 0.42 1.01 -2.32 1.61 3.38 -1.16 0.16 115.31 118.42 1h5l h LEU 237 Ca 0.12 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 1h5l h LEU 237 Cb 0.00 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.55 1h5l h LEU 237 CO -0.02 0.65 -0.04 -0.33 0.09 0.00 0.00 178.44 178.78 1h5l h GLU 238 N 1.15 0.00 -0.51 1.13 5.08 -1.09 -1.26 114.58 119.08 1h5l h GLU 238 Ca 0.43 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.79 1h5l h GLU 238 Cb 0.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.42 1h5l h GLU 238 CO -0.17 0.04 0.00 0.39 -1.00 0.00 0.00 179.01 178.27 1h5l n GLU 239 N -3.65 3.66 -2.61 2.33 1.02 -0.29 -4.94 120.64 116.17 1h5l n GLU 239 Ca -0.02 -2.83 -0.18 0.00 -0.02 0.00 0.00 57.16 54.11 1h5l n GLU 239 Cb 0.14 -1.87 0.01 0.00 -0.02 0.00 0.00 31.44 29.70 1h5l n GLU 239 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1h5l n GLN 240 N 0.60 -2.71 -0.50 3.49 1.13 -0.47 -4.58 117.38 114.33 1h5l n GLN 240 Ca 0.23 0.78 0.06 0.00 -1.94 0.00 0.00 57.00 56.14 1h5l n GLN 240 Cb 0.89 -5.26 0.25 0.00 0.11 0.00 0.00 30.24 26.22 1h5l n GLN 240 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1h5l n LYS 241 N -3.04 2.70 -2.09 -1.09 5.02 0.41 -0.45 118.16 119.62 1h5l n LYS 241 Ca -0.15 -2.89 -0.41 0.00 -2.02 0.00 0.00 58.31 52.85 1h5l n LYS 241 Cb 0.63 -1.84 -0.02 0.00 -0.02 0.00 0.00 35.03 33.78 1h5l n LYS 241 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1h5l s GLY 242 N -2.05 2.99 -0.03 0.72 0.00 -1.25 -4.71 107.32 102.99 1h5l s GLY 242 Ca 0.43 1.28 -0.21 0.00 0.00 0.00 0.00 44.72 46.22 1h5l s GLY 242 CO 0.07 1.92 0.89 -2.00 0.00 0.00 0.00 173.10 173.98 1h5l h LEU 243 N 3.27 -0.32-10.24 0.66 5.85 -1.93 -3.43 115.31 109.17 1h5l h LEU 243 Ca -0.49 -0.20 -0.46 0.00 0.84 0.00 0.00 57.88 57.57 1h5l h LEU 243 Cb 1.23 0.08 -0.00 0.00 0.37 0.00 0.00 40.66 42.34 1h5l h LEU 243 CO 0.65 0.16 -0.36 0.27 -0.34 0.00 0.00 178.44 178.82 1h5l s ILE 244 N -3.70 4.86 0.20 4.05 -4.36 -1.26 -4.95 121.20 116.04 1h5l s ILE 244 Ca -0.12 -0.89 -0.11 0.00 -0.26 0.00 0.00 60.65 59.27 1h5l s ILE 244 Cb 0.01 -3.72 0.15 0.00 1.25 0.00 0.00 42.46 40.14 1h5l s ILE 244 CO 0.42 -0.32 1.70 -0.61 0.24 0.00 0.00 174.94 176.37 1h5l h GLN 245 N 1.00 0.20 0.00 0.37 4.15 -1.87 -0.43 115.11 118.52 1h5l h GLN 245 Ca -0.50 -0.01 -0.01 0.00 0.77 0.00 0.00 58.65 58.90 1h5l h GLN 245 Cb 1.24 -0.05 -0.00 0.00 0.21 0.00 0.00 27.48 28.88 1h5l h GLN 245 CO 0.59 0.13 -0.03 0.66 -1.93 0.00 0.00 178.83 178.25 1h5l h SER 246 N 0.21 0.00 0.20 -0.69 4.64 -1.62 -0.87 113.55 115.41 1h5l h SER 246 Ca 0.29 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.60 1h5l h SER 246 Cb 0.