#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y2m s SER 27 N 0.00 7.22 0.00 0.00 0.15 -1.26 -4.91 113.70 114.90 1y2m s SER 27 Ca 0.00 2.23 0.25 0.00 0.70 0.00 0.00 55.95 59.13 1y2m s SER 27 Cb 0.00 -2.62 0.58 0.00 -1.71 0.00 0.00 66.02 62.27 1y2m s SER 27 CO 0.00 -0.21 1.48 0.35 1.20 0.00 0.00 173.24 176.05 1y2m n THR 28 N 1.71 0.09 -2.29 6.45 -2.24 -1.26 -4.68 114.28 112.06 1y2m n THR 28 Ca 0.01 -0.43 -0.43 0.00 -2.27 0.00 0.00 64.05 60.93 1y2m n THR 28 Cb 0.45 0.96 -0.02 0.00 -2.10 0.00 0.00 70.33 69.62 1y2m n THR 28 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1y2m s ASN 29 N -1.89 6.58 0.52 3.42 3.84 -1.26 -4.91 114.94 121.25 1y2m s ASN 29 Ca 0.33 1.44 0.20 0.00 0.21 0.00 0.00 52.86 55.05 1y2m s ASN 29 Cb 0.20 -2.54 1.38 0.00 -0.55 0.00 0.00 41.25 39.74 1y2m s ASN 29 CO 0.31 -1.12 2.14 -0.07 -2.79 0.00 0.00 177.10 175.58 1y2m h LEU 30 N 11.07 0.00 -2.17 3.21 3.38 -1.89 0.16 115.31 129.07 1y2m h LEU 30 Ca -0.29 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.67 1y2m h LEU 30 Cb 1.12 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.87 1y2m h LEU 30 CO 1.01 0.04 -0.03 0.00 0.09 0.00 0.00 178.44 179.56 1y2m h ALA 31 N 1.96 1.70 0.07 1.53 0.00 -1.89 0.58 119.26 123.20 1y2m h ALA 31 Ca -0.00 -0.03 -0.22 0.00 0.00 0.00 0.00 54.91 54.67 1y2m h ALA 31 Cb 0.08 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1y2m h ALA 31 CO 0.01 0.04 -1.13 0.28 0.00 0.00 0.00 179.25 178.44 1y2m h VAL 32 N 0.00 1.14 0.00 0.00 2.07 -1.14 -3.36 116.25 114.96 1y2m h VAL 32 Ca -0.00 -2.34 -0.01 0.00 0.82 0.00 0.00 66.70 65.18 1y2m h VAL 32 Cb 0.06 2.71 -0.00 0.00 -1.52 0.00 0.00 31.29 32.54 1y2m h VAL 32 CO 0.00 0.59 -0.25 0.00 0.02 0.00 0.00 177.57 177.93 1y2m h ALA 33 N -0.15 0.87 -1.31 1.67 0.00 -0.51 -3.45 119.26 116.38 1y2m h ALA 33 Ca -0.26 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1y2m h ALA 33 Cb 1.51 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.30 1y2m h ALA 33 CO -0.02 0.04 0.00 0.41 0.00 0.00 0.00 179.25 179.68 1y2m n GLY 34 N 1.13 -1.17 3.18 0.00 0.00 0.20 -3.32 105.19 105.20 1y2m n GLY 34 Ca 0.03 -1.12 -0.13 0.00 0.00 0.00 0.00 46.02 44.81 1y2m n GLY 34 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1y2m s SER 35 N -4.00 -0.32 0.29 1.61 0.15 -1.14 -4.74 113.70 105.54 1y2m s SER 35 Ca 0.00 0.62 0.25 0.00 0.70 0.00 0.00 55.95 57.52 1y2m s SER 35 Cb 0.00 0.60 0.75 0.00 -1.71 0.00 0.00 66.02 65.67 1y2m s SER 35 CO 0.00 -0.12 1.74 0.45 1.20 0.00 0.00 173.24 176.51 1y2m h HIS 36 N 5.93 0.00 -2.82 3.44 3.86 -1.85 -3.10 115.15 120.61 1y2m h HIS 36 Ca -0.28 0.00 -0.57 0.00 -1.16 0.00 0.00 60.37 58.35 1y2m h HIS 36 Cb 1.19 0.00 -0.16 0.00 1.06 0.00 0.00 27.41 29.49 1y2m h HIS 36 CO 0.39 0.00 -0.78 -0.51 0.86 0.00 0.00 177.93 177.89 1y2m s LEU 37 N -5.00 2.51 0.24 2.43 1.43 -1.26 -4.92 118.68 114.11 1y2m s LEU 37 Ca 0.09 -0.95 -0.31 0.00 -1.03 0.00 0.00 54.13 51.92 1y2m s LEU 37 Cb 0.10 -0.98 -0.13 0.00 0.03 0.00 0.00 46.19 45.21 1y2m s LEU 37 CO 0.59 0.01 1.45 -2.65 0.23 0.00 0.00 176.35 175.97 1y2m n PRO 38 N -0.15 2.13 -3.65 1.29 -0.02 -1.26 -4.99 135.00 128.36 1y2m n PRO 38 Ca -0.09 0.76 -0.14 0.00 -2.02 0.00 0.00 63.50 62.01 1y2m n PRO 38 Cb 0.58 -2.45 -0.08 0.00 -0.02 0.00 0.00 33.50 31.54 1y2m n PRO 38 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 1y2m s THR 39 N 0.05 0.00 -1.37 3.45 -1.32 -1.26 -4.93 115.64 110.25 1y2m s THR 39 Ca 0.69 -0.00 0.25 0.00 -1.21 0.00 0.00 61.69 61.42 1y2m s THR 39 Cb -0.63 -0.92 0.41 0.00 -1.51 0.00 0.00 72.50 69.85 1y2m s THR 39 CO 0.48 -0.00 1.85 0.35 -2.21 0.00 0.00 174.62 175.09 1y2m n THR 40 N 2.69 0.20 0.67 5.08 -2.24 -1.26 -3.38 114.28 116.04 1y2m n THR 40 Ca -0.14 0.05 0.10 0.00 -2.27 0.00 0.00 64.05 61.79 1y2m n THR 40 Cb 0.55 -0.63 0.44 0.00 -2.10 0.00 0.00 70.33 68.59 1y2m n THR 40 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1y2m n GLN 41 N -1.31 0.04 -3.79 -0.78 6.02 -1.26 -4.80 117.38 111.50 1y2m n GLN 41 Ca 0.11 0.18 -0.12 0.00 -0.01 0.00 0.00 57.00 57.16 1y2m n GLN 41 Cb 0.21 -1.56 -0.08 0.00 1.02 0.00 0.00 30.24 29.83 1y2m n GLN 41 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1y2m s VAL 42 N -3.04 0.08 0.20 5.09 0.11 -1.22 -4.89 120.40 116.74 1y2m s VAL 42 Ca 0.09 -0.63 0.04 0.00 -2.93 0.00 0.00 61.98 58.55 1y2m s VAL 42 Cb 0.13 -0.72 -0.05 0.00 -1.53 0.00 0.00 36.38 34.21 1y2m s VAL 42 CO 0.39 -0.35 -0.05 0.42 -3.33 0.00 0.00 175.10 172.18 1y2m s THR 43 N -1.86 1.16 0.17 5.04 -4.23 -1.26 -4.82 115.64 109.84 1y2m s THR 43 Ca -0.10 -2.06 -0.14 0.00 -1.18 0.00 0.00 61.69 58.21 1y2m s THR 43 Cb -0.04 -2.16 0.07 0.00 1.34 0.00 0.00 72.50 71.71 1y2m s THR 43 CO 0.01 -0.48 1.81 -0.61 -0.54 0.00 0.00 174.62 174.80 1y2m h GLN 44 N 2.57 0.74 -0.60 3.99 4.15 -1.99 -1.52 115.11 122.45 1y2m h GLN 44 Ca -0.38 -0.06 0.11 0.00 0.77 0.00 0.00 58.65 59.09 1y2m h GLN 44 Cb 1.21 -0.16 -0.08 0.00 0.21 0.00 0.00 27.48 28.66 1y2m h GLN 44 CO 0.64 0.53 0.14 0.28 -1.93 0.00 0.00 178.83 178.49 1y2m h VAL 45 N 0.74 0.65 -0.54 2.39 2.07 -1.97 0.15 116.25 119.74 1y2m h VAL 45 Ca 0.20 -0.09 0.06 0.00 0.82 0.00 0.00 66.70 67.68 1y2m h VAL 45 Cb -0.02 0.36 -0.05 0.00 -1.52 0.00 0.00 31.29 30.06 1y2m h VAL 45 CO -0.04 0.05 0.25 0.44 0.02 0.00 0.00 177.57 178.29 1y2m h ASP 46 N 0.27 0.33 -0.33 0.57 3.32 -1.79 0.11 116.42 118.90 1y2m h ASP 46 Ca 0.31 0.04 -0.04 0.00 0.02 0.00 0.00 57.03 57.36 1y2m h ASP 46 Cb 0.46 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.98 1y2m h ASP 46 CO -0.39 0.23 0.06 0.40 -1.72 0.00 0.00 179.24 177.81 1y2m h ILE 47 N 0.48 1.23 -0.30 0.35 2.04 -0.64 -2.40 117.51 118.28 1y2m h ILE 47 Ca 0.25 -0.81 0.02 0.00 1.00 0.00 0.00 64.86 65.32 1y2m h ILE 47 Cb 0.20 1.12 -0.03 0.00 -0.74 0.00 0.00 36.82 37.37 1y2m h ILE 47 CO -0.20 0.27 0.13 0.58 0.00 0.00 0.00 178.15 178.94 1y2m h VAL 48 N 0.38 0.97 -0.56 1.67 2.07 -0.45 -2.89 116.25 117.43 1y2m h VAL 48 Ca 0.10 -0.10 0.09 0.00 0.82 0.00 0.00 66.70 67.61 1y2m h VAL 48 Cb 0.34 0.66 -0.07 0.00 -1.52 0.00 0.00 31.29 30.70 1y2m h VAL 48 CO 0.01 0.05 0.19 -0.08 0.02 0.00 0.00 177.57 177.75 1y2m h GLU 49 N 0.28 0.35 -1.22 1.57 4.81 -0.68 -0.46 114.58 119.22 1y2m h GLU 49 Ca 0.13 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 1y2m h GLU 49 Cb 0.06 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.36 1y2m h GLU 49 CO -0.10 0.23 0.00 1.17 -0.73 0.00 0.00 179.01 179.58 1y2m n LYS 50 N -5.03 0.27 0.00 1.92 3.00 -0.91 -1.94 118.16 115.47 1y2m n LYS 50 Ca 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.38 1y2m n LYS 50 Cb 0.25 -1.28 0.00 0.00 0.00 0.00 0.00 35.03 34.00 1y2m n LYS 50 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1y2m n LEU 52 N 0.69 0.00 -0.37 3.14 4.77 -0.18 -2.96 117.00 122.09 1y2m n LEU 52 Ca 0.00 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 56.11 1y2m n LEU 52 Cb 0.11 0.00 0.40 0.00 -2.33 0.00 0.00 43.42 41.60 1y2m n LEU 52 CO 0.00 0.00 0.71 0.00 -1.33 0.00 0.00 177.39 176.77 1y2m n ALA 53 N 0.00 2.91 -1.66 -1.18 0.00 -0.82 -4.92 120.51 114.84 1y2m n ALA 53 Ca 0.00 -0.44 -0.47 0.00 0.00 0.00 0.00 53.44 52.53 1y2m n ALA 53 Cb 0.00 -1.12 -0.05 0.00 0.00 0.00 0.00 19.45 18.29 1y2m n ALA 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1y2m n ALA 54 N -0.26 0.91 -1.75 0.00 0.00 -1.16 -4.92 120.51 113.34 1y2m n ALA 54 Ca 0.14 0.45 -0.38 0.00 0.00 0.00 0.00 53.44 53.66 1y2m n ALA 54 Cb 0.37 -2.31 0.04 0.00 0.00 0.00 0.00 19.45 17.55 1y2m n ALA 54 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1y2m s PRO 55 N 1.04 3.02 -0.00 0.00 0.02 -1.26 -4.95 135.00 132.87 1y2m s PRO 55 Ca 0.81 2.13 0.10 0.00 0.02 0.00 0.00 61.00 64.05 1y2m s PRO 55 Cb -0.73 -2.13 -0.11 0.00 0.02 0.00 0.00 34.50 31.54 1y2m s PRO 55 CO 0.40 -1.25 0.38 0.25 -0.33 0.00 0.00 177.00 176.45 1y2m n THR 56 N -1.26 0.00 -0.08 0.99 -2.24 -1.26 -4.81 114.28 105.61 1y2m n THR 56 Ca 0.12 -0.27 -0.16 0.00 -2.27 0.00 0.00 64.05 61.48 1y2m n THR 56 Cb 0.46 0.90 -0.06 0.00 -2.10 0.00 0.00 70.33 69.53 1y2m n THR 56 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1y2m n ASP 57 N -1.31 1.56 -4.77 3.42 9.92 -1.26 -3.90 116.55 120.21 1y2m n ASP 57 Ca 0.01 0.13 -0.36 0.00 -0.53 0.00 0.00 54.79 54.04 1y2m n ASP 57 Cb 0.16 -0.41 0.01 0.00 -0.64 0.00 0.00 41.12 40.24 1y2m n ASP 57 CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 1y2m s SER 58 N -6.20 5.63 0.15 -2.24 1.04 -1.26 -4.58 113.70 106.24 1y2m s SER 58 Ca -0.22 2.28 -0.31 0.00 0.48 0.00 0.00 55.95 58.18 1y2m s SER 58 Cb 0.08 -2.59 -0.08 0.00 0.10 0.00 0.00 66.02 63.52 1y2m s SER 58 CO 0.30 -1.28 1.34 -0.89 0.98 0.00 0.00 173.24 173.69 1y2m s THR 59 N -1.67 3.30 -0.38 2.02 2.01 -1.26 -4.57 115.64 115.09 1y2m s THR 59 Ca 0.73 0.99 -0.29 0.00 0.31 0.00 0.00 61.69 63.43 1y2m s THR 59 Cb -0.27 -3.63 0.01 0.00 0.01 0.00 0.00 72.50 68.62 1y2m s THR 59 CO 0.31 0.11 1.26 -0.22 -0.69 0.00 0.00 174.62 175.38 1y2m s LEU 60 N 0.54 3.74 -0.26 4.42 2.96 0.30 -4.94 118.68 125.43 1y2m s LEU 60 Ca 0.61 0.87 -0.17 0.00 -0.22 0.00 0.00 54.13 55.21 1y2m s LEU 60 Cb -0.36 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 42.75 1y2m s LEU 60 CO 0.34 -1.20 0.47 -1.61 -1.32 0.00 0.00 176.35 173.03 1y2m s GLU 61 N 4.39 4.06 -0.19 1.98 2.02 -1.26 -1.19 118.70 128.52 1y2m s GLU 61 Ca 0.54 0.25 -0.18 0.00 0.02 0.00 0.00 54.97 55.60 1y2m s GLU 61 Cb -0.12 -3.64 -0.04 0.00 0.10 0.00 0.00 34.13 30.43 1y2m s GLU 61 CO 0.27 -0.31 0.48 -0.51 0.02 0.00 0.00 175.26 175.21 1y2m s LEU 62 N 2.18 4.17 0.00 1.80 1.43 0.91 -4.69 118.68 124.47 1y2m s LEU 62 Ca 0.20 0.66 0.00 0.00 -1.03 0.00 0.00 54.13 53.95 1y2m s LEU 62 Cb -0.16 -2.66 0.00 0.00 0.03 0.00 0.00 46.19 43.41 1y2m s LEU 62 CO 0.09 -0.13 0.62 -0.90 0.23 0.00 0.00 176.35 176.27 1y2m n ASP 63 N 4.55 1.17 0.00 2.29 5.68 -1.26 -0.37 116.55 128.62 1y2m n ASP 63 Ca -0.06 -1.35 0.00 0.00 -0.50 0.00 0.00 54.79 52.88 1y2m n ASP 63 Cb 0.51 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.49 1y2m n ASP 63 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1y2m n GLY 64 N -0.18 1.11 0.00 6.12 0.00 -1.26 -4.76 105.19 106.22 1y2m n GLY 64 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1y2m n GLY 64 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1y2m n TYR 65 N -2.00 0.00 0.71 1.61 4.01 -1.21 -4.26 117.16 116.03 1y2m n TYR 65 Ca 0.00 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.86 1y2m n TYR 65 Cb 0.00 0.00 0.21 0.00 -0.31 0.00 0.00 39.34 39.24 1y2m n TYR 65 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 1y2m n SER 66 N -0.93 0.61 -4.70 7.72 7.64 -1.26 -3.71 113.62 118.98 1y2m n SER 66 Ca 0.00 0.03 -0.42 0.00 1.01 0.00 0.00 58.87 59.49 1y2m n SER 66 Cb 0.07 0.17 -0.03 0.00 -1.01 0.00 0.00 64.21 63.41 1y2m n SER 66 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 1y2m s LEU 67 N -3.82 4.37 0.47 -3.43 2.96 -1.26 -4.85 118.68 113.12 1y2m s LEU 67 Ca 0.08 2.55 0.05 0.00 -0.22 0.00 0.00 54.13 56.59 1y2m s LEU 67 Cb 0.15 -3.58 -0.03 0.00 0.50 0.00 0.00 46.19 43.23 1y2m s LEU 67 CO 0.71 -0.85 0.14 0.54 -1.32 0.00 0.00 176.35 175.57 1y2m s ASN 68 N 1.74 4.29 0.20 3.68 2.20 -1.26 -4.13 114.94 121.65 1y2m s ASN 68 Ca 0.72 -1.33 -0.05 0.00 -0.94 0.00 0.00 52.86 51.26 1y2m s ASN 68 Cb -0.42 0.01 0.14 0.00 -2.00 0.00 0.00 41.25 38.98 1y2m s ASN 68 CO 0.32 -0.73 1.57 -0.07 -2.94 0.00 0.00 177.10 175.24 1y2m h LEU 69 N 1.32 0.74 -0.86 3.54 3.38 -1.92 -2.16 115.31 119.36 1y2m h LEU 69 Ca -0.42 -0.32 0.07 0.00 0.09 0.00 0.00 57.88 57.30 1y2m h LEU 69 Cb 1.28 -0.21 -0.07 0.00 0.09 0.00 0.00 40.66 41.76 1y2m h LEU 69 CO 0.70 1.04 0.52 1.23 0.09 0.00 0.00 178.44 182.02 1y2m h GLY 70 N 0.96 1.31 0.97 0.83 0.00 -1.95 -2.03 103.07 103.16 1y2m h GLY 70 Ca 0.06 -0.37 0.00 0.00 0.00 0.00 0.00 47.33 47.02 1y2m h GLY 70 CO 0.08 0.22 0.09 -0.55 0.00 0.00 0.00 176.54 176.38 1y2m h ASP 71 N 0.92 0.16 -0.39 0.19 3.32 -1.85 -1.43 116.42 117.33 1y2m h ASP 71 Ca 0.39 -0.00 0.06 0.00 0.02 0.00 0.00 57.03 57.50 1y2m h ASP 71 Cb 0.24 -0.03 -0.05 0.00 0.22 0.00 0.00 39.33 39.70 1y2m h ASP 71 CO -0.20 0.12 0.06 0.58 -1.72 0.00 0.00 179.24 178.08 1y2m h VAL 72 N 0.20 0.78 -0.79 -1.35 2.07 -0.99 -1.64 116.25 114.54 1y2m h VAL 72 Ca 0.06 -0.06 -0.03 0.00 0.82 0.00 0.00 66.70 67.49 1y2m h VAL 72 Cb -0.01 0.58 -0.04 0.00 -1.52 0.00 0.00 31.29 30.30 1y2m h VAL 72 CO -0.02 0.03 0.38 0.58 0.02 0.00 0.00 177.57 178.56 1y2m h VAL 73 N 0.19 1.25 -1.00 2.57 2.07 -1.20 0.10 116.25 120.24 1y2m h VAL 73 Ca 0.19 -0.70 0.01 0.00 0.82 0.00 0.00 66.70 67.02 1y2m h VAL 73 Cb 0.23 0.26 -0.05 0.00 -1.52 0.00 0.00 31.29 30.21 1y2m h VAL 73 CO -0.26 0.30 0.66 0.77 0.02 0.00 0.00 177.57 179.06 1y2m h SER 74 N 1.11 1.14 -0.16 0.57 4.64 -0.72 0.53 113.55 120.66 1y2m h SER 74 Ca 0.27 -0.03 -0.15 0.00 -0.47 0.00 0.00 61.79 61.42 1y2m h SER 74 Cb 0.12 -0.29 0.00 0.00 -0.31 0.00 0.00 62.40 61.93 1y2m h SER 74 CO -0.03 0.83 -0.47 0.00 -0.87 0.00 0.00 176.83 176.29 1y2m h ALA 75 N 1.38 0.27 -0.09 5.18 0.00 -0.98 -1.46 119.26 123.56 1y2m h ALA 75 Ca 0.36 -0.48 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1y2m h ALA 75 Cb -0.16 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 1y2m h ALA 75 CO -0.08 0.43 -0.03 0.00 0.00 0.00 0.00 179.25 179.57 1y2m h ALA 76 N 0.55 0.12 0.00 0.00 0.00 -0.54 -3.34 119.26 116.05 1y2m h ALA 76 Ca -0.01 -0.23 -0.19 0.00 0.00 0.00 0.00 54.91 54.48 1y2m h ALA 76 Cb 1.09 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.81 1y2m h ALA 76 CO 0.10 -0.14 -1.99 0.54 0.00 0.00 0.00 179.25 177.76 1y2m n ARG 77 N -4.77 1.06 -0.12 0.00 1.74 0.15 -4.56 116.66 110.17 1y2m n ARG 77 Ca -0.07 -0.06 0.04 0.00 -0.77 0.00 0.00 57.85 56.99 1y2m n ARG 77 Cb 0.25 -1.41 0.10 0.00 -1.02 0.00 0.00 32.46 30.37 1y2m n ARG 77 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1y2m n LYS 78 N -2.42 2.85 -1.40 5.56 4.76 -0.59 -4.99 118.16 121.94 1y2m n LYS 78 Ca -0.18 -1.91 -0.10 0.00 -2.87 0.00 0.00 58.31 53.24 1y2m n LYS 78 Cb 0.82 -1.21 -0.04 0.00 -1.84 0.00 0.00 35.03 32.76 1y2m n LYS 78 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1y2m n GLY 79 N -0.04 1.04 3.74 0.72 0.00 -1.05 -4.94 105.19 104.66 1y2m n GLY 79 Ca 0.08 -0.55 -0.42 0.00 0.00 0.00 0.00 46.02 45.14 1y2m n GLY 79 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1y2m s ARG 80 N -3.06 4.16 0.59 1.61 3.52 -0.99 -4.95 118.95 119.83 1y2m s ARG 80 Ca 0.00 2.51 -0.20 0.00 -0.13 0.00 0.00 55.73 57.91 1y2m s ARG 80 Cb 0.00 -3.06 -0.03 0.00 -1.56 0.00 0.00 34.95 30.30 1y2m s ARG 80 CO 0.00 -0.61 1.31 -2.30 -0.81 0.00 0.00 175.30 172.90 1y2m n PRO 81 N 2.58 1.44 -4.38 5.12 -0.02 -1.26 -4.65 135.00 133.83 1y2m n PRO 81 Ca 0.09 0.54 -0.20 0.00 -2.02 0.00 0.00 63.50 61.91 1y2m n PRO 81 Cb 0.38 -2.54 -0.15 0.00 -0.02 0.00 0.00 33.50 31.16 1y2m n PRO 