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 1h5l h SER 246 CO -0.40 0.03 -0.09 0.44 -0.87 0.00 0.00 176.83 175.94 1h5l h ASP 247 N 0.00 -0.22 0.22 4.97 3.32 -1.41 -3.34 116.42 119.96 1h5l h ASP 247 Ca -0.00 -0.22 -0.03 0.00 0.02 0.00 0.00 57.03 56.80 1h5l h ASP 247 Cb 0.09 0.06 -0.00 0.00 0.22 0.00 0.00 39.33 39.70 1h5l h ASP 247 CO 0.00 0.31 -0.14 -0.61 -1.72 0.00 0.00 179.24 177.09 1h5l h GLN 248 N -0.98 0.00 0.00 3.56 5.75 -1.20 -2.51 115.11 119.73 1h5l h GLN 248 Ca -0.03 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.46 1h5l h GLN 248 Cb 0.43 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 28.98 1h5l h GLN 248 CO 0.04 0.14 -0.06 0.93 -2.65 0.00 0.00 178.83 177.23 1h5l h GLU 249 N 0.00 0.00 0.00 1.69 5.08 -1.27 -0.21 114.58 119.86 1h5l h GLU 249 Ca -0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1h5l h GLU 249 Cb 0.28 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.53 1h5l h GLU 249 CO 0.02 0.06 -0.10 -0.07 -1.00 0.00 0.00 179.01 177.92 1h5l h LEU 250 N 0.00 0.00 0.00 1.33 3.38 -1.58 -1.93 115.31 116.51 1h5l h LEU 250 Ca -0.00 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.78 1h5l h LEU 250 Cb 0.28 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.00 1h5l h LEU 250 CO 0.01 0.10 -1.74 0.33 0.09 0.00 0.00 178.44 177.23 1h5l n PHE 251 N -3.85 0.00 0.60 1.13 7.35 -0.67 -3.54 117.46 118.48 1h5l n PHE 251 Ca -0.02 0.00 0.06 0.00 -0.76 0.00 0.00 57.45 56.73 1h5l n PHE 251 Cb 0.19 -0.53 -0.06 0.00 0.35 0.00 0.00 39.48 39.44 1h5l n PHE 251 CO 0.00 0.00 0.00 0.43 -0.76 0.00 0.00 176.76 176.43 1h5l n SER 252 N -2.39 0.80 -4.75 -2.13 7.64 -0.18 -4.86 113.62 107.75 1h5l n SER 252 Ca -0.17 -0.90 -0.37 0.00 1.01 0.00 0.00 58.87 58.44 1h5l n SER 252 Cb 0.84 0.88 0.03 0.00 -1.01 0.00 0.00 64.21 64.95 1h5l n SER 252 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1h5l s SER 253 N -2.08 5.26 0.55 6.43 0.15 -0.73 -4.87 113.70 118.40 1h5l s SER 253 Ca 0.06 2.48 0.36 0.00 0.70 0.00 0.00 55.95 59.56 1h5l s SER 253 Cb 0.10 -2.61 1.72 0.00 -1.71 0.00 0.00 66.02 63.52 1h5l s SER 253 CO 0.48 -1.55 2.08 -0.65 1.20 0.00 0.00 173.24 174.79 1h5l h PRO 254 N 1.11 0.00 -0.67 5.44 0.11 -1.96 -1.35 132.00 134.68 1h5l h PRO 254 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1h5l h PRO 254 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 1h5l h PRO 254 CO 0.56 0.00 0.00 -1.71 -0.21 0.00 0.00 178.00 176.64 1h5l n ASN 255 N -2.93 4.56 -1.09 -2.05 4.05 -1.26 -4.54 115.26 112.00 1h5l n ASN 255 Ca -0.01 -2.37 0.03 0.00 0.45 0.00 0.00 54.58 52.69 1h5l n ASN 255 Cb 0.19 -0.56 0.18 0.00 1.23 0.00 0.00 39.78 40.81 1h5l n ASN 255 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1h5l n ALA 256 N 1.19 3.07 -0.20 5.20 0.00 -0.51 -4.42 120.51 124.84 1h5l n ALA 256 Ca 0.25 -0.84 0.09 0.00 0.00 0.00 0.00 53.44 52.94 1h5l n ALA 256 Cb 0.84 -1.05 0.37 0.00 0.00 0.00 0.00 19.45 19.61 1h5l n ALA 256 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1h5l h THR 257 N 1.82 0.95 0.00 0.00 2.02 -1.82 -0.53 112.91 115.34 1h5l h THR 257 Ca 0.00 -0.24 -0.11 0.00 0.77 0.00 0.00 66.41 66.83 1h5l h THR 257 Cb 1.11 0.18 -0.02 0.00 -1.74 0.00 0.00 68.15 67.68 1h5l h THR 257 CO 0.20 0.13 -1.10 -2.24 0.37 0.00 0.00 175.52 172.88 1h5l h ASP 258 N 0.70 0.00 0.63 4.18 2.03 -1.97 -3.38 116.42 118.61 1h5l h ASP 258 Ca 0.36 0.00 -0.22 0.00 -0.73 0.00 0.00 57.03 56.44 1h5l h ASP 258 Cb 0.45 0.00 -0.04 0.00 -0.83 0.00 0.00 39.33 38.91 1h5l h ASP 258 CO -0.13 0.40 -1.52 0.71 -1.03 0.00 0.00 179.24 177.68 1h5l h THR 259 N 0.00 0.66 -0.40 1.15 1.35 -1.68 -3.38 112.91 110.62 1h5l h THR 259 Ca -0.09 -2.31 0.05 0.00 -0.55 0.00 0.00 66.41 63.51 1h5l h THR 259 Cb 1.39 2.21 -0.04 0.00 -1.73 0.00 0.00 68.15 69.97 1h5l h THR 259 CO 0.04 0.38 0.15 0.40 -0.25 0.00 0.00 175.52 176.23 1h5l h ILE 260 N 0.00 0.89 -0.07 6.82 2.04 -1.16 -0.33 117.51 125.70 1h5l h ILE 260 Ca -0.21 -0.11 -0.04 0.00 1.00 0.00 0.00 64.86 65.50 1h5l h ILE 260 Cb 1.76 0.55 -0.01 0.00 -0.74 0.00 0.00 36.82 38.39 1h5l h ILE 260 CO 0.06 0.06 -0.14 1.55 0.00 0.00 0.00 178.15 179.68 1h5l h PRO 261 N 0.31 0.10 -0.17 2.37 0.13 -1.78 -0.92 132.00 132.05 1h5l h PRO 261 Ca 0.18 -0.02 -0.11 0.00 -0.87 0.00 0.00 66.00 65.18 1h5l h PRO 261 Cb 0.15 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.27 1h5l h PRO 261 CO -0.18 0.24 -0.34 -0.07 -0.23 0.00 0.00 178.00 177.43 1h5l h LEU 262 N 0.10 0.59 -0.33 1.56 3.38 -1.55 -0.96 115.31 118.10 1h5l h LEU 262 Ca 0.02 -0.55 0.02 0.00 0.09 