81 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1y2m s VAL 82 N -1.33 0.77 0.01 -1.45 1.01 -1.26 -0.54 120.40 117.60 1y2m s VAL 82 Ca 0.76 -0.35 -0.06 0.00 0.00 0.00 0.00 61.98 62.33 1y2m s VAL 82 Cb -0.40 -0.69 -0.00 0.00 0.00 0.00 0.00 36.38 35.29 1y2m s VAL 82 CO 0.46 0.24 0.11 -0.60 0.00 0.00 0.00 175.10 175.31 1y2m s ARG 83 N 0.22 0.46 0.21 2.72 6.06 -0.34 -4.83 118.95 123.46 1y2m s ARG 83 Ca -0.04 -0.46 -0.31 0.00 -2.50 0.00 0.00 55.73 52.42 1y2m s ARG 83 Cb -0.09 0.19 -0.11 0.00 0.06 0.00 0.00 34.95 35.00 1y2m s ARG 83 CO 0.00 -0.11 1.63 0.08 -2.50 0.00 0.00 175.30 174.41 1y2m s VAL 84 N -1.47 2.28 0.22 7.11 1.01 -1.26 -0.06 120.40 128.23 1y2m s VAL 84 Ca -0.14 0.21 -0.31 0.00 0.00 0.00 0.00 61.98 61.74 1y2m s VAL 84 Cb -0.08 -3.13 -0.15 0.00 0.00 0.00 0.00 36.38 33.02 1y2m s VAL 84 CO 0.01 0.02 1.06 1.17 0.00 0.00 0.00 175.10 177.36 1y2m n LYS 85 N 3.66 1.14 -2.60 2.72 4.81 0.50 -4.71 118.16 123.69 1y2m n LYS 85 Ca 0.14 0.40 -0.41 0.00 -0.87 0.00 0.00 58.31 57.57 1y2m n LYS 85 Cb 0.37 -1.82 -0.03 0.00 0.02 0.00 0.00 35.03 33.57 1y2m n LYS 85 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 1y2m s ASP 86 N -0.28 6.45 -0.21 3.14 3.68 -1.26 -4.82 116.67 123.37 1y2m s ASP 86 Ca 0.67 -1.34 -0.17 0.00 2.13 0.00 0.00 52.55 53.85 1y2m s ASP 86 Cb -0.81 -2.55 0.06 0.00 -1.45 0.00 0.00 42.92 38.17 1y2m s ASP 86 CO 0.55 -1.52 0.53 -0.94 0.13 0.00 0.00 175.17 173.93 1y2m s SER 87 N 4.63 -0.60 0.27 -0.34 1.04 -1.26 -5.04 113.70 112.40 1y2m s SER 87 Ca 0.43 1.10 -0.02 0.00 0.48 0.00 0.00 55.95 57.93 1y2m s SER 87 Cb -0.02 1.07 0.35 0.00 0.10 0.00 0.00 66.02 67.52 1y2m s SER 87 CO -0.06 -0.19 1.80 0.44 0.98 0.00 0.00 173.24 176.21 1y2m h ASP 88 N 5.85 0.81 -0.24 7.02 3.32 -1.98 -2.02 116.42 129.17 1y2m h ASP 88 Ca -0.30 -0.16 0.00 0.00 0.02 0.00 0.00 57.03 56.60 1y2m h ASP 88 Cb 1.18 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.51 1y2m h ASP 88 CO 0.19 0.81 0.16 -0.08 -1.72 0.00 0.00 179.24 178.59 1y2m h GLU 89 N 0.83 0.31 -0.33 3.56 4.81 -1.98 0.48 114.58 122.27 1y2m h GLU 89 Ca 0.18 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.34 1y2m h GLU 89 Cb 0.33 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.62 1y2m h GLU 89 CO 0.00 0.21 0.02 0.82 -0.73 0.00 0.00 179.01 179.34 1y2m h ILE 90 N 0.32 1.25 -0.23 2.32 2.04 -1.88 -0.94 117.51 120.39 1y2m h ILE 90 Ca 0.09 -0.91 0.01 0.00 1.00 0.00 0.00 64.86 65.05 1y2m h ILE 90 Cb -0.03 1.19 -0.02 0.00 -0.74 0.00 0.00 36.82 37.22 1y2m h ILE 90 CO -0.02 0.30 0.12 -0.09 0.00 0.00 0.00 178.15 178.46 1y2m h ARG 91 N 0.39 0.25 -0.64 2.37 2.43 -1.15 -1.53 114.38 116.50 1y2m h ARG 91 Ca 0.10 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.21 1y2m h ARG 91 Cb 0.41 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.87 1y2m h ARG 91 CO 0.01 0.17 0.24 1.03 -1.51 0.00 0.00 179.97 179.91 1y2m h SER 92 N 0.26 0.90 -0.21 -3.80 0.87 0.07 -0.45 113.55 111.19 1y2m h SER 92 Ca 0.09 -0.18 0.02 0.00 -1.23 0.00 0.00 61.79 60.49 1y2m h SER 92 Cb 0.01 -0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 61.71 1y2m h SER 92 CO -0.05 0.84 0.05 0.50 -0.53 0.00 0.00 176.83 177.64 1y2m h LYS 93 N 0.91 0.14 0.05 2.24 3.64 -0.91 0.42 116.57 123.06 1y2m h LYS 93 Ca 0.21 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.58 1y2m h LYS 93 Cb 0.23 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 1y2m h LYS 93 CO -0.01 0.09 -0.02 0.82 -2.27 0.00 0.00 179.45 178.06 1y2m h ILE 94 N 0.14 1.03 -0.88 2.00 2.04 -1.16 -2.66 117.51 118.02 1y2m h ILE 94 Ca 0.09 -0.23 0.01 0.00 1.00 0.00 0.00 64.86 65.73 1y2m h ILE 94 Cb 0.08 1.18 -0.04 0.00 -0.74 0.00 0.00 36.82 37.29 1y2m h ILE 94 CO -0.11 0.06 0.58 0.44 0.00 0.00 0.00 178.15 179.12 1y2m h ASP 95 N -0.16 1.00 -0.05 1.72 5.19 -0.81 -2.37 116.42 120.94 1y2m h ASP 95 Ca -0.01 -0.02 -0.08 0.00 -0.62 0.00 0.00 57.03 56.30 1y2m h ASP 95 Cb 0.14 -0.25 -0.01 0.00 0.18 0.00 0.00 39.33 39.39 1y2m h ASP 95 CO 0.01 0.72 -0.19 0.11 -3.12 0.00 0.00 179.24 176.77 1y2m h LYS 96 N 1.18 0.43 -0.24 3.56 1.57 -0.08 -1.60 116.57 121.39 1y2m h LYS 96 Ca 0.33 -0.14 -0.11 0.00 -1.87 0.00 0.00 60.65 58.86 1y2m h LYS 96 Cb -0.12 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.14 1y2m h LYS 96 CO -0.08 0.60 -0.31 0.66 -0.57 0.00 0.00 179.45 179.76 1y2m h SER 97 N 0.39 0.49 -0.31 0.86 4.64 -1.07 -0.36 113.55 118.19 1y2m h SER 97 Ca 0.07 -0.19 -0.05 0.00 -0.47 0.00 0.00 61.79 61.15 1y2m h SER 97 Cb 0.55 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.50 1y2m h SER 97 CO 0.04 0.78 -0.00 0.58 -0.87 0.00 0.00 176.83 177.35 1y2m h VAL 98 N 0.42 1.26 -0.55 0.95 2.07 -1.20 -2.29 116.25 116.91 1y2m h VAL 98 Ca 0.05 -0.96 -0.10 0.00 0.82 0.00 0.00 66.70 66.52 1y2m h VAL 98 Cb 0.75 1.27 -0.02 0.00 -1.52 0.00 0.00 31.29 31.77 1y2m h VAL 98 CO 0.06 0.31 -0.03 -0.08 0.02 0.00 0.00 177.57 177.85 1y2m h GLU 99 N 0.35 0.99 -0.41 1.57 4.57 -1.17 -0.78 114.58 119.69 1y2m h GLU 99 Ca 0.09 -0.33 0.02 0.00 -1.18 0.00 0.00 59.36 57.96 1y2m h GLU 99 Cb 0.45 -0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 28.93 1y2m h GLU 99 CO 0.02 1.00 0.24 0.35 -1.18 0.00 0.00 179.01 179.44 1y2m h PHE 100 N 0.86 0.45 -0.58 0.92 3.57 -1.00 -2.71 116.94 118.45 1y2m h PHE 100 Ca 0.15 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.61 1y2m h PHE 100 Cb 0.58 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 39.15 1y2m h PHE 100 CO 0.04 0.26 0.15 1.25 -2.23 0.00 0.00 178.31 177.78 1y2m h LEU 101 N 0.48 0.87 0.00 0.59 5.85 -1.09 -3.52 115.31 118.50 1y2m h LEU 101 Ca 0.17 -0.23 0.06 0.00 0.84 0.00 0.00 57.88 58.72 1y2m h LEU 101 Cb 0.02 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.80 1y2m h LEU 101 CO -0.08 0.87 -0.08 0.54 -0.34 0.00 0.00 178.44 179.35 1y2m n ARG 102 N -4.39 -0.43 0.00 1.25 1.74 -0.33 -5.12 116.66 109.39 1y2m n ARG 102 Ca 0.03 0.28 0.00 0.00 -0.77 0.00 0.00 57.85 57.39 1y2m n ARG 102 Cb 0.23 -0.52 0.00 0.00 -1.02 0.00 0.00 32.46 31.15 1y2m n ARG 102 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1y2m n THR 124 N -1.59 0.00 -0.36 0.55 -2.24 -1.26 -4.86 114.28 104.52 1y2m n THR 124 Ca 0.00 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 61.82 1y2m n THR 124 Cb 0.10 0.00 0.20 0.00 -2.10 0.00 0.00 70.33 68.53 1y2m n THR 124 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1y2m h GLU 125 N 0.00 1.08 -0.39 -0.78 4.81 -2.02 -1.57 114.58 115.72 1y2m h GLU 125 Ca 0.00 -0.07 0.04 0.00 -0.13 0.00 0.00 59.36 59.20 1y2m h GLU 125 Cb 0.00 -0.24 -0.04 0.00 0.63 0.00 0.00 28.75 29.10 1y2m h GLU 125 CO 0.00 0.72 0.16 0.38 -0.73 0.00 0.00 179.01 179.54 1y2m h ASP 126 N 1.12 0.21 0.10 1.04 2.03 -2.03 -1.15 116.42 117.73 1y2m h ASP 126 Ca 0.45 0.03 -0.17 0.00 -0.73 0.00 0.00 57.03 56.61 1y2m h ASP 126 Cb 0.26 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 38.76 1y2m h ASP 126 CO -0.20 0.16 -0.62 0.00 -1.03 0.00 0.00 179.24 177.55 1y2m h ALA 127 N 1.23 0.65 -0.49 4.15 0.00 -1.88 -0.88 119.26 122.05 1y2m h ALA 127 Ca 0.17 -0.55 0.01 0.00 0.00 0.00 0.00 54.91 54.54 1y2m h ALA 127 Cb 0.13 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1y2m h ALA 127 CO -0.16 0.71 0.32 0.82 0.00 0.00 0.00 179.25 180.94 1y2m h ILE 128 N 0.38 1.12 -0.66 0.00 2.04 -1.18 -2.27 117.51 116.93 1y2m h ILE 128 Ca -0.01 -0.22 -0.01 0.00 1.00 0.00 0.00 64.86 65.62 1y2m h ILE 128 Cb 1.18 0.41 -0.03 0.00 -0.74 0.00 0.00 36.82 37.63 1y2m h ILE 128 CO 0.11 0.12 0.38 0.28 0.00 0.00 0.00 178.15 179.05 1y2m h SER 129 N 0.65 0.81 -0.76 1.72 0.02 -0.85 -2.54 113.55 112.60 1y2m h SER 129 Ca 0.18 -0.07 0.04 0.00 -0.84 0.00 0.00 61.79 61.09 1y2m h SER 129 Cb -0.07 -0.20 -0.05 0.00 0.14 0.00 0.00 62.40 62.22 1y2m h SER 129 CO -0.04 0.65 0.48 0.25 -1.14 0.00 0.00 176.83 177.02 1y2m h LEU 130 N 0.90 0.78 -0.87 5.07 5.85 -0.80 -0.23 115.31 126.01 1y2m h LEU 130 Ca 0.24 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.88 1y2m h LEU 130 Cb -0.00 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 40.84 1y2m h LEU 130 CO -0.04 0.53 0.04 1.56 -0.34 0.00 0.00 178.44 180.19 1y2m h GLN 131 N 0.92 0.88 -0.54 1.25 1.08 -1.18 -1.37 115.11 116.14 1y2m h GLN 131 Ca 0.31 -0.23 -0.08 0.00 -1.45 0.00 0.00 58.65 57.19 1y2m h GLN 131 Cb 0.04 -0.11 -0.02 0.00 -0.05 0.00 0.00 27.48 27.34 1y2m h GLN 131 CO -0.12 0.85 0.01 0.87 -0.95 0.00 0.00 178.83 179.49 1y2m h LYS 132 N 0.82 0.92 -0.81 1.46 1.57 -0.97 -1.90 116.57 117.67 1y2m h LYS 132 Ca 0.16 -0.26 0.01 0.00 -1.87 0.00 0.00 60.65 58.69 1y2m h LYS 132 Cb 0.44 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.61 1y2m h LYS 132 CO 0.02 0.90 0.54 0.00 -0.57 0.00 0.00 179.45 180.33 1y2m h ALA 133 N 1.15 1.43 -0.05 3.86 0.00 -0.61 0.84 119.26 125.88 1y2m h ALA 133 Ca 0.16 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1y2m h ALA 133 Cb 0.49 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 1y2m h ALA 133 CO 0.02 0.53 0.00 -0.07 0.00 0.00 0.00 179.25 179.73 1y2m h LEU 134 N 1.09 0.09 -0.40 0.00 3.38 -0.73 -3.14 115.31 115.60 1y2m h LEU 134 Ca 0.30 -0.30 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 1y2m h LEU 134 Cb -0.12 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 1y2m h LEU 134 CO -0.07 0.37 0.17 -0.07 0.09 0.00 0.00 178.44 178.93 1y2m h LEU 135 N -0.19 0.55 -0.66 1.67 3.38 -1.13 -3.19 115.31 115.73 1y2m h LEU 135 Ca 0.01 -0.16 0.11 0.00 0.09 0.00 0.00 57.88 57.94 1y2m h LEU 135 Cb 0.32 -0.14 -0.12 0.00 0.09 0.00 0.00 40.66 40.81 1y2m h LEU 135 CO 0.00 0.55 -0.36 -0.08 0.09 0.00 0.00 178.44 178.64 1y2m h GLU 136 N 0.50 -0.14 0.00 1.13 4.81 -0.80 0.13 114.58 120.22 1y2m h GLU 136 Ca 0.13 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.37 1y2m h GLU 136 Cb 0.17 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.58 1y2m h GLU 136 CO -0.01 -0.09 -0.04 1.12 -0.73 0.00 0.00 179.01 179.25 1y2m h HIS 137 N -0.14 0.00 0.00 0.92 2.07 -1.57 -3.05 115.15 113.37 1y2m h HIS 137 Ca 0.24 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.76 1y2m h HIS 137 Cb 0.56 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.54 1y2m h HIS 137 CO -0.69 0.04 -0.61 1.04 -3.07 0.00 0.00 177.93 174.64 1y2m n GLN 138 N -3.12 0.08 -2.06 5.12 1.13 -0.07 -4.33 117.38 114.13 1y2m n GLN 138 Ca 0.02 0.01 -0.41 0.00 -1.94 0.00 0.00 57.00 54.68 1y2m n GLN 138 Cb 0.46 -1.54 -0.00 0.00 0.11 0.00 0.00 30.24 29.26 1y2m n GLN 138 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 1y2m n LEU 139 N -1.66 7.27 -0.12 1.08 4.77 -0.59 -4.52 117.00 123.23 1y2m n LEU 139 Ca 0.05 -4.62 0.03 0.00 -0.03 0.00 0.00 56.01 51.44 1y2m n LEU 139 Cb 0.36 -1.48 0.05 0.00 -2.33 0.00 0.00 43.42 40.02 1y2m n LEU 139 CO 0.36 1.60 0.43 0.00 -1.33 0.00 0.00 177.39 178.45 1y2m s GLY 141 N -1.46 1.80 -0.20 0.00 0.00 -1.26 -5.09 107.32 101.10 1y2m s GLY 141 Ca 0.11 -1.69 -0.09 0.00 0.00 0.00 0.00 44.72 43.05 1y2m s GLY 141 CO 0.01 -1.28 0.11 0.14 0.00 0.00 0.00 173.10 172.08 1y2m s VAL 142 N -2.83 5.09 0.05 1.40 1.01 -1.26 -4.95 120.40 118.90 1y2m s VAL 142 Ca 0.61 0.08 -0.02 0.00 0.00 0.00 0.00 61.98 62.65 1y2m s VAL 142 Cb -0.07 -3.33 -0.03 0.00 0.00 0.00 0.00 36.38 32.95 1y2m s VAL 142 CO 0.40 0.42 0.01 -0.76 0.00 0.00 0.00 175.10 175.17 1y2m s LEU 143 N 0.60 2.25 0.34 3.92 1.43 -1.26 -4.53 118.68 121.42 1y2m s LEU 143 Ca 0.06 -0.80 -0.29 0.00 -1.03 0.00 0.00 54.13 52.06 1y2m s LEU 143 Cb -0.12 0.31 -0.11 0.00 0.03 0.00 0.00 46.19 46.29 1y2m s LEU 143 CO 0.01 -0.54 1.53 -0.81 0.23 0.00 0.00 176.35 176.77 1y2m n PRO 144 N 0.49 2.67 0.17 1.29 -0.04 -1.26 -4.90 135.00 133.40 1y2m n PRO 144 Ca -0.17 0.94 0.04 0.00 -0.04 0.00 0.00 63.50 64.27 1y2m n PRO 144 Cb 0.60 -2.69 0.22 0.00 -0.04 0.00 0.00 33.50 31.58 1y2m n PRO 144 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1y2m h SER 145 N 3.82 0.00 -5.12 3.54 4.64 -2.00 -3.47 113.55 114.96 1y2m h SER 145 Ca -0.49 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 60.78 1y2m h SER 145 Cb 1.24 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 63.21 1y2m h SER 145 CO 0.71 0.45 -0.10 -0.55 -0.87 0.00 0.00 176.83 176.47 1y2m s SER 146 N -6.47 -0.17 0.20 4.97 0.15 -1.26 -5.01 113.70 106.12 1y2m s SER 146 Ca 0.01 -0.49 0.22 0.00 0.70 0.00 0.00 55.95 56.38 1y2m s SER 146 Cb 0.10 0.49 0.91 0.00 -1.71 0.00 0.00 66.02 65.81 1y2m s SER 146 CO 0.71 -0.92 1.66 0.49 1.20 0.00 0.00 173.24 176.38 1y2m n PHE 147 N -0.25 0.64 0.30 3.44 3.72 -1.26 -3.34 117.46 120.72 1y2m n PHE 147 Ca -0.12 0.25 0.17 0.00 -0.05 0.00 0.00 57.45 57.70 1y2m n PHE 147 Cb 0.63 -0.91 0.98 0.00 -0.94 0.00 0.00 39.48 39.24 1y2m n PHE 147 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 1y2m h ASP 148 N 0.00 0.00 1.22 4.37 5.19 -2.00 -1.57 116.42 123.63 1y2m h ASP 148 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1y2m h ASP 148 Cb 0.35 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.86 1y2m h ASP 148 CO 0.00 0.00 -0.24 -1.54 -3.12 0.00 0.00 179.24 174.34 1y2m n SER 149 N -3.69 0.74 -4.77 6.45 3.41 -1.21 -4.91 113.62 109.64 1y2m n SER 149 Ca -0.03 0.39 -0.37 0.00 -0.26 0.00 0.00 58.87 58.61 1y2m n SER 149 Cb 0.09 -0.42 -0.02 0.00 -0.26 0.00 0.00 64.21 63.61 1y2m n SER 149 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1y2m s PHE 150 N -3.12 2.93 0.11 7.33 0.40 -0.59 -4.84 117.98 120.20 1y2m s PHE 150 Ca 0.09 1.56 0.01 0.00 -0.60 0.00 0.00 56.93 57.99 1y2m s PHE 150 Cb 0.13 -3.30 -0.04 0.00 0.51 0.00 0.00 43.02 40.31 1y2m s PHE 150 CO 0.64 -1.31 -0.03 1.03 0.70 0.00 0.00 175.22 176.25 1y2m s ARG 151 N -2.76 0.87 -0.23 0.44 1.81 -1.20 -5.01 118.95 112.87 1y2m s ARG 151 Ca 0.64 -1.38 -0.41 0.00 -1.72 0.00 0.00 55.73 52.86 1y2m s ARG 151 Cb -0.26 -0.11 -0.17 0.00 -0.45 0.00 0.00 34.95 33.96 1y2m s ARG 151 CO 0.32 -0.08 1.59 -0.11 -0.68 0.00 0.00 175.30 176.34 1y2m n LEU 152 N -0.07 1.85 -0.01 2.53 7.94 -1.26 -0.95 117.00 127.04 1y2m n LEU 152 Ca -0.10 1.11 -0.00 0.00 -1.11 0.00 0.00 56.01 55.91 1y2m n LEU 152 Cb 0.62 -1.08 -0.00 0.00 0.53 0.00 0.00 43.42 43.48 1y2m n LEU 152 CO 0.31 -0.73 -0.00 0.61 -1.11 0.00 0.00 177.39 176.47 1y2m n GLY 153 N 3.66 0.31 3.27 -3.96 0.00 -1.26 -4.97 105.19 102.23 1y2m n GLY 153 Ca 0.25 -0.01 -0.10 0.00 0.00 0.00 0.00 46.02 46.17 1y2m n GLY 153 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1y2m s ARG 154 N -0.79 1.10 0.00 1.61 1.81 -0.12 -5.01 118.95 117.54 1y2m s ARG 154 Ca 0.00 -1.33 0.00 0.00 -1.72 0.00 0.00 55.73 52.68 1y2m s ARG 154 Cb 0.00 0.32 0.00 0.00 -0.45 0.00 0.00 34.95 34.82 1y2m s ARG 154 CO 0.00 -0.37 0.00 0.41 -0.68 0.00 0.00 175.30 174.66 1y2m n GLY 155 N -0.18 1.27 0.87 -3.53 0.00 -1.26 -3.26 105.19 99.09 1y2m n GLY 155 Ca -0.05 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.05 1y2m n GLY 155 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1y2m n LEU 156 N 0.00 