0.00 0.00 57.88 57.46 1h5l h LEU 262 Cb 0.31 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 1h5l h LEU 262 CO 0.02 1.04 0.16 0.58 0.09 0.00 0.00 178.44 180.32 1h5l h VAL 263 N 0.17 0.98 -0.58 1.22 2.07 -0.67 -0.84 116.25 118.60 1h5l h VAL 263 Ca 0.00 -0.11 -0.01 0.00 0.82 0.00 0.00 66.70 67.40 1h5l h VAL 263 Cb 0.94 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 31.30 1h5l h VAL 263 CO 0.08 0.06 0.32 0.03 0.02 0.00 0.00 177.57 178.08 1h5l h ARG 264 N 0.33 0.81 -0.71 1.57 3.08 -1.15 -0.92 114.38 117.40 1h5l h ARG 264 Ca 0.14 -0.09 -0.03 0.00 0.07 0.00 0.00 59.98 60.07 1h5l h ARG 264 Cb 0.06 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 29.91 1h5l h ARG 264 CO -0.10 0.61 0.33 0.66 -1.07 0.00 0.00 179.97 180.40 1h5l h SER 265 N 0.79 0.92 0.99 7.04 4.64 -0.75 -0.67 113.55 126.50 1h5l h SER 265 Ca 0.21 -0.11 -0.14 0.00 -0.47 0.00 0.00 61.79 61.28 1h5l h SER 265 Cb 0.04 -0.24 -0.02 0.00 -0.31 0.00 0.00 62.40 61.87 1h5l h SER 265 CO -0.03 0.78 -0.67 -0.26 -0.87 0.00 0.00 176.83 175.79 1h5l h PHE 266 N 1.00 0.00 0.00 4.77 0.04 -0.89 -2.47 116.94 119.40 1h5l h PHE 266 Ca 0.24 0.00 -0.20 0.00 2.80 0.00 0.00 57.97 60.82 1h5l h PHE 266 Cb 0.12 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.26 1h5l h PHE 266 CO 0.01 0.67 -0.88 0.00 -0.60 0.00 0.00 178.31 177.51 1h5l h ALA 267 N 1.33 0.52 0.00 2.45 0.00 -0.77 -3.29 119.26 119.50 1h5l h ALA 267 Ca -0.01 -0.72 -0.17 0.00 0.00 0.00 0.00 54.91 54.01 1h5l h ALA 267 Cb 1.34 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 1h5l h ALA 267 CO 0.09 0.92 -0.81 -0.91 0.00 0.00 0.00 179.25 178.53 1h5l h ASN 268 N 0.11 0.00 -3.24 0.00 -0.26 -1.06 -3.45 115.58 107.67 1h5l h ASN 268 Ca -0.04 0.00 -0.38 0.00 -0.56 0.00 0.00 56.30 55.32 1h5l h ASN 268 Cb 1.50 0.00 -0.39 0.00 -1.06 0.00 0.00 38.32 38.37 1h5l h ASN 268 CO 0.13 0.81 -0.73 -0.55 -1.06 0.00 0.00 177.43 176.03 1h5l s SER 269 N -6.70 1.31 0.24 5.81 0.15 -0.94 -5.00 113.70 108.57 1h5l s SER 269 Ca 0.01 -0.02 -0.07 0.00 0.70 0.00 0.00 55.95 56.57 1h5l s SER 269 Cb 0.10 -0.12 0.24 0.00 -1.71 0.00 0.00 66.02 64.54 1h5l s SER 269 CO 0.79 -0.27 1.91 0.74 1.20 0.00 0.00 173.24 177.61 1h5l h THR 270 N 6.43 1.22 -0.37 6.45 2.02 -1.87 -1.32 112.91 125.48 1h5l h THR 270 Ca -0.13 -0.43 -0.00 0.00 0.77 0.00 0.00 66.41 66.63 1h5l h THR 270 Cb 1.13 -0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 