3.83 -0.07 0.99 4.77 -1.26 -4.66 117.00 120.60 1y2m n LEU 156 Ca 0.00 -2.99 0.17 0.00 -0.03 0.00 0.00 56.01 53.16 1y2m n LEU 156 Cb 0.00 -0.53 0.60 0.00 -2.33 0.00 0.00 43.42 41.15 1y2m n LEU 156 CO 0.00 0.68 1.19 -0.33 -1.33 0.00 0.00 177.39 177.60 1y2m h GLU 157 N 1.78 0.20 -0.64 3.23 3.07 -1.99 -0.65 114.58 119.58 1y2m h GLU 157 Ca 0.00 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.85 1y2m h GLU 157 Cb 1.42 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 29.28 1y2m h GLU 157 CO 0.21 0.13 0.00 0.09 -1.40 0.00 0.00 179.01 178.05 1y2m n ASN 158 N -4.43 3.00 -4.49 1.42 3.02 -1.26 -4.87 115.26 107.65 1y2m n ASN 158 Ca 0.12 -2.32 -0.28 0.00 -0.03 0.00 0.00 54.58 52.07 1y2m n ASN 158 Cb 0.55 -0.48 -0.11 0.00 -0.61 0.00 0.00 39.78 39.13 1y2m n ASN 158 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1y2m s SER 159 N -0.61 3.85 0.39 6.41 1.04 -0.25 -0.33 113.70 124.19 1y2m s SER 159 Ca 0.28 -0.64 -0.27 0.00 0.48 0.00 0.00 55.95 55.80 1y2m s SER 159 Cb 0.19 -0.51 -0.09 0.00 0.10 0.00 0.00 66.02 65.71 1y2m s SER 159 CO 0.12 0.15 1.29 -0.76 0.98 0.00 0.00 173.24 175.02 1y2m s LEU 160 N -2.41 4.26 0.56 2.42 1.43 0.43 -4.52 118.68 120.85 1y2m s LEU 160 Ca 0.20 2.63 -0.20 0.00 -1.03 0.00 0.00 54.13 55.73 1y2m s LEU 160 Cb -0.10 -3.85 -0.06 0.00 0.03 0.00 0.00 46.19 42.21 1y2m s LEU 160 CO 0.11 -0.76 1.06 -2.65 0.23 0.00 0.00 176.35 174.34 1y2m n PRO 161 N 0.28 1.14 -0.06 1.29 -0.02 -1.26 -4.76 135.00 131.61 1y2m n PRO 161 Ca 0.03 0.43 -0.03 0.00 -2.02 0.00 0.00 63.50 61.91 1y2m n PRO 161 Cb 0.43 -2.24 0.20 0.00 -0.02 0.00 0.00 33.50 31.88 1y2m n PRO 161 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1y2m h LEU 162 N 0.86 0.65 -1.34 2.45 3.38 -1.94 -1.66 115.31 117.71 1y2m h LEU 162 Ca -0.48 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.32 1y2m h LEU 162 Cb 1.35 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.90 1y2m h LEU 162 CO 0.53 0.74 0.28 1.05 0.09 0.00 0.00 178.44 181.13 1y2m h GLU 163 N 0.63 0.72 -0.54 1.13 4.11 -1.90 -0.93 114.58 117.81 1y2m h GLU 163 Ca 0.12 -0.08 -0.08 0.00 0.07 0.00 0.00 59.36 59.40 1y2m h GLU 163 Cb 0.45 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 1y2m h GLU 163 CO 0.02 0.54 0.02 0.28 0.07 0.00 0.00 179.01 179.94 1y2m h VAL 164 N 0.73 1.26 -0.42 -1.06 2.07 -1.64 -1.42 116.25 115.77 1y2m h VAL 164 Ca 0.19 -1.08 -0.14 0.00 0.82 0.00 0.00 66.70 66.48 1y2m h VAL 164 Cb 0.04 0.89 -0.01 0.00 -1.52 0.00 0.00 31.29 30.69 1y2m h VAL 164 CO -0.03 0.39 -0.30 0.58 0.02 0.00 0.00 177.57 178.22 1y2m h VAL 165 N 0.82 1.27 -0.50 2.57 2.07 -1.17 -0.61 116.25 120.70 1y2m h VAL 165 Ca 0.16 -1.47 -0.03 0.00 0.82 0.00 0.00 66.70 66.17 1y2m h VAL 165 Cb 0.51 1.27 -0.02 0.00 -1.52 0.00 0.00 31.29 31.52 1y2m h VAL 165 CO 0.02 0.50 0.18 0.03 0.02 0.00 0.00 177.57 178.32 1y2m h ARG 166 N 0.78 0.76 -0.58 1.57 3.08 -1.04 -2.65 114.38 116.30 1y2m h ARG 166 Ca 0.08 -0.15 -0.03 0.00 0.07 0.00 0.00 59.98 59.96 1y2m h ARG 166 Cb 0.88 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.78 1y2m h ARG 166 CO 0.08 0.69 0.25 0.78 -1.07 0.00 0.00 179.97 180.70 1y2m h GLY 167 N 0.67 0.89 -1.61 0.04 0.00 -1.15 -2.11 103.07 99.80 1y2m h GLY 167 Ca 0.16 -0.44 0.00 0.00 0.00 0.00 0.00 47.33 47.06 1y2m h GLY 167 CO -0.01 0.42 0.00 0.00 0.00 0.00 0.00 176.54 176.95 1y2m n ALA 168 N -2.45 1.60 0.00 3.60 0.00 -0.25 -1.48 120.51 121.53 1y2m n ALA 168 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1y2m n ALA 168 Cb 0.15 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.60 1y2m n ALA 168 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1y2m n THR 170 N 0.68 0.00 -0.26 0.00 -1.04 -0.79 -0.16 114.28 112.70 1y2m n THR 170 Ca 0.00 0.00 -0.05 0.00 -2.04 0.00 0.00 64.05 61.96 1y2m n THR 170 Cb 0.10 0.00 0.06 0.00 -1.82 0.00 0.00 70.33 68.67 1y2m n THR 170 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 1y2m h ILE 171 N 0.00 1.22 -0.49 12.58 2.04 -1.54 -1.95 117.51 129.37 1y2m h ILE 171 Ca 0.00 -0.52 0.07 0.00 1.00 0.00 0.00 64.86 65.41 1y2m h ILE 171 Cb 0.00 0.25 -0.06 0.00 -0.74 0.00 0.00 36.82 36.27 1y2m h ILE 171 CO 0.00 0.23 0.16 -0.09 0.00 0.00 0.00 178.15 178.45 1y2m h ARG 172 N 0.99 0.31 -0.21 2.37 9.65 -0.81 -0.16 114.38 126.52 1y2m h ARG 172 Ca 0.26 -0.02 -0.07 0.00 -1.10 0.00 0.00 59.98 59.04 1y2m h ARG 172 Cb 0.01 -0.07 -0.00 0.00 -1.39 0.00 0.00 29.97 28.52 1y2m h ARG 172 CO -0.04 0.21 -0.15 0.28 2.80 0.00 0.00 179.97 183.06 1y2m h VAL 173 N 0.32 1.32 -0.95 0.20 2.07 -1.74 -2.57 116.25 114.90 1y2m h VAL 173 Ca 0.24 -1.27 0.12 0.00 0.82 0.00 0.00 66.70 66.61 1y2m h VAL 173 Cb 0.26 1.68 -0.14 0.00 -1.52 0.00 0.00 31.29 31.57 1y2m h VAL 173 CO -0.26 0.39 -0.44 -3.20 0.02 0.00 0.00 177.57 174.08 1y2m n ASN 174 N -4.48 -0.77 0.28 0.57 5.15 -0.75 -1.91 115.26 113.34 1y2m n ASN 174 Ca -0.05 1.67 0.14 0.00 -0.60 0.00 0.00 54.58 55.74 1y2m n ASN 174 Cb 0.37 -0.31 0.81 0.00 -0.53 0.00 0.00 39.78 40.12 1y2m n ASN 174 CO 0.00 0.00 0.00 0.77 1.40 0.00 0.00 177.26 179.43 1y2m h SER 175 N 0.00 0.00 0.27 1.20 4.64 -0.83 -2.66 113.55 116.18 1y2m h SER 175 Ca 0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 1y2m h SER 175 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 1y2m h SER 175 CO -0.92 0.07 -1.00 0.18 -0.87 0.00 0.00 176.83 174.30 1y2m n LEU 176 N -3.62 0.67 0.00 5.97 4.77 -0.90 -4.06 117.00 119.83 1y2m n LEU 176 Ca -0.02 -0.17 0.10 0.00 -0.03 0.00 0.00 56.01 55.89 1y2m n LEU 176 Cb 0.19 -0.09 0.48 0.00 -2.33 0.00 0.00 43.42 41.67 1y2m n LEU 176 CO 0.28 0.12 0.82 0.35 -1.33 0.00 0.00 177.39 177.63 1y2m n THR 177 N -1.75 0.47 1.05 -5.08 -2.24 -0.80 -3.66 114.28 102.26 1y2m n THR 177 Ca 0.03 0.12 0.14 0.00 -2.27 0.00 0.00 64.05 62.06 1y2m n THR 177 Cb 0.39 -0.78 0.63 0.00 -2.10 0.00 0.00 70.33 68.47 1y2m n THR 177 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1y2m n ARG 178 N -1.36 0.05 -0.74 -0.78 1.74 -1.26 -4.76 116.66 109.57 1y2m n ARG 178 Ca 0.08 -0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.16 1y2m n ARG 178 Cb 0.19 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.13 1y2m n ARG 178 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1y2m n GLY 179 N 1.47 0.61 0.91 -0.13 0.00 -1.24 -4.92 105.19 101.89 1y2m n GLY 179 Ca 0.08 -0.23 0.11 0.00 0.00 0.00 0.00 46.02 45.98 1y2m n GLY 179 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1y2m n HIS 180 N -2.74 0.03 -0.00 1.61 8.25 -1.26 -4.65 115.22 116.46 1y2m n HIS 180 Ca 0.00 -0.02 0.01 0.00 -0.26 0.00 0.00 57.72 57.46 1y2m n HIS 180 Cb 0.00 -0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.08 1y2m n HIS 180 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1y2m n SER 181 N 1.28 4.25 -2.81 0.41 7.64 -1.26 -0.02 113.62 123.10 1y2m n SER 181 Ca 0.13 0.00 -0.21 0.00 1.01 0.00 0.00 58.87 59.81 1y2m n SER 181 Cb 0.56 1.08 0.04 0.00 -1.01 0.00 0.00 64.21 64.88 1y2m n SER 181 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1y2m n ALA 182 N -1.68 -0.91 -2.73 -0.43 0.00 -1.26 -4.82 120.51 108.68 1y2m n ALA 182 Ca -0.01 0.28 -0.35 0.00 0.00 0.00 0.00 53.44 53.35 1y2m n ALA 182 Cb 0.15 -3.76 -0.09 0.00 0.00 0.00 0.00 19.45 15.75 1y2m n ALA 182 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1y2m s VAL 183 N -3.14 5.23 0.60 0.00 1.01 -1.26 -4.64 120.40 118.19 1y2m s VAL 183 Ca 0.30 0.13 -0.19 0.00 0.00 0.00 0.00 61.98 62.22 1y2m s VAL 183 Cb -0.13 -3.40 -0.03 0.00 0.00 0.00 0.00 36.38 32.81 1y2m s VAL 183 CO 0.37 0.41 1.27 -0.13 0.00 0.00 0.00 175.10 177.02 1y2m s ARG 184 N 0.66 2.90 0.34 2.72 0.52 -1.26 -4.90 118.95 119.93 1y2m s ARG 184 Ca 0.07 1.99 0.06 0.00 -0.52 0.00 0.00 55.73 57.33 1y2m s ARG 184 Cb -0.12 -1.99 0.72 0.00 0.52 0.00 0.00 34.95 34.07 1y2m s ARG 184 CO 0.01 -1.31 1.89 1.25 0.02 0.00 0.00 175.30 177.17 1y2m h LEU 185 N 0.95 0.74 -1.89 2.53 5.85 -1.96 -1.68 115.31 119.85 1y2m h LEU 185 Ca -0.51 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.22 1y2m h LEU 185 Cb 1.31 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 42.21 1y2m h LEU 185 CO 0.55 0.42 -0.11 1.62 -0.34 0.00 0.00 178.44 180.58 1y2m h VAL 186 N 0.80 0.88 -0.05 1.05 3.04 -1.98 0.13 116.25 120.12 1y2m h VAL 186 Ca 0.41 -0.42 -0.13 0.00 -1.01 0.00 0.00 66.70 65.55 1y2m h VAL 186 Cb 0.49 1.24 0.01 0.00 -2.01 0.00 0.00 31.29 31.02 1y2m h VAL 186 CO -0.18 0.11 -0.46 0.58 -1.01 0.00 0.00 177.57 176.62 1y2m h VAL 187 N 0.00 1.42 -0.99 1.51 2.07 -1.68 -1.81 116.25 116.77 1y2m h VAL 187 Ca -0.00 -1.89 0.02 0.00 0.82 0.00 0.00 66.70 65.65 1y2m h VAL 187 Cb 0.23 2.41 -0.05 0.00 -1.52 0.00 0.00 31.29 32.36 1y2m h VAL 187 CO 0.01 0.55 0.65 -0.07 0.02 0.00 0.00 177.57 178.74 1y2m h LEU 188 N -0.09 1.11 -1.54 2.57 3.38 -0.97 -2.08 115.31 117.70 1y2m h LEU 188 Ca -0.04 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 1y2m h LEU 188 Cb 1.14 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.61 1y2m h LEU 188 CO 0.09 0.78 -0.24 -0.33 0.09 0.00 0.00 178.44 178.83 1y2m h GLU 189 N 1.30 0.00 -0.69 1.13 5.08 -0.73 -1.79 114.58 118.88 1y2m h GLU 189 Ca 0.38 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.72 1y2m h GLU 189 Cb -0.08 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.14 1y2m h GLU 189 CO -0.10 0.24 0.36 0.00 -1.00 0.00 0.00 179.01 178.51 1y2m h ALA 190 N 1.76 0.88 -0.33 3.43 0.00 -0.61 0.27 119.26 124.67 1y2m h ALA 190 Ca -0.00 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 1y2m h ALA 190 Cb 0.46 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1y2m h ALA 190 CO 0.03 0.42 -0.15 -0.07 0.00 0.00 0.00 179.25 179.48 1y2m h LEU 191 N 0.95 0.70 -1.08 0.00 3.38 -1.28 -2.07 115.31 115.91 1y2m h LEU 191 Ca 0.24 -0.40 -0.07 0.00 0.09 0.00 0.00 57.88 57.74 1y2m h LEU 191 Cb 0.07 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 1y2m h LEU 191 CO -0.04 0.94 -0.07 0.71 0.09 0.00 0.00 178.44 180.08 1y2m h THR 192 N 0.45 1.23 -0.70 0.22 1.35 -1.09 -1.20 112.91 113.17 1y2m h THR 192 Ca 0.07 -0.97 -0.07 0.00 -0.55 0.00 0.00 66.41 64.90 1y2m h THR 192 Cb 0.67 1.04 -0.03 0.00 -1.73 0.00 0.00 68.15 68.11 1y2m h THR 192 CO 0.05 0.32 0.17 0.78 -0.25 0.00 0.00 175.52 176.59 1y2m h ASN 193 N 0.53 1.06 -0.34 5.36 2.35 -0.39 0.20 115.58 124.35 1y2m h ASN 193 Ca 0.10 -0.23 0.02 0.00 -0.55 0.00 0.00 56.30 55.64 1y2m h ASN 193 Cb 0.45 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.52 1y2m h ASN 193 CO 0.02 1.01 0.19 -0.26 -1.65 0.00 0.00 177.43 176.75 1y2m h PHE 194 N 1.05 0.35 0.01 1.19 -1.00 -1.08 -1.17 116.94 116.30 1y2m h PHE 194 Ca 0.22 0.01 -0.00 0.00 2.81 0.00 0.00 57.97 61.01 1y2m h PHE 194 Cb 0.37 -0.11 0.00 0.00 3.61 0.00 0.00 35.95 39.82 1y2m h PHE 194 CO 0.03 0.20 -0.01 -0.07 -1.61 0.00 0.00 178.31 176.85 1y2m h LEU 195 N 0.39 -0.01 -1.29 1.54 3.38 -0.87 0.18 115.31 118.62 1y2m h LEU 195 Ca 0.14 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 1y2m h LEU 195 Cb 0.02 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 1y2m h LEU 195 CO -0.08 0.02 -0.05 0.78 0.09 0.00 0.00 178.44 179.20 1y2m h ASN 196 N -0.05 0.00 -0.48 -0.43 2.35 -0.40 -2.23 115.58 114.34 1y2m h ASN 196 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1y2m h ASN 196 Cb 0.04 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.41 1y2m h ASN 196 CO 0.00 0.05 0.00 1.41 -1.65 0.00 0.00 177.43 177.24 1y2m n HIS 197 N -3.16 0.62 -2.89 1.19 8.25 -0.46 -4.97 115.22 113.79 1y2m n HIS 197 Ca 0.01 -0.34 -0.18 0.00 -0.26 0.00 0.00 57.72 56.95 1y2m n HIS 197 Cb 0.35 -0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.49 1y2m n HIS 197 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1y2m n GLY 198 N 1.43 -0.28 3.53 -1.41 0.00 -0.45 -4.88 105.19 103.14 1y2m n GLY 198 Ca 0.20 -0.05 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 1y2m n GLY 198 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1y2m s ILE 199 N -3.06 5.11 -0.25 -0.61 1.01 0.50 -4.34 121.20 119.56 1y2m s ILE 199 Ca 0.26 0.01 0.03 0.00 0.00 0.00 0.00 60.65 60.94 1y2m s ILE 199 Cb -0.11 -3.91 0.06 0.00 0.01 0.00 0.00 42.46 38.50 1y2m s ILE 199 CO 0.32 -0.21 -0.12 -0.89 0.00 0.00 0.00 174.94 174.04 1y2m s THR 200 N 2.14 2.16 0.27 2.92 2.01 0.03 -4.40 115.64 120.77 1y2m s THR 200 Ca 0.13 -1.57 -0.29 0.00 0.31 0.00 0.00 61.69 60.27 1y2m s THR 200 Cb -0.16 -2.24 -0.14 0.00 0.01 0.00 0.00 72.50 69.97 1y2m s THR 200 CO 0.13 0.03 1.12 -2.65 -0.69 0.00 0.00 174.62 172.55 1y2m n PRO 201 N 4.45 1.49 -2.92 4.92 -0.02 -1.26 -0.03 135.00 141.63 1y2m n PRO 201 Ca -0.15 0.53 -0.42 0.00 -2.02 0.00 0.00 63.50 61.44 1y2m n PRO 201 Cb 0.43 -1.98 -0.05 0.00 -0.02 0.00 0.00 33.50 31.89 1y2m n PRO 201 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1y2m s ILE 202 N -0.80 4.85 -0.05 4.25 -1.09 -0.45 -4.79 121.20 123.12 1y2m s ILE 202 Ca 0.62 1.49 0.04 0.00 -2.23 0.00 0.00 60.65 60.56 1y2m s ILE 202 Cb -0.70 -4.10 0.00 0.00 -1.58 0.00 0.00 42.46 36.08 1y2m s ILE 202 CO 0.58 -0.08 -0.16 -0.69 -1.23 0.00 0.00 174.94 173.36 1y2m s VAL 203 N 2.81 1.34 0.47 2.92 1.01 -1.26 -4.74 120.40 122.95 1y2m s VAL 203 Ca 0.34 -0.65 -0.24 0.00 0.00 0.00 0.00 61.98 61.43 1y2m s VAL 203 Cb -0.15 -1.17 -0.08 0.00 0.00 0.00 0.00 36.38 34.98 1y2m s VAL 203 CO 0.08 0.39 1.24 -2.65 0.00 0.00 0.00 175.10 174.17 1y2m n PRO 204 N 3.33 1.73 -0.12 2.72 -0.02 -1.26 -0.43 135.00 140.95 1y2m n PRO 204 Ca -0.19 0.62 -0.10 0.00 -2.02 0.00 0.00 63.50 61.81 1y2m n PRO 204 Cb 0.53 -2.39 0.04 0.00 -0.02 0.00 0.00 33.50 31.65 1y2m n PRO 204 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1y2m h LEU 205 N 1.72 0.91 -9.15 2.45 5.85 -0.91 -3.37 115.31 112.80 1y2m h LEU 205 Ca -0.49 -0.36 -0.63 0.00 0.84 0.00 0.00 57.88 57.25 1y2m h LEU 205 Cb 1.31 -0.25 -0.16 0.00 0.37 0.00 0.00 40.66 41.92 1y2m h LEU 205 CO 0.58 1.12 -0.78 -0.13 -0.34 0.00 0.00 178.44 178.88 1y2m s ARG 206 N -4.57 1.68 0.00 1.25 0.52 -1.26 -4.84 118.95 111.72 1y2m s ARG 206 Ca -0.10 -1.56 0.00 0.00 -0.52 0.00 0.00 55.73 53.55 1y2m s ARG 206 Cb 0.12 -1.88 0.00 0.00 0.52 0.00 0.00 34.95 33.71 1y2m s ARG 206 CO 0.86 0.38 0.00 0.41 0.02 0.00 0.00 175.30 176.97 1y2m n GLY 207 N -0.08 1.22 3.88 -3.53 0.00 -1.26 -4.61 105.19 100.80 1y2m n GLY 207 Ca -0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.57 1y2m n GLY 207 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1y2m s THR 208 N -0.54 5.23 -2.46 2.61 -1.32 -1.26 -4.88 115.64 113.02 1y2m s THR 208 Ca 0.00 0.29 0.23 0.00 -1.21 0.00 0.00 61.69 61.00 1y2m s THR 208 Cb 0.00 -3.59 0.40 0.00 -1.51 0.00 0.00 72.50 67.80 1y2m s THR 208 CO 0.00 0.36 1.38 2.30 -2.21 0.00 0.00 174.62 176.46 1y2m n ILE 209 N 1.13 0.48 -3.71 5.08 -5.35 -1.26 -4.77 119.36 110.95 1y2m n ILE 209 Ca -0.11 -0.74 -0.24 0.00 -0.27 0.00 0.00 62.75 61.39 1y2m n ILE 209 Cb 0.53 1.02 0.05 0.00 -1.74 0.00 0.00 39.64 39.49 1y2m n ILE 209 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1y2m n SER 210 N 1.47 -3.65 0.00 7.28 7.64 -1.19 -1.22 113.62 123.96 1y2m n SER 210 Ca 0.19 -0.72 0.00 0.00 1.01 0.00 0.00 58.87 59.35 1y2m n SER 210 Cb 0.60 -4.37 0.00 0.00 -1.01 0.00 0.00 64.21 59.44 1y2m n SER 210 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1y2m n ALA 211 N -4.55 0.00 0.00 -0.43 0.00 -1.26 -2.62 120.51 111.65 1y2m n ALA 211 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1y2m n ALA 211 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.05 1y2m n ALA 211 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1y2m n SER 212 N 0.00 0.00 0.00 0.00 3.41 -1.26 -5.67 113.62 110.09 1y2m n SER 212 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1y2m n SER 212 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1y2m n SER 212 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1y2m n GLY 213 N 0.00 -0.01 2.37 5.00 0.00 -1.09 -1.79 105.19 109.66 1y2m n GLY 213 Ca 0.00 -1.35 -0.39 0.00 0.00 0.00 0.00 46.02 44.29 1y2m n GLY 213 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1y2m n ASP 214 N 1.10 8.43 0.19 1.61 8.00 0.25 -3.14 116.55 132.99 1y2m n ASP 214 Ca 0.00 -2.78 -0.14 0.00 0.71 0.00 0.00 54.79 52.58 1y2m n ASP 214 Cb 0.00 -1.48 -0.07 0.00 -0.02 0.00 0.00 41.12 39.54 1y2m n ASP 214 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1y2m h LEU 215 N 6.42 -0.54 0.42 0.64 3.38 -1.77 -1.48 115.31 122.38 1y2m h LEU 215 Ca 0.80 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.79 1y2m h LEU 215 Cb 0.32 0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1y2m h LEU 215 CO 1.64 -0.33 -0.20 -1.28 0.09 0.00 0.00 178.44 178.36 1y2m h SER 216 N -0.51 -0.48 -0.37 -0.43 0.87 -1.86 0.09 113.55 110.86 1y2m h SER 216 Ca -0.02 -0.06 -0.06 0.00 -1.23 0.00 0.00 61.79 60.42 1y2m h SER 216 Cb 0.43 0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 62.50 1y2m h SER 216 CO 0.01 -0.24 0.05 1.55 -0.53 0.00 0.00 176.83 177.67 1y2m h PRO 217 N -0.70 0.71 -0.09 2.24 0.13 -1.85 -0.85 132.00 131.59 1y2m h PRO 217 Ca -0.06 -0.16 -0.04 0.00 -0.87 0.00 0.00 66.00 64.87 1y2m h PRO 217 Cb 0.50 -0.10 -0.01 0.00 0.13 0.00 0.00 31.00 31.52 1y2m h PRO 217 CO 0.09 0.69 -0.14 -0.07 -0.23 0.00 0.00 178.00 178.35 1y2m h LEU 218 N 0.68 0.13 -0.77 1.56 3.38 -1.17 -2.25 115.31 116.88 1y2m h LEU 218 Ca 0.14 -0.02 -0.12 0.00 0.09 0.00 0.00 57.88 57.97 1y2m h LEU 218 Cb 0.34 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1y2m h LEU 218 CO 0.01 0.29 -0.36 0.28 0.09 0.00 0.00 178.44 178.75 1y2m h SER 219 N 0.13 0.54 -0.86 -0.43 0.02 0.41 -1.35 113.55 112.01 1y2m h SER 219 Ca 0.03 -0.22 0.01 0.00 -0.84 0.00 0.00 61.79 60.76 1y2m h SER 219 Cb 0.33 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 62.68 1y2m h SER 219 CO 0.02 0.86 0.56 1.88 -1.14 0.00 0.00 176.83 179.01 1y2m h TYR 220 N 0.44 1.09 -0.32 3.45 -1.99 -0.77 0.78 116.97 119.66 1y2m h TYR 220 Ca 0.05 0.02 -0.05 0.00 2.00 0.00 0.00 58.73 60.75 1y2m h TYR 220 Cb 0.83 -0.37 -0.01 0.00 2.00 0.00 0.00 36.73 39.18 1y2m h TYR 220 CO 0.03 0.70 0.02 0.82 -0.00 0.00 0.00 178.16 179.72 1y2m h ILE 221 N 1.17 1.25 -0.70 -2.88 2.04 -1.14 -1.95 117.51 115.31 1y2m h ILE 221 Ca 0.32 -0.91 0.01 0.00 1.00 0.00 0.00 64.86 65.27 1y2m h ILE 221 Cb -0.12 1.22 -0.03 0.00 -0.74 0.00 0.00 36.82 37.14 1y2m h ILE 221 CO -0.07 0.30 0.46 0.00 0.00 0.00 0.00 178.15 178.84 1y2m h ALA 222 N 0.86 0.88 -0.32 1.87 0.00 -1.04 -2.20 119.26 119.32 1y2m h ALA 222 Ca 0.09 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 1y2m h ALA 222 Cb 0.41 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1y2m h ALA 222 CO 0.01 0.31 -0.01 0.00 0.00 0.00 0.00 179.25 179.56 1y2m h ALA 223 N 1.26 1.38 -0.11 0.00 0.00 -0.79 -2.24 119.26 118.76 1y2m h ALA 223 Ca 0.26 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1y2m h ALA 223 Cb -0.11 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 1y2m h ALA 223 CO -0.06 0.43 -0.08 0.00 0.00 0.00 0.00 179.25 179.54 1y2m h ALA 224 N 1.52 0.16 0.00 0.00 0.00 -0.76 -0.12 119.26 120.06 1y2m h ALA 224 Ca 0.10 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1y2m h ALA 224 Cb 0.33 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1y2m h ALA 224 CO 0.01 -0.02 0.00 -0.84 0.00 0.00 0.00 179.25 178.40 1y2m h ILE 225 N -0.12 0.00 -0.39 0.00 3.07 -1.35 -1.79 117.51 116.93 1y2m h ILE 225 Ca 0.02 -0.44 0.00 0.00 1.55 0.00 0.00 64.86 65.99 1y2m h ILE 225 Cb 0.57 1.37 0.00 0.00 -0.27 0.00 0.00 36.82 38.49 1y2m h ILE 225 CO 0.02 0.00 0.00 -1.54 -1.05 0.00 0.00 178.15 175.58 1y2m n SER 226 N -2.88 2.93 -2.77 2.16 3.41 -0.85 -1.83 113.62 113.79 1y2m n SER 226 Ca 0.01 -1.93 -0.18 0.00 -0.26 0.00 0.00 58.87 56.51 1y2m n SER 226 Cb 0.28 -0.26 0.06 0.00 -0.26 0.00 0.00 64.21 64.04 1y2m n SER 226 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1y2m n GLY 227 N 1.39 -0.19 3.66 5.00 0.00 -0.67 -4.63 105.19 109.75 1y2m n GLY 227 Ca 0.19 0.01 -0.45 0.00 0.00 0.00 0.00 46.02 45.77 1y2m n GLY 227 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1y2m n HIS 228 N -4.38 2.05 0.33 1.61 -0.00 -0.13 -4.77 115.22 109.93 1y2m n HIS 228 Ca -0.00 0.50 0.22 0.00 -0.00 0.00 0.00 57.72 58.44 1y2m n HIS 228 Cb 0.55 -2.42 1.17 0.00 -0.00 0.00 0.00 29.99 29.30 1y2m n HIS 228 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 1y2m h PRO 229 N 3.60 0.00 -0.39 1.57 0.11 -1.92 -2.13 132.00 132.84 1y2m h PRO 229 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1y2m h PRO 229 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1y2m h PRO 229 CO 0.71 0.00 0.00 -3.47 -0.21 0.00 0.00 178.00 175.03 1y2m n ASP 230 N -3.08 3.21 -4.72 -2.05 2.03 -1.26 -4.94 116.55 105.74 1y2m n ASP 230 Ca -0.03 -2.13 -0.40 0.00 0.52 0.00 0.00 54.79 52.76 1y2m n ASP 230 Cb 0.09 -0.31 -0.05 0.00 -0.72 0.00 0.00 41.12 40.14 1y2m n ASP 230 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 1y2m s SER 231 N -1.10 6.97 0.03 1.67 0.15 -0.80 -5.02 113.70 115.59 1y2m s SER 231 Ca 0.29 1.16 0.03 0.00 0.70 0.00 0.00 55.95 58.13 1y2m s SER 231 Cb 0.17 -2.40 -0.04 0.00 -1.71 0.00 0.00 66.02 62.04 1y2m s SER 231 CO 0.17 -0.11 -0.03 -0.54 1.20 0.00 0.00 173.24 173.94 1y2m s LYS 232 N 0.79 2.62 0.07 5.44 1.02 -1.26 -0.71 119.74 127.71 1y2m s LYS 232 Ca 0.37 -0.72 0.02 0.00 0.02 0.00 0.00 55.97 55.66 1y2m s LYS 232 Cb -0.18 -2.57 -0.03 0.00 -0.52 0.00 0.00 37.83 34.53 1y2m s LYS 232 CO 0.18 0.59 -0.07 0.14 -0.92 0.00 0.00 175.35 175.27 1y2m s VAL 233 N -1.12 0.60 -0.16 3.17 -7.23 0.27 -1.34 120.40 114.59 1y2m s VAL 233 Ca 0.20 -1.56 -0.08 0.00 -1.81 0.00 0.00 61.98 58.74 1y2m s VAL 233 Cb -0.11 -1.21 -0.04 0.00 0.56 0.00 0.00 36.38 35.58 1y2m s VAL 233 CO 0.11 -0.67 0.11 -2.28 -0.31 0.00 0.00 175.10 172.07 1y2m s HIS 234 N -2.66 3.43 0.05 2.82 2.46 0.96 -0.78 115.29 121.57 1y2m s HIS 234 Ca 0.02 0.35 -0.09 0.00 0.47 0.00 0.00 55.06 55.81 1y2m s HIS 234 Cb -0.01 -2.04 -0.00 0.00 -0.13 0.00 0.00 32.58 30.40 1y2m s HIS 234 CO -0.03 0.44 0.18 0.14 -2.47 0.00 0.00 174.74 173.00 1y2m s VAL 235 N -0.24 0.12 -0.22 0.89 -7.23 -0.14 -0.79 120.40 112.79 1y2m s VAL 235 Ca 0.10 -1.01 -0.08 0.00 -1.81 0.00 0.00 61.98 59.18 1y2m s VAL 235 Cb -0.12 -1.04 -0.04 0.00 0.56 0.00 0.00 36.38 35.75 1y2m s VAL 235 CO 0.01 -0.56 0.08 -0.69 -0.31 0.00 0.00 175.10 173.63 1y2m s VAL 236 N -2.94 4.71 -0.17 1.32 1.01 -1.26 -0.23 120.40 122.84 1y2m s VAL 236 Ca -0.02 -0.05 -0.11 0.00 0.00 0.00 0.00 61.98 61.80 1y2m s VAL 236 Cb 0.01 -3.17 0.06 0.00 0.00 0.00 0.00 36.38 33.27 1y2m s VAL 236 CO -0.06 0.39 0.43 -2.28 0.00 0.00 0.00 175.10 173.58 1y2m s HIS 237 N 1.01 -0.59 -1.47 5.22 5.04 0.23 -4.86 115.29 119.86 1y2m s HIS 237 Ca 0.05 1.30 -0.09 0.00 -1.54 0.00 0.00 55.06 54.77 1y2m s HIS 237 Cb -0.14 0.26 0.06 0.00 0.04 0.00 0.00 32.58 32.80 1y2m s HIS 237 CO 0.03 -0.32 0.87 0.39 -2.34 0.00 0.00 174.74 173.38 1y2m n GLU 238 N 3.87 -5.21 -1.04 2.88 1.02 -1.26 -2.02 120.64 118.88 1y2m n GLU 238 Ca -0.20 0.59 -0.01 0.00 -0.02 0.00 0.00 57.16 57.51 1y2m n GLU 238 Cb 0.56 -5.35 -0.01 0.00 -0.02 0.00 0.00 31.44 26.62 1y2m n GLU 238 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1y2m n GLY 239 N -1.67 0.36 3.18 0.62 0.00 -1.26 -4.99 105.19 101.43 1y2m n GLY 239 Ca -0.07 -0.06 -0.15 0.00 0.00 0.00 0.00 46.02 45.73 1y2m n GLY 239 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1y2m s LYS 240 N -1.30 0.87 0.17 1.61 -2.85 -0.86 -5.12 119.74 112.26 1y2m s LYS 240 Ca 0.00 -1.14 -0.30 0.00 -1.00 0.00 0.00 55.97 53.53 1y2m s LYS 240 Cb 0.00 -0.63 -0.08 0.00 -2.06 0.00 0.00 37.83 35.06 1y2m s LYS 240 CO 0.00 0.11 1.27 -1.21 0.10 0.00 0.00 175.35 175.62 1y2m s GLU 241 N -2.62 4.42 0.03 1.78 2.02 -1.26 -0.60 118.70 122.47 1y2m s GLU 241 Ca 0.05 1.97 0.03 0.00 0.02 0.00 0.00 54.97 57.04 1y2m s GLU 241 Cb -0.04 -3.23 -0.02 0.00 0.10 0.00 0.00 34.13 30.94 1y2m s GLU 241 CO 0.01 -0.22 -0.11 0.15 0.02 0.00 0.00 175.26 175.11 1y2m s LYS 242 N 0.11 0.71 -0.21 1.61 1.02 0.68 -4.95 119.74 118.72 1y2m s LYS 242 Ca 0.57 -0.67 -0.04 0.00 0.02 0.00 0.00 55.97 55.84 1y2m s LYS 242 Cb -0.35 -0.64 -0.01 0.00 -0.52 0.00 0.00 37.83 36.31 1y2m s LYS 242 CO 0.36 0.15 -0.03 0.42 -0.92 0.00 0.00 175.35 175.33 1y2m s ILE 243 N -0.91 3.53 0.30 2.17 1.01 -1.26 -0.97 121.20 125.07 1y2m s ILE 243 Ca -0.02 -0.44 0.07 0.00 0.00 0.00 0.00 60.65 60.25 1y2m s ILE 243 Cb -0.08 -2.60 -0.06 0.00 0.01 0.00 0.00 42.46 39.73 1y2m s ILE 243 CO 0.01 0.42 -0.05 -0.76 0.00 0.00 0.00 174.94 174.56 1y2m s LEU 244 N 1.35 2.52 0.56 2.97 1.43 0.04 -4.94 118.68 122.61 1y2m s LEU 244 Ca 0.04 -1.22 -0.20 0.00 -1.03 0.00 0.00 54.13 51.72 1y2m s LEU 244 Cb -0.14 -0.69 -0.04 0.00 0.03 0.00 0.00 46.19 45.34 1y2m s LEU 244 CO -0.01 -0.35 1.23 -0.31 0.23 0.00 0.00 176.35 177.14 1y2m s TYR 245 N -2.95 2.44 0.21 0.29 2.02 -1.26 -0.57 117.35 117.53 1y2m s TYR 245 Ca 0.31 1.49 -0.09 0.00 -0.37 0.00 0.00 57.07 58.41 1y2m s TYR 245 Cb 0.04 -3.54 0.27 0.00 -0.40 0.00 0.00 41.96 38.34 1y2m s TYR 245 CO 0.13 -2.25 1.78 0.00 -1.57 0.00 0.00 175.55 173.64 1y2m h ALA 246 N 1.20 0.87 -0.57 3.71 0.00 -1.18 -1.56 119.26 121.73 1y2m h ALA 246 Ca -0.50 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.40 1y2m h ALA 246 Cb 1.29 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 19.01 1y2m h ALA 246 CO 0.56 -0.06 0.14 0.00 0.00 0.00 0.00 179.25 179.89 1y2m h ARG 247 N 0.57 0.88 -0.14 0.00 3.08 -1.85 -2.80 114.38 114.11 1y2m h ARG 247 Ca 0.31 -0.18 0.03 0.00 0.07 0.00 0.00 59.98 60.20 1y2m h ARG 247 Cb 0.29 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.19 1y2m h ARG 247 CO -0.24 0.79 -0.02 0.93 -1.07 0.00 0.00 179.97 180.36 1y2m h GLU 248 N 0.85 0.02 -1.30 0.04 5.08 -1.71 -1.68 114.58 115.88 1y2m h GLU 248 Ca 0.19 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 1y2m h GLU 248 Cb 0.31 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.55 1y2m h GLU 248 CO -0.00 0.01 0.00 0.00 -1.00 0.00 0.00 179.01 178.02 1y2m n ALA 249 N -2.29 1.44 0.00 3.43 0.00 -0.67 -2.42 120.51 120.00 1y2m n ALA 249 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1y2m n ALA 249 Cb 0.09 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.54 1y2m n ALA 249 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1y2m n ALA 251 N 0.79 0.00 0.05 0.00 0.00 -0.63 -3.17 120.51 117.55 1y2m n ALA 251 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.45 1y2m n ALA 251 Cb 0.04 0.00 0.36 0.00 0.00 0.00 0.00 19.45 19.84 1y2m n ALA 251 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1y2m h LEU 252 N 0.00 0.37 -2.98 0.00 3.38 -1.76 -3.09 115.31 111.23 1y2m h LEU 252 Ca 0.00 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1y2m h LEU 252 Cb 0.00 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.65 1y2m h LEU 252 CO 0.00 0.45 0.00 0.49 0.09 0.00 0.00 178.44 179.47 1y2m n PHE 253 N -4.31 0.64 -2.63 1.13 3.72 -1.19 -4.96 117.46 109.86 1y2m n PHE 253 Ca 0.01 -0.59 -0.20 0.00 -0.05 0.00 0.00 57.45 56.61 1y2m n PHE 253 Cb 0.23 -0.10 0.01 0.00 -0.94 0.00 0.00 39.48 38.67 1y2m n PHE 253 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 1y2m n ASN 254 N 0.34 -5.73 -4.86 4.37 2.85 -1.17 -4.98 115.26 106.09 1y2m n ASN 254 Ca 0.15 -0.13 -0.35 0.00 -0.11 0.00 0.00 54.58 54.14 1y2m n ASN 254 Cb 0.56 -4.67 -0.06 0.00 1.24 0.00 0.00 39.78 36.86 1y2m n ASN 254 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 1y2m s LEU 255 N -5.91 4.36 -0.12 1.20 1.43 -1.26 -5.01 118.68 113.38 1y2m s LEU 255 Ca 0.12 0.87 -0.04 0.00 -1.03 0.00 0.00 54.13 54.05 1y2m s LEU 255 Cb -0.05 -2.99 -0.04 0.00 0.03 0.00 0.00 46.19 43.14 1y2m s LEU 255 CO 0.15 0.18 0.05 -1.61 0.23 0.00 0.00 176.35 175.35 1y2m s GLU 256 N -1.82 3.32 0.58 1.70 0.41 -1.26 -4.37 118.70 117.26 1y2m s GLU 256 Ca 0.33 -0.32 -0.19 0.00 -0.41 0.00 0.00 54.97 54.37 1y2m s GLU 256 Cb -0.14 -2.98 -0.04 0.00 -1.78 0.00 0.00 34.13 29.18 1y2m s GLU 256 CO 0.18 0.63 1.22 -1.25 -0.49 0.00 0.00 175.26 175.55 1y2m s PRO 257 N -0.65 3.03 0.29 0.39 0.04 -1.26 -5.02 135.00 131.82 1y2m s PRO 257 Ca 0.11 1.87 -0.06 0.00 0.04 0.00 0.00 61.00 62.96 1y2m s PRO 257 Cb -0.12 -1.99 -0.06 0.00 0.04 0.00 0.00 34.50 32.38 1y2m s PRO 257 CO 0.02 -1.17 0.57 0.14 0.04 0.00 0.00 177.00 176.60 1y2m s VAL 258 N -1.55 4.99 -0.22 -0.36 -7.23 -0.76 -4.98 120.40 110.28 1y2m s VAL 258 Ca 0.76 0.18 -0.04 0.00 -1.81 0.00 0.00 61.98 61.07 1y2m s VAL 258 Cb -0.32 -3.71 -0.01 0.00 0.56 0.00 0.00 36.38 32.90 1y2m s VAL 258 CO 0.35 -0.30 -0.03 -0.69 -0.31 0.00 0.00 175.10 174.12 1y2m s VAL 259 N -2.07 3.49 0.09 1.32 1.01 -1.26 -4.31 120.40 118.66 1y2m s VAL 259 Ca 0.45 -0.45 -0.31 0.00 0.00 0.00 0.00 61.98 61.67 1y2m s VAL 259 Cb -0.11 -2.59 -0.07 0.00 0.00 0.00 0.00 36.38 33.61 1y2m s VAL 259 CO 0.29 0.41 1.26 -0.76 0.00 0.00 0.00 175.10 176.31 1y2m s LEU 260 N 1.47 4.38 0.00 3.92 1.43 -1.26 -5.02 118.68 123.60 1y2m s LEU 260 Ca 0.06 2.14 0.00 0.00 -1.03 0.00 0.00 54.13 55.29 1y2m s LEU 260 Cb -0.14 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.49 1y2m s LEU 260 CO -0.02 -0.53 0.00 0.61 0.23 0.00 0.00 176.35 176.64 1y2m n GLY 261 N 3.24 2.55 3.67 -3.19 0.00 -1.26 -4.39 105.19 105.80 1y2m n GLY 261 Ca 0.09 -2.09 -0.46 0.00 0.00 0.00 0.00 46.02 43.57 1y2m n GLY 261 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1y2m n PRO 262 N -0.42 2.15 0.00 1.61 -0.02 -1.26 -1.36 135.00 135.70 1y2m n PRO 262 Ca 0.00 0.77 0.00 0.00 -2.02 0.00 0.00 63.50 62.25 1y2m n PRO 262 Cb 0.00 -2.54 0.00 0.00 -0.02 0.00 0.00 33.50 30.94 1y2m n PRO 262 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1y2m n LYS 263 N 3.38 0.00 0.14 -0.52 3.00 -1.26 -4.83 118.16 118.07 1y2m n LYS 263 Ca 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.48 1y2m n LYS 263 Cb 0.29 -2.12 0.18 0.00 0.00 0.00 0.00 35.03 33.38 1y2m n LYS 263 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 1y2m h GLU 264 N 1.17 0.00 0.72 1.64 5.08 -1.48 0.22 114.58 121.93 1y2m h GLU 264 Ca 0.00 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 1y2m h GLU 264 Cb 0.00 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.26 1y2m h GLU 264 CO 0.00 0.59 -0.35 0.78 -1.00 0.00 0.00 179.01 179.03 1y2m h GLY 265 N 2.07 -1.01 1.28 -3.84 0.00 -1.88 -0.72 103.07 98.97 1y2m h GLY 265 Ca -0.01 0.37 -0.04 0.00 0.00 0.00 0.00 47.33 47.66 1y2m h GLY 265 CO 0.08 -0.37 0.23 1.41 0.00 0.00 0.00 176.54 177.89 1y2m h LEU 266 N -1.00 0.84 -1.14 3.11 3.38 -1.88 -0.22 115.31 118.41 1y2m h LEU 266 Ca -0.10 -0.12 0.06 0.00 0.09 0.00 0.00 57.88 57.81 1y2m h LEU 266 Cb 0.75 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 41.22 1y2m h LEU 266 CO 0.16 0.77 0.59 1.23 0.09 0.00 0.00 178.44 181.28 1y2m h GLY 267 N 1.01 1.32 1.10 0.83 0.00 -0.46 -0.17 103.07 106.70 1y2m h GLY 267 Ca 0.21 -0.42 -0.33 0.00 0.00 0.00 0.00 47.33 46.79 1y2m h GLY 267 CO -0.02 0.31 -1.62 1.41 0.00 0.00 0.00 176.54 176.62 1y2m h LEU 268 N 1.04 0.55 0.00 3.11 3.38 -0.83 -3.41 115.31 119.15 1y2m h LEU 268 Ca 0.39 -0.76 -0.09 0.00 0.09 0.00 0.00 57.88 57.51 1y2m h LEU 268 Cb 0.18 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1y2m h LEU 268 CO -0.14 1.63 -1.47 1.33 0.09 0.00 0.00 178.44 179.87 1y2m n VAL 269 N -3.54 0.74 -3.06 1.22 0.24 -0.12 -4.81 118.33 109.00 1y2m n VAL 269 Ca -0.20 -0.61 -0.40 0.00 -2.04 0.00 0.00 64.34 61.09 1y2m n VAL 269 Cb 1.07 -0.41 -0.05 0.00 -1.47 0.00 0.00 33.84 32.98 1y2m n VAL 269 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 1y2m s ASN 270 N -5.33 6.90 0.00 -1.34 0.01 -0.09 -3.96 114.94 111.14 1y2m s ASN 270 Ca -0.04 1.08 0.00 0.00 -0.71 0.00 0.00 52.86 53.19 1y2m s ASN 270 Cb 0.10 -2.40 0.00 0.00 0.41 0.00 0.00 41.25 39.36 1y2m s ASN 270 CO 0.83 -0.18 0.00 0.61 -1.51 0.00 0.00 177.10 176.84 1y2m n GLY 271 N 3.32 1.03 0.41 0.66 0.00 -0.74 -3.56 105.19 106.30 1y2m n GLY 271 Ca -0.01 -1.68 0.05 0.00 0.00 0.00 0.00 46.02 44.38 1y2m n GLY 271 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1y2m n THR 272 N -1.66 1.30 0.24 2.61 -2.24 -1.26 -0.59 114.28 112.68 1y2m n THR 272 Ca 0.00 -1.28 0.08 0.00 -2.27 0.00 0.00 64.05 60.59 1y2m n THR 272 Cb 0.00 0.30 0.59 0.00 -2.10 0.00 0.00 70.33 69.12 1y2m n THR 272 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1y2m h ALA 273 N 1.11 1.51 0.02 6.98 0.00 -1.94 0.90 119.26 127.84 1y2m h ALA 273 Ca 0.00 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 1y2m h ALA 273 Cb 0.80 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1y2m h ALA 273 CO 0.03 0.21 -0.01 0.28 0.00 0.00 0.00 179.25 179.77 1y2m h VAL 274 N 0.00 1.50 -0.64 0.00 2.07 -1.87 -0.27 116.25 117.04 1y2m h VAL 274 Ca -0.00 -1.75 0.05 0.00 0.82 0.00 0.00 66.70 65.82 1y2m h VAL 274 Cb 0.34 2.66 -0.05 0.00 -1.52 0.00 0.00 31.29 32.72 1y2m h VAL 274 CO 0.02 0.44 0.36 0.28 0.02 0.00 0.00 177.57 178.69 1y2m h SER 275 N -0.80 0.54 -0.16 0.57 0.02 -1.90 -2.75 113.55 109.08 1y2m h SER 275 Ca -0.00 0.02 -0.11 0.00 -0.84 0.00 0.00 61.79 60.86 1y2m h SER 275 Cb 0.74 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 63.18 1y2m h SER 275 CO 0.00 0.36 -0.27 0.00 -1.14 0.00 0.00 176.83 175.79 1y2m h ALA 276 N 1.32 0.96 0.00 3.77 0.00 -0.80 0.11 119.26 124.62 1y2m h ALA 276 Ca 0.28 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1y2m h ALA 276 Cb 0.15 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1y2m h ALA 276 CO -0.16 0.61 0.00 0.45 0.00 0.00 0.00 179.25 180.14 1y2m n SER 277 N -4.10 0.00 0.00 0.00 2.88 -0.12 -0.93 113.62 111.35 1y2m n SER 277 Ca -0.00 -0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1y2m n SER 277 Cb 0.44 -0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.90 1y2m n SER 277 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1y2m n ALA 279 N 0.01 0.00 -0.08 -1.46 0.00 0.03 -1.94 120.51 117.07 1y2m n ALA 279 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.34 1y2m n ALA 279 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 1y2m n ALA 279 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1y2m h THR 280 N 0.00 1.18 -0.44 0.00 2.02 -1.27 0.30 112.91 114.70 1y2m h THR 280 Ca 0.00 -0.57 -0.00 0.00 0.77 0.00 0.00 66.41 66.61 1y2m h THR 280 Cb 0.00 1.09 -0.02 0.00 -1.74 0.00 0.00 68.15 67.48 1y2m h THR 280 CO 0.00 0.19 0.28 -0.07 0.37 0.00 0.00 175.52 176.29 1y2m h LEU 281 N 0.25 0.52 -0.65 2.58 3.38 -1.65 -1.03 115.31 118.71 1y2m h LEU 281 Ca 0.08 -0.04 -0.07 0.00 0.09 0.00 0.00 57.88 57.94 1y2m h LEU 281 Cb 0.21 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 1y2m h LEU 281 CO -0.00 0.41 0.13 0.00 0.09 0.00 0.00 178.44 179.07 1y2m h ALA 282 N 1.14 0.86 -0.31 1.53 0.00 -1.78 -1.89 119.26 118.80 1y2m h ALA 282 Ca 0.16 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 1y2m h ALA 282 Cb -0.03 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1y2m h ALA 282 CO -0.03 0.60 0.02 1.25 0.00 0.00 0.00 179.25 181.09 1y2m h LEU 283 N 0.98 0.53 -0.47 0.00 5.85 -0.19 0.62 115.31 122.63 1y2m h LEU 283 Ca 0.20 -0.29 0.09 0.00 0.84 0.00 0.00 57.88 58.72 1y2m h LEU 283 Cb 0.40 -0.14 -0.10 0.00 0.37 0.00 0.00 40.66 41.19 1y2m h LEU 283 CO 0.01 0.69 -0.25 -0.74 -0.34 0.00 0.00 178.44 177.81 1y2m h HIS 284 N 0.35 -0.66 -0.63 1.25 2.76 -1.09 -0.40 115.15 116.73 1y2m h HIS 284 Ca 0.09 0.06 -0.09 0.00 -2.20 0.00 0.00 60.37 58.23 1y2m h HIS 284 Cb 0.41 0.36 -0.02 0.00 1.55 0.00 0.00 27.41 29.71 1y2m h HIS 284 CO 0.03 -0.33 0.06 -0.44 -1.30 0.00 0.00 177.93 175.95 1y2m h ASP 285 N -0.15 1.04 -0.65 3.26 3.32 -1.12 -2.84 116.42 119.28 1y2m h ASP 285 Ca 0.22 -0.28 0.02 0.00 0.02 0.00 0.00 57.03 57.01 1y2m h ASP 285 Cb 0.49 -0.28 -0.04 0.00 0.22 0.00 0.00 39.33 39.73 1y2m h ASP 285 CO -0.56 1.06 0.41 0.00 -1.72 0.00 0.00 179.24 178.43 1y2m h ALA 286 N 1.01 0.84 0.00 3.45 0.00 -0.42 -2.13 119.26 122.01 1y2m h ALA 286 Ca 0.18 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1y2m h ALA 286 Cb 0.50 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1y2m h ALA 286 CO 0.02 0.18 0.00 0.72 0.00 0.00 0.00 179.25 180.17 1y2m n HIS 287 N -4.69 0.00 0.00 0.00 8.25 -0.20 -0.77 115.22 117.81 1y2m n HIS 287 Ca 0.06 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.52 1y2m n HIS 287 Cb 0.07 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.15 1y2m n HIS 287 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1y2m n LEU 289 N 0.53 0.00 -0.06 2.41 4.77 -0.80 -1.96 117.00 121.90 1y2m n LEU 289 Ca 0.00 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.90 1y2m n LEU 289 Cb 0.00 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.07 1y2m n LEU 289 CO 0.00 0.00 0.88 -1.28 -1.33 0.00 0.00 177.39 175.66 1y2m h SER 290 N 0.00 -0.02 -0.72 -1.43 0.87 -1.23 0.45 113.55 111.47 1y2m h SER 290 Ca 0.00 0.04 -0.06 0.00 -1.23 0.00 0.00 61.79 60.55 1y2m h SER 290 Cb 0.00 0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 61.99 1y2m h SER 290 CO 0.00 0.02 0.24 -0.07 -0.53 0.00 0.00 176.83 176.49 1y2m h LEU 291 N 0.12 1.04 -0.83 2.23 3.38 -1.65 -2.60 115.31 117.00 1y2m h LEU 291 Ca 0.11 -0.20 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 1y2m h LEU 291 Cb 0.12 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.56 1y2m h LEU 291 CO -0.16 0.97 0.50 0.25 0.09 0.00 0.00 178.44 180.10 1y2m h LEU 292 N 1.06 0.99 -0.81 1.67 5.85 -1.77 -0.86 115.31 121.44 1y2m h LEU 292 Ca 0.23 -0.06 0.10 0.00 0.84 0.00 0.00 57.88 59.00 1y2m h LEU 292 Cb 0.29 -0.25 -0.08 0.00 0.37 0.00 0.00 40.66 40.99 1y2m h LEU 292 CO -0.01 0.76 0.44 -1.28 -0.34 0.00 0.00 178.44 178.02 1y2m h SER 293 N 1.14 0.60 -0.29 1.25 0.87 -0.54 0.12 113.55 116.71 1y2m h SER 293 Ca 0.30 0.06 -0.17 0.00 -1.23 0.00 0.00 61.79 60.74 1y2m h SER 293 Cb -0.05 -0.05 -0.00 0.00 -0.44 0.00 0.00 62.40 61.86 1y2m h SER 293 CO -0.06 0.33 -0.48 1.56 -0.53 0.00 0.00 176.83 177.65 1y2m h GLN 294 N 0.72 0.86 -0.72 2.24 4.20 -1.09 -0.81 115.11 120.51 1y2m h GLN 294 Ca 0.40 -0.51 -0.06 0.00 0.06 0.00 0.00 58.65 58.54 1y2m h GLN 294 Cb 0.42 0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.21 1y2m h GLN 294 CO -0.27 1.15 0.22 0.77 -0.67 0.00 0.00 178.83 180.02 1y2m h SER 295 N 0.68 1.06 -0.25 1.46 0.02 -0.66 -1.91 113.55 113.96 1y2m h SER 295 Ca 0.03 -0.21 -0.07 0.00 -0.84 0.00 0.00 61.79 60.70 1y2m h SER 295 Cb 1.08 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 63.32 1y2m h SER 295 CO 0.11 0.99 -0.07 -0.07 -1.14 0.00 0.00 176.83 176.65 1y2m h LEU 296 N 1.07 0.59 0.25 5.07 3.38 -0.65 -2.86 115.31 122.17 1y2m h LEU 296 Ca 0.23 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 1y2m h LEU 296 Cb 0.32 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 1y2m h LEU 296 CO -0.01 0.71 -0.15 0.74 0.09 0.00 0.00 178.44 179.83 1y2m h THR 297 N 0.57 0.69 0.00 0.22 2.02 -0.70 0.51 112.91 116.23 1y2m h THR 297 Ca 0.11 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.29 1y2m h THR 297 Cb 0.47 0.69 0.00 0.00 -1.74 0.00 0.00 68.15 67.57 1y2m h THR 297 CO 0.02 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.91 1y2m n ALA 298 N -2.30 0.69 0.00 6.16 0.00 -0.76 -1.02 120.51 123.28 1y2m n ALA 298 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1y2m n ALA 298 Cb 0.18 -0.68 0.00 0.00 0.00 0.00 0.00 19.45 18.95 1y2m n ALA 298 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1y2m n THR 300 N 0.32 0.00 -0.21 0.00 -1.04 0.17 -1.59 114.28 111.93 1y2m n THR 300 Ca 0.00 0.00 0.01 0.00 -2.04 0.00 0.00 64.05 62.02 1y2m n THR 300 Cb 0.00 0.00 0.12 0.00 -1.82 0.00 0.00 70.33 68.63 1y2m n THR 300 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 1y2m h VAL 301 N 0.00 0.69 -0.04 12.58 2.07 -1.32 -2.68 116.25 127.55 1y2m h VAL 301 Ca 0.00 -0.12 -0.00 0.00 0.82 0.00 0.00 66.70 67.40 1y2m h VAL 301 Cb 0.00 0.31 -0.00 0.00 -1.52 0.00 0.00 31.29 30.08 1y2m h VAL 301 CO 0.00 0.06 0.02 -0.33 0.02 0.00 0.00 177.57 177.34 1y2m h GLU 302 N 0.34 0.06 -1.93 1.57 5.08 -1.57 -0.06 114.58 118.07 1y2m h GLU 302 Ca 0.33 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 1y2m h GLU 302 Cb 0.47 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.71 1y2m h GLU 302 CO -0.37 0.14 0.00 0.00 -1.00 0.00 0.00 179.01 177.78 1y2m n ALA 303 N -2.15 1.63 -2.69 3.43 0.00 -1.01 -4.48 120.51 115.23 1y2m n ALA 303 Ca -0.07 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.31 1y2m n ALA 303 Cb 0.08 -1.23 0.11 0.00 0.00 0.00 0.00 19.45 18.41 1y2m n ALA 303 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1y2m n VAL 305 N 1.21 0.00 -1.70 0.00 0.24 -0.75 -4.89 118.33 112.45 1y2m n VAL 305 Ca 0.00 -1.38 0.00 0.00 -2.04 0.00 0.00 64.34 60.92 1y2m n VAL 305 Cb 0.05 0.97 0.00 0.00 -1.47 0.00 0.00 33.84 33.39 1y2m n VAL 305 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1y2m n GLY 306 N -0.71 -0.02 3.47 7.63 0.00 -0.11 -4.58 105.19 110.87 1y2m n GLY 306 Ca -0.06 -1.83 -0.37 0.00 0.00 0.00 0.00 46.02 43.76 1y2m n GLY 306 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1y2m s HIS 307 N -0.26 3.12 0.05 1.61 3.76 -1.26 -0.59 115.29 121.72 1y2m s HIS 307 Ca 0.00 -0.33 0.32 0.00 -0.15 0.00 0.00 55.06 54.91 1y2m s HIS 307 Cb 0.00 -2.27 1.49 0.00 1.11 0.00 0.00 32.58 32.90 1y2m s HIS 307 CO 0.00 -0.33 1.97 0.00 -0.85 0.00 0.00 174.74 175.53 1y2m h ALA 308 N 8.27 1.00 0.00 -1.40 0.00 -1.42 -3.18 119.26 122.53 1y2m h ALA 308 Ca -0.37 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.54 1y2m h ALA 308 Cb 1.18 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 1y2m h ALA 308 CO 0.57 0.00 -0.01 0.78 0.00 0.00 0.00 179.25 180.59 1y2m h GLY 309 N 1.44 0.00 2.00 0.00 0.00 -1.92 -2.15 103.07 102.43 1y2m h GLY 309 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1y2m h GLY 309 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 176.54 178.30 1y2m h SER 310 N 0.00 0.00 -0.37 0.19 0.02 -1.92 -2.65 113.55 108.82 1y2m h SER 310 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1y2m h SER 310 Cb 0.16 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.70 1y2m h SER 310 CO 0.00 0.00 0.00 0.49 -1.14 0.00 0.00 176.83 176.18 1y2m n PHE 311 N -2.95 0.49 -1.81 3.45 3.72 -0.81 -4.93 117.46 114.61 1y2m n PHE 311 Ca -0.01 -0.40 -0.41 0.00 -0.05 0.00 0.00 57.45 56.58 1y2m n PHE 311 Cb 0.16 -0.02 -0.01 0.00 -0.94 0.00 0.00 39.48 38.67 1y2m n PHE 311 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 1y2m s HIS 312 N -1.05 2.72 0.65 1.38 2.46 -1.00 -4.70 115.29 115.75 1y2m s HIS 312 Ca 0.28 0.94 0.40 0.00 0.47 0.00 0.00 55.06 57.15 1y2m s HIS 312 Cb 0.15 -4.03 2.23 0.00 -0.13 0.00 0.00 32.58 30.81 1y2m s HIS 312 CO 0.20 -3.29 2.31 -1.00 -2.47 0.00 0.00 174.74 170.49 1y2m h PRO 313 N 4.22 0.00 -0.47 2.88 0.13 -1.94 -0.75 132.00 136.07 1y2m h PRO 313 Ca -0.48 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 64.69 1y2m h PRO 313 Cb 1.23 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.33 1y2m h PRO 313 CO 0.74 0.00 0.32 0.35 -0.23 0.00 0.00 178.00 179.17 1y2m h PHE 314 N 0.00 0.46 -0.01 1.56 3.57 -1.96 0.38 116.94 120.93 1y2m h PHE 314 Ca 0.00 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.52 1y2m h PHE 314 Cb 0.07 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 38.66 1y2m h PHE 314 CO 0.00 0.26 0.00 1.28 -2.23 0.00 0.00 178.31 177.62 1y2m n LEU 315 N -4.48 0.40 0.00 0.59 4.77 -0.29 -2.20 117.00 115.79 1y2m n LEU 315 Ca 0.06 -0.14 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 1y2m n LEU 315 Cb 0.19 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.28 1y2m n LEU 315 CO 0.35 0.07 0.00 1.41 -1.33 0.00 0.00 177.39 177.88 1y2m n HIS 316 N -0.67 0.00 -0.32 -1.77 8.25 -0.71 -4.51 115.22 115.49 1y2m n HIS 316 Ca 0.22 0.00 0.09 0.00 -0.26 0.00 0.00 57.72 57.77 1y2m n HIS 316 Cb 0.17 0.18 0.25 0.00 1.12 0.00 0.00 29.99 31.72 1y2m n HIS 316 CO 0.00 0.00 0.00 -0.44 0.64 0.00 0.00 176.34 176.54 1y2m h ASP 317 N 0.00 0.65 0.05 0.41 5.19 -1.20 -1.50 116.42 120.03 1y2m h ASP 317 Ca 0.00 0.09 -0.22 0.00 -0.62 0.00 0.00 57.03 56.28 1y2m h ASP 317 Cb 0.00 -0.02 -0.02 0.00 0.18 0.00 0.00 39.33 39.47 1y2m h ASP 317 CO 0.00 0.27 -1.17 0.58 -3.12 0.00 0.00 179.24 175.80 1y2m h VAL 318 N 0.71 1.08 0.00 -1.35 2.07 -1.57 -3.40 116.25 113.79 1y2m h VAL 318 Ca 0.50 -2.30 -0.30 0.00 0.82 0.00 0.00 66.70 65.42 1y2m h VAL 318 Cb 0.71 2.61 -0.06 0.00 -1.52 0.00 0.00 31.29 33.03 1y2m h VAL 318 CO -0.36 0.55 -2.03 0.35 0.02 0.00 0.00 177.57 176.10 1y2m n THR 319 N -4.20 1.38 -3.12 2.57 -2.24 -0.94 -4.70 114.28 103.04 1y2m n THR 319 Ca -0.26 -0.80 -0.20 0.00 -2.27 0.00 0.00 64.05 60.52 1y2m n THR 319 Cb 0.76 -0.67 -0.05 0.00 -2.10 0.00 0.00 70.33 68.28 1y2m n THR 319 