67.39 1h5l h THR 270 CO 0.17 0.23 0.23 -0.61 0.37 0.00 0.00 175.52 175.91 1h5l h GLN 271 N 1.24 0.50 -0.62 6.66 4.15 -1.94 0.21 115.11 125.31 1h5l h GLN 271 Ca 0.35 -0.04 -0.00 0.00 0.77 0.00 0.00 58.65 59.72 1h5l h GLN 271 Cb -0.12 -0.11 -0.03 0.00 0.21 0.00 0.00 27.48 27.44 1h5l h GLN 271 CO -0.08 0.36 0.38 1.15 -1.93 0.00 0.00 178.83 178.71 1h5l h THR 272 N 0.48 1.18 0.24 2.39 2.02 -1.76 -0.50 112.91 116.97 1h5l h THR 272 Ca 0.13 -0.38 -0.01 0.00 0.77 0.00 0.00 66.41 66.92 1h5l h THR 272 Cb -0.01 0.31 0.00 0.00 -1.74 0.00 0.00 68.15 66.72 1h5l h THR 272 CO -0.03 0.18 -0.12 0.15 0.37 0.00 0.00 175.52 176.08 1h5l h PHE 273 N 0.84 -0.30 -0.86 3.16 3.57 -0.85 -2.03 116.94 120.47 1h5l h PHE 273 Ca 0.22 -0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.81 1h5l h PHE 273 Cb -0.04 0.10 -0.07 0.00 2.79 0.00 0.00 35.95 38.73 1h5l h PHE 273 CO -0.02 -0.02 0.51 0.74 -2.23 0.00 0.00 178.31 177.29 1h5l h PHE 274 N -0.58 0.93 -0.37 0.41 -1.00 -0.47 0.33 116.94 116.19 1h5l h PHE 274 Ca -0.03 0.03 -0.02 0.00 2.81 0.00 0.00 57.97 60.76 1h5l h PHE 274 Cb 0.42 -0.29 -0.02 0.00 3.61 0.00 0.00 35.95 39.67 1h5l h PHE 274 CO 0.01 0.40 0.15 -0.91 -1.61 0.00 0.00 178.31 176.35 1h5l h ASN 275 N 0.86 0.51 -0.46 2.17 2.35 -1.06 -1.52 115.58 118.44 1h5l h ASN 275 Ca 0.41 -0.16 -0.07 0.00 -0.55 0.00 0.00 56.30 55.92 1h5l h ASN 275 Cb 0.33 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.55 1h5l h ASN 275 CO -0.23 0.53 0.03 0.00 -1.65 0.00 0.00 177.43 176.11 1h5l h ALA 276 N 1.00 1.08 -0.43 -0.83 0.00 -0.55 -1.69 119.26 117.84 1h5l h ALA 276 Ca 0.12 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.70 1h5l h ALA 276 Cb 0.18 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1h5l h ALA 276 CO -0.01 0.59 -0.03 0.35 0.00 0.00 0.00 179.25 180.14 1h5l h PHE 277 N 0.80 0.85 -0.48 0.00 3.57 -0.14 -0.14 116.94 121.40 1h5l h PHE 277 Ca 0.16 -0.16 -0.07 0.00 3.53 0.00 0.00 57.97 61.43 1h5l h PHE 277 Cb 0.44 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.94 1h5l h PHE 277 CO 0.02 0.86 0.04 0.28 -2.23 0.00 0.00 178.31 177.28 1h5l h VAL 278 N 0.61 1.26 -0.34 1.41 2.07 -1.14 0.22 116.25 120.33 1h5l h VAL 278 Ca 0.12 -0.99 0.00 0.00 0.82 0.00 0.00 66.70 66.64 1h5l h VAL 278 Cb 0.54 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 31.26 1h5l h VAL 278 CO 0.03 0.35 0.21 -0.08 0.02 0.00 0.00 