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1y2m n ARG 320 N -2.84 0.60 -0.97 -0.78 0.63 -0.58 -4.99 116.66 107.72 1y2m n ARG 320 Ca -0.24 -2.84 -0.12 0.00 -0.92 0.00 0.00 57.85 53.74 1y2m n ARG 320 Cb 1.06 -1.37 -0.13 0.00 0.45 0.00 0.00 32.46 32.47 1y2m n ARG 320 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 1y2m n PRO 321 N 1.86 1.88 -1.75 -0.14 -0.04 -1.09 -4.65 135.00 131.07 1y2m n PRO 321 Ca 0.20 -0.99 -0.42 0.00 -0.04 0.00 0.00 63.50 62.25 1y2m n PRO 321 Cb 0.54 -1.85 -0.03 0.00 -0.04 0.00 0.00 33.50 32.12 1y2m n PRO 321 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 1y2m s HIS 322 N 0.51 1.60 0.35 0.54 3.76 -1.26 -4.88 115.29 115.92 1y2m s HIS 322 Ca 0.55 -0.23 0.11 0.00 -0.15 0.00 0.00 55.06 55.33 1y2m s HIS 322 Cb 0.28 -4.16 0.87 0.00 1.11 0.00 0.00 32.58 30.68 1y2m s HIS 322 CO -0.02 -5.06 1.82 -1.35 -0.85 0.00 0.00 174.74 169.28 1y2m h PRO 323 N 9.97 0.62 0.00 8.40 0.11 -1.91 -1.24 132.00 147.94 1y2m h PRO 323 Ca -0.47 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.58 1y2m h PRO 323 Cb 1.22 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 1y2m h PRO 323 CO 0.94 0.41 -0.46 1.79 -0.21 0.00 0.00 178.00 180.47 1y2m h THR 324 N 0.63 0.13 -0.21 -1.15 1.35 -1.89 -1.70 112.91 110.07 1y2m h THR 324 Ca 0.52 -1.20 -0.03 0.00 -0.55 0.00 0.00 66.41 65.15 1y2m h THR 324 Cb 0.97 1.89 -0.01 0.00 -1.73 0.00 0.00 68.15 69.27 1y2m h THR 324 CO -0.27 0.07 0.01 -0.61 -0.25 0.00 0.00 175.52 174.47 1y2m h GLN 325 N 0.00 0.36 -0.63 4.72 4.15 -1.51 -1.28 115.11 120.91 1y2m h GLN 325 Ca -0.01 -0.11 0.11 0.00 0.77 0.00 0.00 58.65 59.41 1y2m h GLN 325 Cb 1.08 -0.04 -0.08 0.00 0.21 0.00 0.00 27.48 28.65 1y2m h GLN 325 CO 0.01 0.54 0.19 0.82 -1.93 0.00 0.00 178.83 178.46 1y2m h ILE 326 N 0.13 0.69 0.11 2.39 2.04 -1.16 -0.31 117.51 121.40 1y2m h ILE 326 Ca 0.06 -0.12 -0.01 0.00 1.00 0.00 0.00 64.86 65.80 1y2m h ILE 326 Cb 0.37 0.32 0.00 0.00 -0.74 0.00 0.00 36.82 36.77 1y2m h ILE 326 CO 0.01 0.06 -0.05 -0.08 0.00 0.00 0.00 178.15 178.09 1y2m h GLU 327 N 0.34 -0.14 -0.30 2.37 4.81 -1.20 0.08 114.58 120.53 1y2m h GLU 327 Ca 0.33 0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.52 1y2m h GLU 327 Cb 0.46 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.87 1y2m h GLU 327 CO -0.37 -0.08 0.01 0.28 -0.73 0.00 0.00 179.01 178.12 1y2m h VAL 328 N -0.17 1.25 -0.95 0.32 2.07 -1.02 -0.51 116.25 117.23 1y2m h VAL 328 Ca -0.02 -0.91 0.02 0.00 0.82 0.00 0.00 66.70 66.61 1y2m h VAL 328 Cb 0.13 1.26 -0.05 0.00 -1.52 0.00 0.00 31.29 31.11 1y2m h VAL 328 CO 0.03 0.29 0.63 0.00 0.02 0.00 0.00 177.57 178.54 1y2m h ALA 329 N 0.84 1.22 -0.80 1.67 0.00 -1.00 -1.70 119.26 119.49 1y2m h ALA 329 Ca 0.09 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1y2m h ALA 329 Cb 0.41 -0.37 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 1y2m h ALA 329 CO 0.01 0.58 0.33 0.78 0.00 0.00 0.00 179.25 180.95 1y2m h GLY 330 N 1.27 1.28 0.86 0.00 0.00 -0.50 0.87 103.07 106.86 1y2m h GLY 330 Ca 0.36 -0.69 -0.01 0.00 0.00 0.00 0.00 47.33 46.99 1y2m h GLY 330 CO -0.09 0.65 0.04 3.43 0.00 0.00 0.00 176.54 180.57 1y2m h ASN 331 N 1.17 0.14 -0.44 0.19 2.35 -0.61 -0.71 115.58 117.67 1y2m h ASN 331 Ca 0.27 -0.17 -0.11 0.00 -0.55 0.00 0.00 56.30 55.74 1y2m h ASN 331 Cb 0.20 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.53 1y2m h ASN 331 CO -0.02 0.27 -0.16 0.40 -1.65 0.00 0.00 177.43 176.27 1y2m h ILE 332 N 0.01 1.27 -0.41 2.81 2.04 -1.19 -0.95 117.51 121.09 1y2m h ILE 332 Ca 0.03 -1.29 0.06 0.00 1.00 0.00 0.00 64.86 64.66 1y2m h ILE 332 Cb 0.17 1.19 -0.06 0.00 -0.74 0.00 0.00 36.82 37.39 1y2m h ILE 332 CO -0.00 0.44 0.08 -0.09 0.00 0.00 0.00 178.15 178.58 1y2m h ARG 333 N 0.71 0.21 -0.47 2.37 2.43 -0.76 -0.66 114.38 118.21 1y2m h ARG 333 Ca 0.10 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1y2m h ARG 333 Cb 0.71 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.20 1y2m h ARG 333 CO 0.05 0.14 0.30 -0.22 -1.51 0.00 0.00 179.97 178.73 1y2m h LYS 334 N 0.21 0.62 -0.57 0.20 3.64 -0.79 -2.19 116.57 117.69 1y2m h LYS 334 Ca 0.20 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.53 1y2m h LYS 334 Cb 0.24 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 31.90 1y2m h LYS 334 CO -0.26 0.43 0.33 -0.07 -2.27 0.00 0.00 179.45 177.61 1y2m h LEU 335 N 0.63 0.68 0.00 5.20 3.38 -0.75 -2.71 115.31 121.74 1y2m h LEU 335 Ca 0.17 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1y2m h LEU 335 Cb -0.05 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.53 1y2m h LEU 335 CO -0.04 0.54 -0.11 0.18 0.09 0.00 0.00 178.44 179.11 1y2m n LEU 336 N -4.41 0.34 -4.70 1.67 4.77 -0.29 -4.33 117.00 110.05 1y2m n LEU 336 Ca 0.05 0.44 -0.43 0.00 -0.03 0.00 0.00 56.01 56.04 1y2m n LEU 336 Cb 0.09 -0.39 -0.03 0.00 -2.33 0.00 0.00 43.42 40.75 1y2m n LEU 336 CO 0.37 -0.04 1.30 -0.62 -1.33 0.00 0.00 177.39 177.07 1y2m n GLU 337 N -1.76 2.57 -0.98 3.23 1.02 -0.86 -1.52 120.64 122.33 1y2m n GLU 337 Ca 0.06 0.93 0.00 0.00 -0.02 0.00 0.00 57.16 58.13 1y2m n GLU 337 Cb 0.37 -2.74 0.00 0.00 -0.02 0.00 0.00 31.44 29.05 1y2m n GLU 337 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1y2m n GLY 338 N 3.64 0.95 3.77 0.62 0.00 -1.26 -4.32 105.19 108.59 1y2m n GLY 338 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 1y2m n GLY 338 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1y2m s SER 339 N -2.92 6.80 0.00 1.61 0.15 -0.57 -4.40 113.70 114.36 1y2m s SER 339 Ca 0.00 2.66 0.18 0.00 0.70 0.00 0.00 55.95 59.49 1y2m s SER 339 Cb 0.00 -2.65 0.38 0.00 -1.71 0.00 0.00 66.02 62.04 1y2m s SER 339 CO 0.00 -0.51 1.30 0.54 1.20 0.00 0.00 173.24 175.77 1y2m n ARG 340 N 0.91 2.34 -0.11 5.44 1.74 0.12 -4.45 116.66 122.66 1y2m n ARG 340 Ca 0.00 -2.12 -0.21 0.00 -0.77 0.00 0.00 57.85 54.75 1y2m n ARG 340 Cb 0.42 -1.42 -0.10 0.00 -1.02 0.00 0.00 32.46 30.34 1y2m n ARG 340 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1y2m n PHE 341 N 1.15 0.75 -2.17 -1.55 3.72 -1.20 -4.93 117.46 113.23 1y2m n PHE 341 Ca 0.16 0.33 -0.38 0.00 -0.05 0.00 0.00 57.45 57.51 1y2m n PHE 341 Cb 0.52 -1.03 -0.00 0.00 -0.94 0.00 0.00 39.48 38.03 1y2m n PHE 341 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1y2m s ALA 342 N -2.45 3.03 -0.10 4.37 0.00 -1.26 -4.42 121.76 120.93 1y2m s ALA 342 Ca -0.30 1.04 -0.23 0.00 0.00 0.00 0.00 51.96 52.47 1y2m s ALA 342 Cb 0.07 -3.42 -0.03 0.00 0.00 0.00 0.00 23.12 19.74 1y2m s ALA 342 CO 0.52 -0.75 0.70 0.08 0.00 0.00 0.00 175.76 176.32 1y2m s VAL 343 N -1.44 5.03 0.17 0.00 1.01 0.24 -4.89 120.40 120.52 1y2m s VAL 343 Ca 0.62 1.43 0.03 0.00 0.00 0.00 0.00 61.98 64.07 1y2m s VAL 343 Cb -0.32 -4.04 -0.03 0.00 0.00 0.00 0.00 36.38 31.99 1y2m s VAL 343 CO 0.39 0.21 0.27 -1.00 0.00 0.00 0.00 175.10 174.97 1y2m s HIS 344 N 1.09 3.41 -0.08 5.22 3.76 -1.26 -1.03 115.29 126.41 1y2m s HIS 344 Ca 0.36 0.06 -0.13 0.00 -0.15 0.00 0.00 55.06 55.20 1y2m s HIS 344 Cb -0.17 -1.62 -0.29 0.00 1.11 0.00 0.00 32.58 31.62 1y2m s HIS 344 CO 0.16 0.50 0.59 1.25 -0.85 0.00 0.00 174.74 176.40 1y2m h HIS 345 N 1.98 0.56 0.00 1.40 -0.00 -1.96 2.12 115.15 119.25 1y2m h HIS 345 Ca -0.49 -0.41 0.00 0.00 -0.00 0.00 0.00 60.37 59.47 1y2m h HIS 345 Cb 1.20 -0.02 0.00 0.00 -0.00 0.00 0.00 27.41 28.59 1y2m h HIS 345 CO 0.52 1.62 0.00 -0.85 -0.00 0.00 0.00 177.93 179.23 1y2m n GLU 346 N -3.76 0.42 0.06 5.26 0.00 -1.26 -2.79 120.64 118.57 1y2m n GLU 346 Ca -0.25 0.00 0.00 0.00 0.00 0.00 0.00 57.16 56.91 1y2m n GLU 346 Cb 0.98 -1.16 0.00 0.00 0.00 0.00 0.00 31.44 31.27 1y2m n GLU 346 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1y2m n GLU 347 N 0.09 0.00 -0.28 3.44 1.02 -1.07 -4.96 120.64 118.88 1y2m n GLU 347 Ca 0.00 0.00 0.21 0.00 -0.02 0.00 0.00 57.16 57.35 1y2m n GLU 347 Cb 0.08 -0.16 0.39 0.00 -0.02 0.00 0.00 31.44 31.73 1y2m n GLU 347 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1y2m n GLU 348 N -3.10 -0.06 -2.61 3.49 2.13 0.71 -5.05 120.64 116.16 1y2m n GLU 348 Ca 0.00 1.21 -0.42 0.00 0.66 0.00 0.00 57.16 58.61 1y2m n GLU 348 Cb 0.00 -2.07 -0.03 0.00 0.27 0.00 0.00 31.44 29.61 1y2m n GLU 348 CO 0.00 0.00 0.00 0.14 -0.41 0.00 0.00 177.13 176.86 1y2m s VAL 349 N -5.51 3.99 0.00 6.31 -7.23 -1.12 -5.05 120.40 111.80 1y2m s VAL 349 Ca -0.09 0.67 0.00 0.00 -1.81 0.00 0.00 61.98 60.74 1y2m s VAL 349 Cb 0.27 -4.75 0.00 0.00 0.56 0.00 0.00 36.38 32.46 1y2m s VAL 349 CO 0.66 -1.45 0.00 -0.90 -0.31 0.00 0.00 175.10 173.10 1y2m n ASP 354 N 8.55 0.00 0.00 4.85 5.75 -1.26 -5.10 116.55 129.34 1y2m n ASP 354 Ca 0.06 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.84 1y2m n ASP 354 Cb 0.49 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.58 1y2m n ASP 354 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1y2m n GLU 355 N 0.00 1.22 -2.49 0.11 1.02 -1.26 -5.02 120.64 114.21 1y2m n GLU 355 Ca 0.00 -0.90 -0.17 0.00 -0.02 0.00 0.00 57.16 56.06 1y2m n GLU 355 Cb 0.00 -0.71 0.00 0.00 -0.02 0.00 0.00 31.44 30.71 1y2m n GLU 355 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1y2m n GLY 356 N -0.20 -0.33 3.72 0.62 0.00 -1.26 -4.96 105.19 102.79 1y2m n GLY 356 Ca 0.00 -0.13 -0.42 0.00 0.00 0.00 0.00 46.02 45.48 1y2m n GLY 356 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1y2m s ILE 357 N -2.92 3.92 -0.40 -0.61 1.01 -1.26 -4.98 121.20 115.96 1y2m s ILE 357 Ca 0.08 1.49 -0.28 0.00 0.00 0.00 0.00 60.65 61.93 1y2m s ILE 357 Cb -0.03 -3.95 0.02 0.00 0.01 0.00 0.00 42.46 38.51 1y2m s ILE 357 CO 0.09 0.18 1.05 -0.22 0.00 0.00 0.00 174.94 176.04 1y2m s LEU 358 N 0.44 3.85 -0.01 2.97 0.20 -1.26 -4.91 118.68 119.96 1y2m s LEU 358 Ca 0.55 0.66 0.21 0.00 0.69 0.00 0.00 54.13 56.24 1y2m s LEU 358 Cb -0.30 -3.45 -0.26 0.00 -0.43 0.00 0.00 46.19 41.75 1y2m s LEU 358 CO 0.32 -1.02 0.79 0.54 -0.29 0.00 0.00 176.35 176.69 1y2m n ARG 359 N 7.21 0.18 -4.43 1.98 1.74 -1.26 -4.95 116.66 117.14 1y2m n ARG 359 Ca 0.10 -0.05 -0.26 0.00 -0.77 0.00 0.00 57.85 56.87 1y2m n ARG 359 Cb 0.48 -1.50 -0.11 0.00 -1.02 0.00 0.00 32.46 30.30 1y2m n ARG 359 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1y2m s GLN 360 N -3.14 1.53 0.63 5.56 -1.52 -1.26 -5.12 119.66 116.35 1y2m s GLN 360 Ca 0.04 -1.57 -0.19 0.00 -1.95 0.00 0.00 55.36 51.69 1y2m s GLN 360 Cb 0.15 -1.79 -0.02 0.00 -0.22 0.00 0.00 33.01 31.14 1y2m s GLN 360 CO 0.88 0.38 1.31 -0.25 -0.25 0.00 0.00 175.29 177.35 1y2m n ASP 361 N 0.09 2.19 -4.76 5.90 8.00 -1.26 -5.02 116.55 121.69 1y2m n ASP 361 Ca -0.11 0.85 -0.29 0.00 0.71 0.00 0.00 54.79 55.95 1y2m n ASP 361 Cb 0.57 -1.56 0.14 0.00 -0.02 0.00 0.00 41.12 40.24 1y2m n ASP 361 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1y2m s ARG 362 N -3.30 1.12 0.41 -1.24 0.52 -1.26 -4.65 118.95 110.55 1y2m s ARG 362 Ca 0.81 0.27 0.11 0.00 -0.52 0.00 0.00 55.73 56.40 1y2m s ARG 362 Cb -0.39 -1.84 0.86 0.00 0.52 0.00 0.00 34.95 34.11 1y2m s ARG 362 CO 0.41 -2.20 1.96 1.88 0.02 0.00 0.00 175.30 177.37 1y2m h TYR 363 N -1.50 0.21 -0.74 -0.53 -1.99 -1.96 -1.46 116.97 109.01 1y2m h TYR 363 Ca -0.50 -0.02 0.16 0.00 2.00 0.00 0.00 58.73 60.38 1y2m h TYR 363 Cb 1.33 -0.06 -0.05 0.00 2.00 0.00 0.00 36.73 39.95 1y2m h TYR 363 CO 0.23 0.31 0.50 -1.35 -0.00 0.00 0.00 178.16 177.85 1y2m h PRO 364 N 0.20 0.29 0.01 4.88 0.11 -1.93 0.82 132.00 136.39 1y2m h PRO 364 Ca 0.04 -0.02 -0.34 0.00 0.11 0.00 0.00 66.00 65.80 1y2m h PRO 364 Cb 0.30 -0.07 -0.05 0.00 0.11 0.00 0.00 31.00 31.30 1y2m h PRO 364 CO 0.02 0.19 -1.85 1.28 -0.21 0.00 0.00 178.00 177.43 1y2m n LEU 365 N -4.45 2.04 0.19 2.35 4.77 -1.10 -4.18 117.00 116.61 1y2m n LEU 365 Ca 0.14 0.34 0.05 0.00 -0.03 0.00 0.00 56.01 56.51 1y2m n LEU 365 Cb 0.60 -0.93 0.36 0.00 -2.33 0.00 0.00 43.42 41.11 1y2m n LEU 365 CO 0.34 0.48 0.69 -0.09 -1.33 0.00 0.00 177.39 177.47 1y2m h ARG 366 N -0.83 0.00 -0.48 3.23 2.43 -1.11 -2.77 114.38 114.84 1y2m h ARG 366 Ca -0.49 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 1y2m h ARG 366 Cb 1.52 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.07 1y2m h ARG 366 CO -0.25 0.39 0.00 0.25 -1.51 0.00 0.00 179.97 178.85 1y2m n THR 367 N -3.70 1.50 -0.29 0.20 -2.24 0.27 -4.71 114.28 105.32 1y2m n THR 367 Ca -0.01 -1.22 -0.04 0.00 -2.27 0.00 0.00 64.05 60.51 1y2m n THR 367 Cb 0.48 0.24 0.07 0.00 -2.10 0.00 0.00 70.33 69.02 1y2m n THR 367 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1y2m h SER 368 N 2.96 0.92 -0.27 3.42 4.64 -1.59 0.56 113.55 124.19 1y2m h SER 368 Ca 0.00 -0.03 -0.09 0.00 -0.47 0.00 0.00 61.79 61.20 1y2m h SER 368 Cb 1.13 -0.23 -0.02 0.00 -0.31 0.00 0.00 62.40 62.97 1y2m h SER 368 CO 0.12 0.68 -0.13 -0.65 -0.87 0.00 0.00 176.83 175.97 1y2m h PRO 369 N 1.08 0.69 0.00 4.77 0.11 -1.84 0.38 132.00 137.18 1y2m h PRO 369 Ca 0.29 -0.23 -0.09 0.00 0.11 0.00 0.00 66.00 66.08 1y2m h PRO 369 Cb -0.10 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 30.94 1y2m h PRO 369 CO -0.06 0.80 -0.41 1.96 -0.21 0.00 0.00 178.00 180.08 1y2m h GLN 370 N 0.62 0.00 0.02 1.05 7.50 -1.71 0.82 115.11 123.41 1y2m h GLN 370 Ca 0.11 0.00 -0.03 0.00 0.50 0.00 0.00 58.65 59.22 1y2m h GLN 370 Cb 0.59 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.12 1y2m h GLN 370 CO 0.04 0.41 -0.13 2.35 -1.50 0.00 0.00 178.83 180.00 1y2m h TRP 371 N 0.00 0.09 0.04 2.96 2.91 -0.56 -3.39 115.95 118.00 1y2m h TRP 371 Ca -0.00 -0.07 -0.22 0.00 1.13 0.00 0.00 58.89 59.73 1y2m h TRP 371 Cb 0.89 -0.00 -0.02 0.00 -0.51 0.00 0.00 29.16 29.52 1y2m h TRP 371 CO 0.00 1.04 -1.03 -0.07 -1.03 0.00 0.00 178.44 177.35 1y2m h LEU 372 N -0.88 0.18 -0.60 0.65 3.38 -0.96 -3.37 115.31 113.71 1y2m h LEU 372 Ca -0.02 -0.18 0.10 0.00 0.09 0.00 0.00 57.88 57.87 1y2m h LEU 372 Cb 1.09 -0.06 -0.11 0.00 0.09 0.00 0.00 40.66 41.67 1y2m h LEU 372 CO 0.02 1.09 -0.36 1.23 0.09 0.00 0.00 178.44 180.52 1y2m h GLY 373 N 2.29 -0.18 0.95 0.83 0.00 -1.02 -0.97 103.07 104.98 1y2m h GLY 373 Ca -0.05 0.46 0.02 0.00 0.00 0.00 0.00 47.33 47.76 1y2m h GLY 373 CO 0.15 -0.20 0.57 -2.55 0.00 0.00 0.00 176.54 174.51 1y2m h PRO 374 N -0.17 1.11 0.00 4.80 0.11 -1.78 -1.93 132.00 134.14 1y2m h PRO 374 Ca 0.22 -0.07 -0.12 0.00 0.11 0.00 0.00 66.00 66.15 1y2m h PRO 374 Cb 0.56 -0.25 -0.02 0.00 0.11 0.00 0.00 31.00 31.40 1y2m h PRO 374 CO -0.69 0.74 -0.56 1.37 -0.21 0.00 0.00 178.00 178.65 1y2m h LEU 375 N 1.15 0.00 -0.68 2.35 8.10 -1.64 -2.44 115.31 122.13 1y2m h LEU 375 Ca 0.33 0.00 -0.08 0.00 0.11 0.00 0.00 57.88 58.25 1y2m h LEU 375 Cb -0.08 0.00 -0.03 0.00 -0.44 0.00 0.00 40.66 40.12 1y2m h LEU 375 CO -0.09 0.56 0.13 0.58 -4.11 0.00 0.00 178.44 175.51 1y2m h VAL 376 N 0.00 1.26 -0.82 0.15 2.07 -0.78 -1.45 116.25 116.69 1y2m h VAL 376 Ca -0.01 -1.02 -0.01 0.00 0.82 0.00 0.00 66.70 66.48 1y2m h VAL 376 Cb 1.06 0.60 -0.04 0.00 -1.52 0.00 0.00 31.29 31.40 1y2m h VAL 376 CO 0.07 