177.57 178.10 1h5l h GLU 279 N 0.68 0.45 -0.30 1.57 4.81 -1.17 -1.17 114.58 119.46 1h5l h GLU 279 Ca 0.14 -0.04 -0.15 0.00 -0.13 0.00 0.00 59.36 59.18 1h5l h GLU 279 Cb 0.45 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 1h5l h GLU 279 CO 0.02 0.33 -0.42 0.00 -0.73 0.00 0.00 179.01 178.20 1h5l h ALA 280 N 1.10 0.68 -0.83 2.92 0.00 -0.88 -2.35 119.26 119.91 1h5l h ALA 280 Ca 0.12 -0.46 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 1h5l h ALA 280 Cb -0.02 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.62 1h5l h ALA 280 CO -0.02 0.67 0.46 0.52 0.00 0.00 0.00 179.25 180.87 1h5l h MET 281 N 0.61 1.15 -0.07 0.00 2.86 -0.33 0.19 114.93 119.35 1h5l h MET 281 Ca 0.04 -0.13 -0.12 0.00 -2.06 0.00 0.00 59.70 57.43 1h5l h MET 281 Cb 0.98 -0.23 -0.01 0.00 0.06 0.00 0.00 31.60 32.40 1h5l h MET 281 CO 0.09 0.84 -0.52 -0.44 1.06 0.00 0.00 176.91 177.94 1h5l h ASP 282 N 1.15 0.20 -0.31 1.22 3.32 -1.11 -0.04 116.42 120.85 1h5l h ASP 282 Ca 0.29 -0.10 -0.11 0.00 0.02 0.00 0.00 57.03 57.13 1h5l h ASP 282 Cb 0.02 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 1h5l h ASP 282 CO -0.05 0.69 -0.23 0.03 -1.72 0.00 0.00 179.24 177.96 1h5l h ARG 283 N 0.14 0.70 -0.56 3.56 3.08 -0.88 -2.33 114.38 118.10 1h5l h ARG 283 Ca 0.00 -0.34 -0.07 0.00 0.07 0.00 0.00 59.98 59.64 1h5l h ARG 283 Cb 0.97 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.00 1h5l h ARG 283 CO 0.08 0.95 0.08 1.98 -1.07 0.00 0.00 179.97 181.99 1h5l h MET 284 N 0.46 0.90 0.00 0.04 4.05 -0.79 -1.63 114.93 117.96 1h5l h MET 284 Ca 0.06 -0.22 0.00 0.00 -0.28 0.00 0.00 59.70 59.26 1h5l h MET 284 Cb 0.79 -0.12 0.00 0.00 -0.80 0.00 0.00 31.60 31.47 1h5l h MET 284 CO 0.06 0.84 0.00 0.41 0.23 0.00 0.00 176.91 178.45 1h5l n GLY 285 N -0.71 -0.91 1.21 1.39 0.00 -0.04 -2.36 105.19 103.77 1h5l n GLY 285 Ca 0.04 -0.07 0.11 0.00 0.00 0.00 0.00 46.02 46.09 1h5l n GLY 285 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1h5l n ASN 286 N -1.37 3.73 -4.66 1.61 4.05 -0.62 -4.82 115.26 113.20 1h5l n ASN 286 Ca 0.06 -1.99 -0.43 0.00 0.45 0.00 0.00 54.58 52.67 1h5l n ASN 286 Cb 0.15 -0.42 -0.02 0.00 1.23 0.00 0.00 39.78 40.71 1h5l n ASN 286 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 1h5l s ILE 287 N -1.04 4.09 -0.29 -1.44 1.01 -0.99 -4.35 121.20 118.19 1h5l s ILE 287 Ca 0.44 1.30 -0.07 0.00 0.00 0.00 0.00 60.65 62.32 1h5l s ILE 287 Cb 0.23 -3.88 0.01 0.00 0.01 0.00 0.00 42.46 38.83 1h5l s ILE 287 CO 0.30 -0.15 0.17 0.35 0.00 0.00 0.00 174.94 175.61 1h5l n THR 288 N 5.51 -0.69 -2.58 2.92 -2.24 -1.26 -2.98 114.28 112.96 1h5l n THR 288 Ca 0.15 -0.12 -0.33 0.00 -2.27 0.00 0.00 64.05 61.48 1h5l n THR 288 Cb 0.45 -0.59 -0.05 0.00 -2.10 0.00 0.00 70.33 68.04 1h5l n THR 288 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1h5l s PRO 289 N -5.07 3.99 -0.01 -0.78 0.04 -1.26 -4.51 135.00 127.40 1h5l s PRO 289 Ca 0.10 1.13 -0.19 0.00 0.04 0.00 0.00 61.00 62.08 1h5l s PRO 289 Cb -0.06 -2.14 -0.05 0.00 0.04 0.00 0.00 34.50 32.29 1h5l s PRO 289 CO 0.24 -0.24 0.53 -0.51 0.04 0.00 0.00 177.00 177.06 1h5l s LEU 290 N -3.60 4.43 0.29 -3.56 1.43 -1.26 -4.97 118.68 111.43 1h5l s LEU 290 Ca 0.62 1.07 0.05 0.00 -1.03 0.00 0.00 54.13 54.84 1h5l s LEU 290 Cb -0.11 -2.80 -0.03 0.00 0.03 0.00 0.00 46.19 43.27 1h5l s LEU 290 CO 0.22 0.17 0.24 0.42 0.23 0.00 0.00 176.35 177.62 1h5l s THR 291 N -0.42 0.00 0.00 5.49 -4.23 -1.26 -0.28 115.64 114.93 1h5l s THR 291 Ca 0.28 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.79 1h5l s THR 291 Cb -0.18 -2.50 0.00 0.00 1.34 0.00 0.00 72.50 71.16 1h5l s THR 291 CO 0.15 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.84 1h5l n GLY 292 N -0.52 1.27 0.54 3.99 0.00 -1.26 -1.22 105.19 107.98 1h5l n GLY 292 Ca 0.06 0.34 0.06 0.00 0.00 0.00 0.00 46.02 46.48 1h5l n GLY 292 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1h5l n THR 293 N 0.00 0.43 -2.52 2.61 -2.24 -1.26 -5.00 114.28 106.30 1h5l n THR 293 Ca 0.00 -0.71 -0.40 0.00 -2.27 0.00 0.00 64.05 60.66 1h5l n THR 293 Cb 0.00 0.92 -0.04 0.00 -2.10 0.00 0.00 70.33 69.11 1h5l n THR 293 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1h5l s GLN 294 N -0.97 4.65 2.40 -0.78 -0.21 -0.36 -4.82 119.66 119.58 1h5l s GLN 294 Ca 0.18 1.74 0.00 0.00 0.02 0.00 0.00 55.36 57.30 1h5l s GLN 294 Cb 0.11 -3.23 0.00 0.00 1.00 0.00 0.00 33.01 30.89 1h5l s GLN 294 CO 0.15 0.21 0.00 0.41 -2.12 0.00 0.00 175.29 173.94 1h5l n GLY 295 N 1.48 -0.28 3.37 3.09 0.00 -1.26 -4.37 105.19 107.21 1h5l n GLY 295 Ca -0.00 -1.04 -0.22 0.00 0.00 0.00 0.00 46.02 44.75 1h5l n GLY 295 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1h5l n GLN 296 N -0.29 0.47 -3.55 1.61 6.02 -0.75 -4.86 117.38 116.03 1h5l n GLN 296 Ca 0.00 -3.49 -0.41 0.00 -0.01 0.00 0.00 57.00 53.09 1h5l