0.39 0.47 -1.28 0.02 0.00 0.00 177.57 177.24 1y2m h SER 377 N 1.05 1.00 -0.69 0.57 0.87 -1.06 -0.54 113.55 114.74 1y2m h SER 377 Ca 0.21 -0.07 -0.04 0.00 -1.23 0.00 0.00 61.79 60.66 1y2m h SER 377 Cb 0.42 -0.25 -0.03 0.00 -0.44 0.00 0.00 62.40 62.10 1y2m h SER 377 CO 0.01 0.79 0.29 0.44 -0.53 0.00 0.00 176.83 177.82 1y2m h ASP 378 N 1.13 0.95 -0.61 6.23 3.32 -1.03 -0.28 116.42 126.13 1y2m h ASP 378 Ca 0.29 -0.16 -0.07 0.00 0.02 0.00 0.00 57.03 57.11 1y2m h ASP 378 Cb -0.01 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.27 1y2m h ASP 378 CO -0.05 0.85 0.14 -0.07 -1.72 0.00 0.00 179.24 178.39 1y2m h LEU 379 N 0.98 0.97 -0.54 1.55 3.38 -0.56 0.95 115.31 122.04 1y2m h LEU 379 Ca 0.23 -0.20 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 1y2m h LEU 379 Cb 0.19 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 1y2m h LEU 379 CO -0.02 0.94 0.07 0.40 0.09 0.00 0.00 178.44 179.92 1y2m h ILE 380 N 0.97 1.26 -0.29 1.22 2.04 -0.93 -1.32 117.51 120.45 1y2m h ILE 380 Ca 0.20 -0.98 -0.01 0.00 1.00 0.00 0.00 64.86 65.07 1y2m h ILE 380 Cb 0.37 0.85 -0.01 0.00 -0.74 0.00 0.00 36.82 37.28 1y2m h ILE 380 CO 0.00 0.35 0.15 -0.74 0.00 0.00 0.00 178.15 177.92 1y2m h HIS 381 N 0.79 0.41 -0.77 1.37 2.76 -0.72 -2.52 115.15 116.45 1y2m h HIS 381 Ca 0.16 -0.01 0.09 0.00 -2.20 0.00 0.00 60.37 58.41 1y2m h HIS 381 Cb 0.43 -0.13 -0.05 0.00 1.55 0.00 0.00 27.41 29.21 1y2m h HIS 381 CO 0.03 0.35 0.51 0.00 -1.30 0.00 0.00 177.93 177.52 1y2m h ALA 382 N 1.02 1.75 -0.38 5.26 0.00 -0.67 -1.77 119.26 124.47 1y2m h ALA 382 Ca 0.10 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1y2m h ALA 382 Cb 0.08 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1y2m h ALA 382 CO -0.01 0.10 0.12 1.25 0.00 0.00 0.00 179.25 180.70 1y2m h HIS 383 N 0.73 0.62 -0.73 0.00 6.17 -0.92 0.63 115.15 121.65 1y2m h HIS 383 Ca 0.35 -0.06 -0.07 0.00 0.71 0.00 0.00 60.37 61.30 1y2m h HIS 383 Cb 0.40 -0.18 -0.03 0.00 2.52 0.00 0.00 27.41 30.12 1y2m h HIS 383 CO -0.00 0.59 0.20 0.00 0.71 0.00 0.00 177.93 179.42 1y2m h ALA 384 N 0.96 0.98 0.18 5.26 0.00 -0.99 -1.05 119.26 124.61 1y2m h ALA 384 Ca 0.12 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1y2m h ALA 384 Cb 0.26 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1y2m h ALA 384 CO -0.00 0.67 -0.09 0.28 0.00 0.00 0.00 179.25 180.11 1y2m h VAL 385 N 1.09 0.91 0.00 0.00 2.07 -0.89 -2.86 116.25 116.58 1y2m h VAL 385 Ca 0.23 -0.51 -0.06 0.00 0.82 0.00 0.00 66.70 67.18 1y2m h VAL 385 Cb 0.34 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.32 1y2m h VAL 385 CO -0.00 0.12 -0.28 -0.07 0.02 0.00 0.00 177.57 177.35 1y2m h LEU 386 N -0.50 0.00 -0.61 2.57 3.38 -0.85 -1.69 115.31 117.62 1y2m h LEU 386 Ca -0.03 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 1y2m h LEU 386 Cb 0.38 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 1y2m h LEU 386 CO 0.04 0.28 0.38 0.74 0.09 0.00 0.00 178.44 179.97 1y2m h THR 387 N 0.00 1.17 -0.27 0.22 2.02 -1.07 0.20 112.91 115.18 1y2m h THR 387 Ca -0.00 -0.36 -0.07 0.00 0.77 0.00 0.00 66.41 66.74 1y2m h THR 387 Cb 0.51 0.32 -0.01 0.00 -1.74 0.00 0.00 68.15 67.23 1y2m h THR 387 CO 0.04 0.17 -0.12 0.40 0.37 0.00 0.00 175.52 176.38 1y2m h ILE 388 N 0.82 1.30 -0.28 3.11 2.04 -1.24 -1.36 117.51 121.90 1y2m h ILE 388 Ca 0.22 -1.20 -0.04 0.00 1.00 0.00 0.00 64.86 64.84 1y2m h ILE 388 Cb -0.04 1.50 -0.01 0.00 -0.74 0.00 0.00 36.82 37.53 1y2m h ILE 388 CO -0.04 0.38 0.03 -0.08 0.00 0.00 0.00 178.15 178.44 1y2m h GLU 389 N 0.30 0.48 0.05 2.37 4.57 -1.04 -0.42 114.58 120.89 1y2m h GLU 389 Ca 0.06 -0.14 -0.23 0.00 -1.18 0.00 0.00 59.36 57.87 1y2m h GLU 389 Cb 0.63 -0.05 -0.00 0.00 -0.16 0.00 0.00 28.75 29.17 1y2m h GLU 389 CO 0.04 0.60 -1.03 0.00 -1.18 0.00 0.00 179.01 177.44 1y2m h ALA 390 N 0.86 0.31 0.00 2.92 0.00 -0.68 -3.38 119.26 119.29 1y2m h ALA 390 Ca 0.08 -0.78 0.00 0.00 0.00 0.00 0.00 54.91 54.21 1y2m h ALA 390 Cb 0.36 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1y2m h ALA 390 CO 0.01 0.91 -1.29 0.41 0.00 0.00 0.00 179.25 179.29 1y2m n GLY 391 N 1.15 -0.39 0.75 0.00 0.00 -0.51 -4.77 105.19 101.41 1y2m n GLY 391 Ca -0.06 -0.27 0.01 0.00 0.00 0.00 0.00 46.02 45.70 1y2m n GLY 391 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1y2m n GLN 392 N -1.74 0.03 -4.72 1.61 6.02 -0.19 -3.28 117.38 115.10 1y2m n GLN 392 Ca -0.01 -1.29 -0.24 0.00 -0.01 0.00 0.00 57.00 55.45 1y2m n GLN 392 Cb 0.26 -0.39 -0.16 0.00 1.02 0.00 0.00 30.24 30.97 1y2m n GLN 392 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1y2m s SER 393 N -1.29 1.87 -0.25 1.08 0.01 -1.08 -4.94 113.70 109.10 1y2m s SER 393 Ca 0.09 -0.30 -0.13 0.00 1.31 0.00 0.00 55.95 56.92 1y2m s SER 393 Cb 0.10 -0.42 -0.04 0.00 0.21 0.00 0.00 66.02 65.87 1y2m s SER 393 CO -0.04 0.15 0.29 -0.89 0.41 0.00 0.00 173.24 173.15 1y2m s THR 394 N -0.06 5.25 0.00 1.44 2.01 -1.26 -4.41 115.64 118.61 1y2m s THR 394 Ca -0.01 0.43 0.00 0.00 0.31 0.00 0.00 61.69 62.42 1y2m s THR 394 Cb -0.09 -3.62 0.00 0.00 0.01 0.00 0.00 72.50 68.80 1y2m s THR 394 CO 0.01 0.24 0.86 0.35 -0.69 0.00 0.00 174.62 175.40 1y2m n THR 395 N 4.72 0.75 -1.77 -0.82 -2.24 -1.26 -4.83 114.28 108.82 1y2m n THR 395 Ca -0.11 -0.83 0.00 0.00 -2.27 0.00 0.00 64.05 60.84 1y2m n THR 395 Cb 0.51 0.64 0.00 0.00 -2.10 0.00 0.00 70.33 69.39 1y2m n THR 395 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1y2m n ASP 396 N -0.37 0.00 -3.58 3.42 5.75 -1.23 -2.44 116.55 118.09 1y2m n ASP 396 Ca 0.00 -0.88 -0.08 0.00 -0.01 0.00 0.00 54.79 53.82 1y2m n ASP 396 Cb 0.23 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.28 1y2m n ASP 396 CO 0.00 0.00 0.00 0.21 -0.11 0.00 0.00 177.20 177.30 1y2m s ASN 397 N -1.00 -0.29 1.01 -1.12 2.47 -1.26 -4.57 114.94 110.18 1y2m s ASN 397 Ca 0.00 0.23 -0.11 0.00 0.42 0.00 0.00 52.86 53.39 1y2m s ASN 397 Cb 0.00 0.26 0.20 0.00 -1.45 0.00 0.00 41.25 40.26 1y2m s ASN 397 CO 0.00 -0.33 1.09 -2.16 -3.72 0.00 0.00 177.10 171.98 1y2m s PRO 398 N -1.64 0.27 0.06 0.43 0.05 -1.26 -4.65 135.00 128.26 1y2m s PRO 398 Ca 0.02 1.22 0.08 0.00 0.05 0.00 0.00 61.00 62.37 1y2m s PRO 398 Cb -0.01 -1.66 -0.03 0.00 0.05 0.00 0.00 34.50 32.84 1y2m s PRO 398 CO -0.02 -3.04 -0.18 -0.51 0.05 0.00 0.00 177.00 173.30 1y2m s LEU 399 N -6.82 2.64 -0.20 -3.56 1.43 -0.47 -4.87 118.68 106.83 1y2m s LEU 399 Ca 0.67 -0.46 -0.04 0.00 -1.03 0.00 0.00 54.13 53.27 1y2m s LEU 399 Cb -0.23 -1.53 -0.02 0.00 0.03 0.00 0.00 46.19 44.44 1y2m s LEU 399 CO 0.61 0.23 -0.04 -0.63 0.23 0.00 0.00 176.35 176.75 1y2m s ILE 400 N -0.99 3.60 -0.52 -0.59 -1.09 0.97 -0.37 121.20 122.21 1y2m s ILE 400 Ca 0.16 -0.43 -0.12 0.00 -2.23 0.00 0.00 60.65 58.03 1y2m s ILE 400 Cb -0.11 -2.62 0.13 0.00 -1.58 0.00 0.00 42.46 38.29 1y2m s ILE 400 CO 0.07 0.44 0.43 -0.62 -1.23 0.00 0.00 174.94 174.03 1y2m s ASP 401 N 1.09 5.93 0.16 3.58 2.15 0.20 -4.51 116.67 125.27 1y2m s ASP 401 Ca 0.01 -1.93 -0.06 0.00 0.43 0.00 0.00 52.55 51.00 1y2m s ASP 401 Cb -0.15 -2.09 0.03 0.00 -0.30 0.00 0.00 42.92 40.41 1y2m s ASP 401 CO 0.00 -0.74 1.45 0.58 -0.17 0.00 0.00 175.17 176.29 1y2m h VAL 402 N 5.95 1.31 -0.34 1.11 2.07 -1.89 0.17 116.25 124.62 1y2m h VAL 402 Ca -0.22 -1.83 -0.04 0.00 0.82 0.00 0.00 66.70 65.43 1y2m h VAL 402 Cb 1.08 1.78 -0.02 0.00 -1.52 0.00 0.00 31.29 32.61 1y2m h VAL 402 CO 0.92 0.58 0.03 -0.33 0.02 0.00 0.00 177.57 178.78 1y2m h GLU 403 N 0.50 0.52 -0.50 1.57 5.08 -1.94 -2.18 114.58 117.62 1y2m h GLU 403 Ca 0.00 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1y2m h GLU 403 Cb 1.16 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.33 1y2m h GLU 403 CO 0.12 0.52 0.00 0.09 -1.00 0.00 0.00 179.01 178.74 1y2m n ASN 404 N -4.30 3.51 -3.77 1.42 3.02 -1.16 -4.99 115.26 108.99 1y2m n ASN 404 Ca 0.02 -2.11 -0.23 0.00 -0.03 0.00 0.00 54.58 52.23 1y2m n ASN 404 Cb 0.22 -0.37 0.02 0.00 -0.61 0.00 0.00 39.78 39.04 1y2m n ASN 404 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1y2m n LYS 405 N 0.88 -4.61 -3.81 3.52 5.02 -0.09 -4.96 118.16 114.10 1y2m n LYS 405 Ca 0.18 0.57 -0.09 0.00 -2.02 0.00 0.00 58.31 56.95 1y2m n LYS 405 Cb 0.57 -5.07 -0.06 0.00 -0.02 0.00 0.00 35.03 30.45 1y2m n LYS 405 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 1y2m s THR 406 N -3.70 0.10 0.25 -0.18 -1.32 -0.42 -5.02 115.64 105.35 1y2m s THR 406 Ca 0.05 -1.04 0.11 0.00 -1.21 0.00 0.00 61.69 59.61 1y2m s THR 406 Cb -0.03 -1.41 -0.05 0.00 -1.51 0.00 0.00 72.50 69.51 1y2m s THR 406 CO 0.83 -0.46 -0.20 -0.94 -2.21 0.00 0.00 174.62 171.63 1y2m s SER 407 N -2.87 3.42 -0.01 8.08 1.04 -1.26 0.58 113.70 122.68 1y2m s SER 407 Ca 0.07 -0.98 0.02 0.00 0.48 0.00 0.00 55.95 55.55 1y2m s SER 407 Cb 0.03 -0.27 -0.01 0.00 0.10 0.00 0.00 66.02 65.88 1y2m s SER 407 CO -0.09 0.04 -0.08 -1.00 0.98 0.00 0.00 173.24 173.10 1y2m s HIS 408 N -2.31 0.69 -0.36 5.02 3.76 0.50 -4.94 115.29 117.65 1y2m s HIS 408 Ca 0.26 -0.13 -0.07 0.00 -0.15 0.00 0.00 55.06 54.97 1y2m s HIS 408 Cb -0.05 -0.45 0.05 0.00 1.11 0.00 0.00 32.58 33.24 1y2m s HIS 408 CO 0.13 -0.01 0.15 -1.01 -0.85 0.00 0.00 174.74 173.14 1y2m s HIS 409 N -0.16 3.29 0.00 1.40 3.76 -1.26 -1.37 115.29 120.95 1y2m s HIS 409 Ca 0.03 -1.49 0.00 0.00 -0.15 0.00 0.00 55.06 53.44 1y2m s HIS 409 Cb -0.03 -2.48 0.00 0.00 1.11 0.00 0.00 32.58 31.17 1y2m s HIS 409 CO -0.00 -0.77 0.00 0.41 -0.85 0.00 0.00 174.74 173.53 1y2m n GLY 410 N 4.83 5.44 1.74 -2.22 0.00 -1.26 -5.07 105.19 108.64 1y2m n GLY 410 Ca -0.11 -1.42 0.01 0.00 0.00 0.00 0.00 46.02 44.50 1y2m n GLY 410 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1y2m n GLY 411 N 1.71 1.13 0.00 -0.02 0.00 -1.26 -4.92 105.19 101.83 1y2m n GLY 411 Ca 0.00 -0.72 0.07 0.00 0.00 0.00 0.00 46.02 45.37 1y2m n GLY 411 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1y2m n ASN 412 N 0.11 0.00 -0.04 1.61 3.02 -1.26 -1.68 115.26 117.01 1y2m n ASN 412 Ca -0.00 0.14 0.14 0.00 -0.03 0.00 0.00 54.58 54.82 1y2m n ASN 412 Cb 1.00 -0.32 0.60 0.00 -0.61 0.00 0.00 39.78 40.45 1y2m n ASN 412 CO 0.00 0.00 0.00 2.22 -2.62 0.00 0.00 177.26 176.86 1y2m n PHE 413 N -1.32 0.00 -2.29 3.10 1.16 -1.02 -4.56 117.46 112.52 1y2m n PHE 413 Ca 0.07 0.00 -0.40 0.00 -1.87 0.00 0.00 57.45 55.24 1y2m n PHE 413 Cb 0.13 -0.31 -0.03 0.00 -1.61 0.00 0.00 39.48 37.66 1y2m n PHE 413 CO 0.00 0.00 0.00 -1.14 -1.87 0.00 0.00 176.76 173.75 1y2m s GLN 414 N -2.72 2.98 -0.04 3.97 2.00 -0.68 -2.68 119.66 122.49 1y2m s GLN 414 Ca 0.22 0.29 -0.00 0.00 -2.00 0.00 0.00 55.36 53.87 1y2m s GLN 414 Cb 0.19 -4.26 0.03 0.00 0.80 0.00 0.00 33.01 29.78 1y2m s GLN 414 CO 0.52 -2.35 1.82 0.00 -0.50 0.00 0.00 175.29 174.78 1y2m n ALA 415 N 10.86 3.88 0.04 1.58 0.00 -1.08 -4.41 120.51 131.38 1y2m n ALA 415 Ca 0.13 -0.22 -0.01 0.00 0.00 0.00 0.00 53.44 53.33 1y2m n ALA 415 Cb 0.50 -1.05 0.27 0.00 0.00 0.00 0.00 19.45 19.18 1y2m n ALA 415 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1y2m h ALA 416 N 1.23 1.27 -0.78 0.00 0.00 -1.89 -0.87 119.26 118.23 1y2m h ALA 416 Ca 0.04 -0.27 0.07 0.00 0.00 0.00 0.00 54.91 54.75 1y2m h ALA 416 Cb 1.01 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.62 1y2m h ALA 416 CO 0.10 0.48 0.45 0.00 0.00 0.00 0.00 179.25 180.28 1y2m h ALA 417 N 1.45 1.07 -0.00 0.00 0.00 -1.99 0.19 119.26 119.97 1y2m h ALA 417 Ca 0.07 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1y2m h ALA 417 Cb 0.51 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 1y2m h ALA 417 CO 0.03 0.13 -0.00 0.28 0.00 0.00 0.00 179.25 179.69 1y2m h VAL 418 N 0.80 1.39 -0.79 0.00 2.07 -1.72 -2.92 116.25 115.08 1y2m h VAL 418 Ca 0.35 -1.15 0.09 0.00 0.82 0.00 0.00 66.70 66.82 1y2m h VAL 418 Cb 0.24 2.17 -0.07 0.00 -1.52 0.00 0.00 31.29 32.10 1y2m h VAL 418 CO -0.20 0.30 0.44 0.00 0.02 0.00 0.00 177.57 178.13 1y2m h ALA 419 N 0.51 1.12 -0.52 1.67 0.00 -0.85 -2.13 119.26 119.07 1y2m h ALA 419 Ca 0.00 0.04 0.10 0.00 0.00 0.00 0.00 54.91 55.05 1y2m h ALA 419 Cb 0.49 -0.11 -0.10 0.00 0.00 0.00 0.00 17.79 18.07 1y2m h ALA 419 CO 0.00 0.06 -0.12 -0.97 0.00 0.00 0.00 179.25 178.22 1y2m h ASN 420 N 0.74 -0.46 0.00 0.00 -0.73 -0.61 -0.61 115.58 113.91 1y2m h ASN 420 Ca 0.38 0.15 0.00 0.00 1.87 0.00 0.00 56.30 58.71 1y2m h ASN 420 Cb 0.36 0.31 0.00 0.00 0.27 0.00 0.00 38.32 39.27 1y2m h ASN 420 CO -0.25 -0.16 0.00 0.35 -0.37 0.00 0.00 177.43 176.99 1y2m n THR 421 N -5.36 0.05 0.00 -3.57 -2.24 -0.80 -2.46 114.28 99.91 1y2m n THR 421 Ca 0.05 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 1y2m n THR 421 Cb 0.28 -0.28 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 1y2m n THR 421 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1y2m n GLU 423 N 0.66 0.00 -0.15 -0.78 -0.58 -0.24 -1.35 120.64 118.19 1y2m n GLU 423 Ca 0.00 0.00 -0.11 0.00 -0.42 0.00 0.00 57.16 56.63 1y2m n GLU 423 Cb 0.04 0.00 -0.01 0.00 -0.57 0.00 0.00 31.44 30.90 1y2m n GLU 423 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 1y2m h LYS 424 N 0.00 0.91 -0.61 3.49 1.57 -1.74 -2.62 116.57 117.56 1y2m h LYS 424 Ca 0.00 -0.38 -0.01 0.00 -1.87 0.00 0.00 60.65 58.40 1y2m h LYS 424 Cb 0.00 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.24 1y2m h LYS 424 CO 0.00 1.03 0.36 1.15 -0.57 0.00 0.00 179.45 181.42 1y2m h THR 425 N 0.74 1.18 -0.42 -0.16 2.02 -1.48 -0.72 112.91 114.08 1y2m h THR 425 Ca 0.11 -0.42 -0.10 0.00 0.77 0.00 0.00 66.41 66.77 1y2m h THR 425 Cb 0.73 0.36 -0.02 0.00 -1.74 0.00 0.00 68.15 67.48 1y2m h THR 425 CO 0.06 0.19 -0.13 -0.09 0.37 0.00 0.00 175.52 175.91 1y2m h ARG 426 N 0.83 0.76 -0.50 6.66 2.43 -1.79 0.12 114.38 122.89 1y2m h ARG 426 Ca 0.22 -0.26 -0.11 0.00 -0.81 0.00 0.00 59.98 59.02 1y2m h ARG 426 Cb -0.01 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.47 1y2m h ARG 426 CO -0.04 0.86 -0.11 1.25 -1.51 0.00 0.00 179.97 180.42 1y2m h LEU 427 N 0.68 0.95 -0.82 3.80 5.85 -1.25 -2.62 115.31 121.90 1y2m h LEU 427 Ca 0.11 -0.36 0.07 0.00 0.84 0.00 0.00 57.88 58.55 1y2m h LEU 427 Cb 0.61 -0.26 -0.06 0.00 0.37 0.00 0.00 40.66 41.32 1y2m h LEU 427 CO 0.04 1.08 0.50 1.23 -0.34 0.00 0.00 178.44 180.95 1y2m h GLY 428 N 0.80 1.25 1.17 3.75 0.00 -0.60 -1.63 103.07 107.80 1y2m h GLY 428 Ca 0.13 -0.35 -0.01 0.00 0.00 0.00 0.00 47.33 47.09 1y2m h GLY 428 CO 0.05 0.22 0.46 1.41 0.00 0.00 0.00 176.54 178.67 1y2m h LEU 429 N 0.89 0.98 -0.81 3.11 3.38 -0.83 0.57 115.31 122.59 1y2m h LEU 429 Ca 0.37 -0.07 -0.08 0.00 0.09 0.00 0.00 57.88 58.19 1y2m h LEU 429 Cb 0.22 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 1y2m h LEU 429 CO -0.19 0.77 -0.01 0.00 0.09 0.00 0.00 178.44 179.09 1y2m h ALA 430 N 1.39 1.01 -0.32 1.53 0.00 -1.03 -0.68 119.26 121.16 1y2m h ALA 430 Ca 0.29 -0.29 -0.12 0.00 0.00 0.00 0.00 54.91 54.78 1y2m h ALA 430 Cb -0.01 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1y2m h ALA 