n GLN 296 Cb 0.00 2.49 -0.07 0.00 1.02 0.00 0.00 30.24 33.68 1h5l n GLN 296 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1h5l s ILE 297 N -3.30 4.44 0.25 5.09 -1.09 -1.26 -0.30 121.20 125.02 1h5l s ILE 297 Ca 0.34 -2.38 -0.31 0.00 -2.23 0.00 0.00 60.65 56.07 1h5l s ILE 297 Cb 0.02 -3.85 -0.11 0.00 -1.58 0.00 0.00 42.46 36.94 1h5l s ILE 297 CO 0.24 -0.88 1.58 -0.60 -1.23 0.00 0.00 174.94 174.05 1h5l s ARG 298 N 0.53 4.17 -0.01 2.79 3.52 -1.26 -4.93 118.95 123.76 1h5l s ARG 298 Ca 0.13 2.49 -0.04 0.00 -0.13 0.00 0.00 55.73 58.17 1h5l s ARG 298 Cb -0.20 -3.07 -0.28 0.00 -1.56 0.00 0.00 34.95 29.84 1h5l s ARG 298 CO -0.04 -0.60 0.79 -0.07 -0.81 0.00 0.00 175.30 174.57 1h5l h LEU 299 N 5.58 0.43 -7.93 -0.88 3.38 -1.95 -3.42 115.31 110.54 1h5l h LEU 299 Ca -0.45 -0.62 -0.67 0.00 0.09 0.00 0.00 57.88 56.23 1h5l h LEU 299 Cb 1.21 -0.14 -0.36 0.00 0.09 0.00 0.00 40.66 41.46 1h5l h LEU 299 CO 0.84 1.52 -0.82 0.21 0.09 0.00 0.00 178.44 180.29 1h5l s ASN 300 N -7.02 3.93 0.58 -0.43 3.84 -1.26 -4.91 114.94 109.67 1h5l s ASN 300 Ca -0.11 -1.11 0.37 0.00 0.21 0.00 0.00 52.86 52.22 1h5l s ASN 300 Cb 0.07 -1.50 2.04 0.00 -0.55 0.00 0.00 41.25 41.30 1h5l s ASN 300 CO 0.85 -0.12 2.14 0.00 -2.79 0.00 0.00 177.10 177.18 1h5l h ARG 302 N 0.00 0.00 -3.90 0.00 3.08 -1.95 -3.29 114.38 108.32 1h5l h ARG 302 Ca 0.00 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.88 1h5l h ARG 302 Cb 0.08 0.00 -0.21 0.00 0.08 0.00 0.00 29.97 29.92 1h5l h ARG 302 CO 0.00 0.00 -0.67 0.14 -1.07 0.00 0.00 179.97 178.37 1h5l s VAL 303 N -3.18 0.10 0.40 2.04 -7.23 -0.78 -1.19 120.40 110.56 1h5l s VAL 303 Ca 0.07 -0.82 -0.25 0.00 -1.81 0.00 0.00 61.98 59.17 1h5l s VAL 303 Cb 0.09 -0.27 -0.08 0.00 0.56 0.00 0.00 36.38 36.68 1h5l s VAL 303 CO 0.66 -0.45 1.15 -0.69 -0.31 0.00 0.00 175.10 175.46 1h5l s VAL 304 N -1.36 3.26 0.51 1.32 1.01 -1.26 -4.47 120.40 119.41 1h5l s VAL 304 Ca -0.15 1.04 -0.22 0.00 0.00 0.00 0.00 61.98 62.65 1h5l s VAL 304 Cb -0.09 -3.58 -0.06 0.00 0.00 0.00 0.00 36.38 32.66 1h5l s VAL 304 CO -0.01 0.08 1.31 0.20 0.00 0.00 0.00 175.10 176.69 1h5l s ASN 305 N -1.21 5.58 0.00 3.32 0.01 -1.26 -5.05 114.94 116.33 1h5l s ASN 305 Ca 0.57 2.66 0.00 0.00 -0.71 0.00 0.00 52.86 55.38 1h5l s ASN 305 Cb -0.29 -2.63 0.00 0.00 0.41 0.00 0.00 41.25 38.74 1h5l s ASN 305 CO 0.37 -1.35 0.42 -1.54 -1.51 0.00 0.00 177.10 173.48