430 CO -0.05 0.61 -0.28 1.96 0.00 0.00 0.00 179.25 181.48 1y2m h GLN 431 N 0.81 0.76 -0.18 0.00 1.08 -0.36 0.06 115.11 117.28 1y2m h GLN 431 Ca 0.15 -0.39 0.00 0.00 -1.45 0.00 0.00 58.65 56.96 1y2m h GLN 431 Cb 0.50 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.93 1y2m h GLN 431 CO 0.03 1.01 0.12 0.82 -0.95 0.00 0.00 178.83 179.86 1y2m h ILE 432 N 0.53 1.05 -0.27 2.54 2.04 -0.86 -1.64 117.51 120.90 1y2m h ILE 432 Ca 0.06 -0.09 0.05 0.00 1.00 0.00 0.00 64.86 65.88 1y2m h ILE 432 Cb 0.86 0.79 -0.05 0.00 -0.74 0.00 0.00 36.82 37.68 1y2m h ILE 432 CO 0.07 0.05 -0.02 1.23 0.00 0.00 0.00 178.15 179.47 1y2m h GLY 433 N 0.24 0.24 0.70 5.37 0.00 -0.94 -0.80 103.07 107.88 1y2m h GLY 433 Ca 0.07 0.05 0.06 0.00 0.00 0.00 0.00 47.33 47.50 1y2m h GLY 433 CO -0.01 -0.07 0.40 1.70 0.00 0.00 0.00 176.54 178.55 1y2m h LYS 434 N 0.05 0.71 0.41 4.80 1.63 -0.85 0.17 116.57 123.49 1y2m h LYS 434 Ca 0.13 -0.04 -0.02 0.00 -0.85 0.00 0.00 60.65 59.87 1y2m h LYS 434 Cb 0.18 -0.16 0.00 0.00 -0.60 0.00 0.00 32.23 31.66 1y2m h LYS 434 CO -0.24 0.47 -0.20 1.25 -3.45 0.00 0.00 179.45 177.28 1y2m h LEU 435 N 0.73 -0.46 -1.29 5.20 5.85 -0.34 -0.77 115.31 124.23 1y2m h LEU 435 Ca 0.31 -0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.95 1y2m h LEU 435 Cb 0.17 0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.30 1y2m h LEU 435 CO -0.17 -0.26 0.02 0.78 -0.34 0.00 0.00 178.44 178.46 1y2m h ASN 436 N -0.64 0.46 -0.18 1.25 4.21 -1.05 -0.87 115.58 118.76 1y2m h ASN 436 Ca -0.06 -0.08 0.00 0.00 1.21 0.00 0.00 56.30 57.38 1y2m h ASN 436 Cb 0.47 -0.12 -0.01 0.00 -1.12 0.00 0.00 38.32 37.54 1y2m h ASN 436 CO 0.09 0.52 0.11 0.15 -1.29 0.00 0.00 177.43 177.01 1y2m h PHE 437 N 0.48 0.22 -0.30 1.19 3.57 -0.49 -0.51 116.94 121.10 1y2m h PHE 437 Ca 0.11 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.54 1y2m h PHE 437 Cb 0.29 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.94 1y2m h PHE 437 CO 0.01 0.13 -0.13 1.79 -2.23 0.00 0.00 178.31 177.88 1y2m h THR 438 N 0.23 1.24 0.16 4.41 1.35 -0.44 0.12 112.91 119.97 1y2m h THR 438 Ca 0.07 -1.05 -0.01 0.00 -0.55 0.00 0.00 66.41 64.87 1y2m h THR 438 Cb -0.02 1.15 0.00 0.00 -1.73 0.00 0.00 68.15 67.55 1y2m h THR 438 CO -0.02 0.34 -0.08 1.56 -0.25 0.00 0.00 175.52 177.08 1y2m h GLN 439 N 0.48 -0.20 0.02 4.72 4.20 -0.91 -2.30 115.11 121.12 1y2m h GLN 439 Ca 0.09 0.01 0.02 0.00 0.06 0.00 0.00 58.65 58.83 1y2m h GLN 439 Cb 0.51 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.32 1y2m h GLN 439 CO 0.03 -0.02 -0.12 1.25 -0.67 0.00 0.00 178.83 179.31 1y2m h LEU 440 N -0.36 -0.34 -1.43 1.46 5.85 -0.81 -3.05 115.31 116.63 1y2m h LEU 440 Ca -0.02 0.05 -0.06 0.00 0.84 0.00 0.00 57.88 58.69 1y2m h LEU 440 Cb 0.28 0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 1y2m h LEU 440 CO 0.04 -0.17 -0.27 0.00 -0.34 0.00 0.00 178.44 177.69 1y2m h THR 441 N -0.21 0.96 0.00 1.05 1.03 -0.81 -1.31 112.91 113.62 1y2m h THR 441 Ca 0.04 -1.03 0.00 0.00 -0.01 0.00 0.00 66.41 65.41 1y2m h THR 441 Cb 0.26 1.59 0.00 0.00 -1.07 0.00 0.00 68.15 68.93 1y2m h THR 441 CO -0.11 0.27 0.00 1.21 -0.01 0.00 0.00 175.52 176.88 1y2m n GLU 442 N -3.87 0.36 0.00 0.00 2.13 -0.87 -2.57 120.64 115.82 1y2m n GLU 442 Ca -0.02 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.80 1y2m n GLU 442 Cb 0.36 -1.27 0.00 0.00 0.27 0.00 0.00 31.44 30.80 1y2m n GLU 442 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 1y2m n LEU 444 N 0.65 0.00 -4.45 4.31 4.77 -0.50 -4.04 117.00 117.74 1y2m n LEU 444 Ca 0.00 0.00 -0.40 0.00 -0.03 0.00 0.00 56.01 55.58 1y2m n LEU 444 Cb 0.15 0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.13 1y2m n LEU 444 CO 0.00 0.00 -0.16 0.21 -1.33 0.00 0.00 177.39 176.11 1y2m s ASN 445 N 0.00 5.78 0.54 -1.43 3.84 -1.06 -4.41 114.94 118.20 1y2m s ASN 445 Ca 0.00 -0.66 0.26 0.00 0.21 0.00 0.00 52.86 52.67 1y2m s ASN 445 Cb 0.00 -2.06 1.55 0.00 -0.55 0.00 0.00 41.25 40.19 1y2m s ASN 445 CO 0.00 -0.28 2.15 0.00 -2.79 0.00 0.00 177.10 176.17 1y2m h ALA 446 N 8.44 1.48 0.00 1.71 0.00 -1.89 -2.14 119.26 126.86 1y2m h ALA 446 Ca -0.30 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1y2m h ALA 446 Cb 1.14 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1y2m h ALA 446 CO 0.65 0.09 0.00 0.41 0.00 0.00 0.00 179.25 180.39 1y2m n GLY 447 N -1.05 1.43 1.94 0.00 0.00 -1.26 -4.60 105.19 101.65 1y2m n GLY 447 Ca -0.02 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.96 1y2m n GLY 447 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1y2m n ASN 449 N 0.11 -1.42 -3.73 1.61 0.23 -0.81 -5.02 115.26 106.23 1y2m n ASN 449 Ca 0.00 0.27 -0.25 0.00 -0.53 0.00 0.00 54.58 54.06 1y2m n ASN 449 Cb 0.26 -1.47 0.05 0.00 -2.08 0.00 0.00 39.78 36.54 1y2m n ASN 449 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1y2m n ARG 450 N -1.98 -6.24 -0.81 -3.83 1.74 -1.26 -2.76 116.66 101.52 1y2m n ARG 450 Ca -0.04 0.69 0.00 0.00 -0.77 0.00 0.00 57.85 57.74 1y2m n ARG 450 Cb 0.34 -5.58 0.00 0.00 -1.02 0.00 0.00 32.46 26.20 1y2m n ARG 450 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1y2m n GLY 451 N -1.70 0.57 3.76 -0.13 0.00 -1.25 -4.99 105.19 101.44 1y2m n GLY 451 Ca -0.07 -0.19 -0.38 0.00 0.00 0.00 0.00 46.02 45.39 1y2m n GLY 451 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1y2m s LEU 452 N 0.00 3.98 0.43 0.99 1.43 -1.11 -4.88 118.68 119.51 1y2m s LEU 452 Ca 0.00 2.57 -0.24 0.00 -1.03 0.00 0.00 54.13 55.43 1y2m s LEU 452 Cb 0.00 -4.19 -0.10 0.00 0.03 0.00 0.00 46.19 41.93 1y2m s LEU 452 CO 0.00 -1.19 0.99 -2.65 0.23 0.00 0.00 176.35 173.73 1y2m n PRO 453 N -0.61 1.31 -1.64 1.29 -0.02 -1.26 -4.85 135.00 129.22 1y2m n PRO 453 Ca 0.08 0.47 -0.46 0.00 -2.02 0.00 0.00 63.50 61.56 1y2m n PRO 453 Cb 0.46 -2.03 -0.03 0.00 -0.02 0.00 0.00 33.50 31.88 1y2m n PRO 453 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1y2m n SER 454 N 0.48 2.28 -1.20 2.55 3.41 -0.74 -1.22 113.62 119.19 1y2m n SER 454 Ca 0.10 1.14 -0.14 0.00 -0.26 0.00 0.00 58.87 59.70 1y2m n SER 454 Cb 0.39 -1.35 -0.06 0.00 -0.26 0.00 0.00 64.21 62.94 1y2m n SER 454 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1y2m n LEU 456 N -1.72 -1.59 -4.74 0.00 4.77 -0.35 -0.39 117.00 112.98 1y2m n LEU 456 Ca -0.14 -0.33 -0.41 0.00 -0.03 0.00 0.00 56.01 55.10 1y2m n LEU 456 Cb 0.54 -2.18 -0.03 0.00 -2.33 0.00 0.00 43.42 39.42 1y2m n LEU 456 CO 0.21 0.14 1.00 0.00 -1.33 0.00 0.00 177.39 177.41 1y2m s ALA 457 N -2.91 3.53 -0.35 -1.18 0.00 -0.30 -4.77 121.76 115.78 1y2m s ALA 457 Ca 0.35 1.12 0.21 0.00 0.00 0.00 0.00 51.96 53.65 1y2m s ALA 457 Cb -0.19 -3.49 0.23 0.00 0.00 0.00 0.00 23.12 19.67 1y2m s ALA 457 CO 0.44 -0.55 1.47 0.00 0.00 0.00 0.00 175.76 177.11 1y2m h ALA 458 N 5.41 0.86 -3.18 0.00 0.00 -1.77 -3.44 119.26 117.13 1y2m h ALA 458 Ca -0.45 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1y2m h ALA 458 Cb 1.21 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1y2m h ALA 458 CO 0.78 0.14 0.00 0.39 0.00 0.00 0.00 179.25 180.55 1y2m n GLU 459 N -3.05 1.84 -1.68 0.00 -0.58 -1.26 -5.06 120.64 110.85 1y2m n GLU 459 Ca 0.03 0.00 -0.45 0.00 -0.42 0.00 0.00 57.16 56.32 1y2m n GLU 459 Cb 0.58 0.00 -0.04 0.00 -0.57 0.00 0.00 31.44 31.41 1y2m n GLU 459 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1y2m n ASP 460 N -0.62 3.68 0.25 1.62 8.00 -1.26 -4.85 116.55 123.37 1y2m n ASP 460 Ca 0.00 1.00 0.17 0.00 0.71 0.00 0.00 54.79 56.67 1y2m n ASP 460 Cb 0.00 -1.47 0.84 0.00 -0.02 0.00 0.00 41.12 40.47 1y2m n ASP 460 CO 0.00 0.00 0.00 -0.65 -0.39 0.00 0.00 177.20 176.16 1y2m h PRO 461 N 8.28 0.00 0.00 -0.24 0.11 -1.83 -2.73 132.00 135.59 1y2m h PRO 461 Ca -0.47 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.62 1y2m h PRO 461 Cb 1.24 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 1y2m h PRO 461 CO 0.93 0.00 -0.10 0.66 -0.21 0.00 0.00 178.00 179.28 1y2m h SER 462 N 0.00 0.00 0.00 -2.05 4.64 -1.88 -2.84 113.55 111.42 1y2m h SER 462 Ca 0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 1y2m h SER 462 Cb 0.17 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.20 1y2m h SER 462 CO 0.00 0.10 -0.39 0.18 -0.87 0.00 0.00 176.83 175.86 1y2m n LEU 463 N -3.59 1.83 -3.63 5.97 4.77 -1.04 -4.99 117.00 116.31 1y2m n LEU 463 Ca -0.02 -2.79 -0.07 0.00 -0.03 0.00 0.00 56.01 53.10 1y2m n LEU 463 Cb 0.23 -0.32 -0.08 0.00 -2.33 0.00 0.00 43.42 40.92 1y2m n LEU 463 CO 0.29 0.80 0.06 -0.55 -1.33 0.00 0.00 177.39 176.66 1y2m s SER 464 N -2.51 -0.38 -0.23 -1.43 0.15 -1.07 -4.57 113.70 103.67 1y2m s SER 464 Ca 0.28 1.04 0.10 0.00 0.70 0.00 0.00 55.95 58.07 1y2m s SER 464 Cb 0.27 1.49 0.43 0.00 -1.71 0.00 0.00 66.02 66.50 1y2m s SER 464 CO -0.03 -0.23 1.21 -1.22 1.20 0.00 0.00 173.24 174.16 1y2m n TYR 465 N 5.40 0.65 0.00 3.44 4.01 -1.26 -4.52 117.16 124.88 1y2m n TYR 465 Ca -0.09 -1.65 0.00 0.00 -0.16 0.00 0.00 57.90 56.00 1y2m n TYR 465 Cb 0.49 -0.27 0.00 0.00 -0.31 0.00 0.00 39.34 39.25 1y2m n TYR 465 CO 0.00 0.00 0.00 1.58 -0.46 0.00 0.00 176.86 177.98 1y2m n HIS 466 N -0.99 0.00 0.14 -0.72 -0.00 -1.25 -0.35 115.22 112.05 1y2m n HIS 466 Ca 0.25 0.00 0.08 0.00 0.46 0.00 0.00 57.72 58.51 1y2m n HIS 466 Cb 0.76 0.00 0.25 0.00 -0.12 0.00 0.00 29.99 30.89 1y2m n HIS 466 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1y2m h LYS 468 N 3.14 1.07 -0.78 0.00 3.64 -0.91 -1.02 116.57 121.72 1y2m h LYS 468 Ca 0.00 -0.22 -0.05 0.00 -1.27 0.00 0.00 60.65 59.11 1y2m h LYS 468 Cb 0.90 -0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 32.53 1y2m h LYS 468 CO 0.07 0.91 0.29 0.78 -2.27 0.00 0.00 179.45 179.23 1y2m h GLY 469 N 1.08 1.26 1.52 5.01 0.00 -1.77 -2.38 103.07 107.80 1y2m h GLY 469 Ca 0.22 -0.71 -0.10 0.00 0.00 0.00 0.00 47.33 46.75 1y2m h GLY 469 CO -0.01 0.66 -0.23 1.41 0.00 0.00 0.00 176.54 178.38 1y2m h LEU 470 N 1.14 0.56 -0.53 3.11 3.38 -1.72 0.14 115.31 121.38 1y2m h LEU 470 Ca 0.26 -0.19 0.06 0.00 0.09 0.00 0.00 57.88 58.10 1y2m h LEU 470 Cb 0.25 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 40.79 1y2m h LEU 470 CO -0.02 0.79 0.25 -0.78 0.09 0.00 0.00 178.44 178.77 1y2m h ASP 471 N 0.49 0.33 -0.29 -0.43 3.58 -0.78 0.13 116.42 119.45 1y2m h ASP 471 Ca 0.07 0.04 -0.09 0.00 0.42 0.00 0.00 57.03 57.47 1y2m h ASP 471 Cb 0.67 -0.02 -0.01 0.00 1.72 0.00 0.00 39.33 41.69 1y2m h ASP 471 CO 0.05 0.22 -0.17 0.40 -2.88 0.00 0.00 179.24 176.86 1y2m h ILE 472 N 0.48 1.30 -0.55 2.25 2.04 -0.94 -2.58 117.51 119.51 1y2m h ILE 472 Ca 0.24 -1.29 0.00 0.00 1.00 0.00 0.00 64.86 64.82 1y2m h ILE 472 Cb 0.19 1.50 -0.03 0.00 -0.74 0.00 0.00 36.82 37.75 1y2m h ILE 472 CO -0.19 0.41 0.35 0.00 0.00 0.00 0.00 178.15 178.72 1y2m h ALA 473 N 0.74 0.70 -0.92 1.87 0.00 -0.53 -1.10 119.26 120.01 1y2m h ALA 473 Ca 0.06 -0.05 0.08 0.00 0.00 0.00 0.00 54.91 55.00 1y2m h ALA 473 Cb 0.70 -0.22 -0.07 0.00 0.00 0.00 0.00 17.79 18.20 1y2m h ALA 473 CO 0.05 0.15 0.57 0.00 0.00 0.00 0.00 179.25 180.02 1y2m h ALA 474 N 1.19 1.31 -0.35 0.00 0.00 -0.66 0.16 119.26 120.91 1y2m h ALA 474 Ca 0.20 0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.12 1y2m h ALA 474 Cb -0.06 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 1y2m h ALA 474 CO -0.04 0.28 0.21 0.00 0.00 0.00 0.00 179.25 179.70 1y2m h ALA 475 N 1.45 0.44 -0.30 0.00 0.00 -0.98 -1.81 119.26 118.06 1y2m h ALA 475 Ca 0.42 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.33 1y2m h ALA 475 Cb 0.27 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1y2m h ALA 475 CO -0.21 -0.13 0.16 0.00 0.00 0.00 0.00 179.25 179.08 1y2m h ALA 476 N 1.15 0.37 -0.83 0.00 0.00 -0.12 -0.32 119.26 119.51 1y2m h ALA 476 Ca 0.14 0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.05 1y2m h ALA 476 Cb -0.02 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 1y2m h ALA 476 CO -0.05 -0.22 0.54 1.88 0.00 0.00 0.00 179.25 181.40 1y2m h TYR 477 N 0.33 1.05 -0.34 0.00 0.05 -0.56 -2.03 116.97 115.48 1y2m h TYR 477 Ca 0.12 0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.91 1y2m h TYR 477 Cb 0.02 -0.36 -0.02 0.00 1.01 0.00 0.00 36.73 37.39 1y2m h TYR 477 CO -0.09 0.67 0.17 1.15 -1.05 0.00 0.00 178.16 179.01 1y2m h THR 478 N 1.13 1.15 -0.43 -2.88 2.02 -0.82 -1.01 112.91 112.08 1y2m h THR 478 Ca 0.30 -0.42 0.04 0.00 0.77 0.00 0.00 66.41 67.10 1y2m h THR 478 Cb -0.12 0.81 -0.04 0.00 -1.74 0.00 0.00 68.15 67.06 1y2m h THR 478 CO -0.06 0.16 0.20 0.28 0.37 0.00 0.00 175.52 176.46 1y2m h SER 479 N 0.41 0.28 -0.87 4.18 0.02 -0.93 -1.89 113.55 114.75 1y2m h SER 479 Ca 0.12 0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 61.07 1y2m h SER 479 Cb 0.09 -0.02 -0.04 0.00 0.14 0.00 0.00 62.40 62.57 1y2m h SER 479 CO -0.02 0.20 0.46 -0.08 -1.14 0.00 0.00 176.83 176.26 1y2m h GLU 480 N 0.40 1.23 -0.63 3.45 4.81 -1.11 -2.17 114.58 120.56 1y2m h GLU 480 Ca 0.19 -0.15 0.01 0.00 -0.13 0.00 0.00 59.36 59.27 1y2m h GLU 480 Cb 0.11 -0.23 -0.03 0.00 0.63 0.00 0.00 28.75 29.23 1y2m h GLU 480 CO -0.14 0.91 0.42 -0.07 -0.73 0.00 0.00 179.01 179.39 1y2m h LEU 481 N 1.22 0.72 -0.28 1.64 3.38 -0.88 -1.40 115.31 119.71 1y2m h LEU 481 Ca 0.30 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.24 1y2m h LEU 481 Cb 0.05 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 1y2m h LEU 481 CO -0.05 0.52 0.09 1.23 0.09 0.00 0.00 178.44 180.33 1y2m h GLY 482 N 0.85 0.46 1.19 0.83 0.00 -0.71 -2.11 103.07 103.58 1y2m h GLY 482 Ca 0.23 -0.27 -0.10 0.00 0.00 0.00 0.00 47.33 47.19 1y2m h GLY 482 CO -0.05 0.25 -0.07 0.84 0.00 0.00 0.00 176.54 177.51 1y2m h HIS 483 N 0.28 1.06 -0.44 5.60 -0.00 -1.25 -2.69 115.15 117.71 1y2m h HIS 483 Ca 0.09 -0.20 -0.00 0.00 -0.00 0.00 0.00 60.37 60.26 1y2m h HIS 483 Cb 0.23 -0.27 -0.02 0.00 -0.00 0.00 0.00 27.41 27.35 1y2m h HIS 483 CO 0.00 0.98 0.26 -0.07 -0.00 0.00 0.00 177.93 179.10 1y2m h LEU 484 N 0.87 0.52 -0.18 0.26 3.38 -1.06 -3.05 115.31 116.04 1y2m h LEU 484 Ca 0.15 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.09 1y2m h LEU 484 Cb 0.61 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1y2m h LEU 484 CO 0.04 0.41 0.00 0.00 0.09 0.00 0.00 178.44 178.98 1y2m n ALA 485 N -2.47 1.63 -1.74 1.53 0.00 -0.81 -4.77 120.51 113.89 1y2m n ALA 485 Ca 0.03 -0.01 -0.37 0.00 0.00 0.00 0.00 53.44 53.09 1y2m n ALA 485 Cb 0.08 -1.26 0.06 0.00 0.00 0.00 0.00 19.45 18.33 1y2m n ALA 485 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1y2m s ASN 486 N -3.31 4.81 0.44 0.00 0.01 -1.16 -4.53 114.94 111.21 1y2m s ASN 486 Ca 0.06 2.65 -0.24 0.00 -0.71 0.00 0.00 52.86 54.63 1y2m s ASN 486 Cb 0.09 -2.62 -0.08 0.00 0.41 0.00 0.00 41.25 39.05 1y2m s ASN 486 CO 0.28 -1.87 1.15 -2.16 -1.51 0.00 0.00 177.10 173.00 1y2m s PRO 487 N -3.25 3.88 0.02 -0.60 0.04 -1.26 -4.94 135.00 128.89 1y2m s PRO 487 Ca 0.79 1.75 0.09 0.00 0.04 0.00 0.00 61.00 63.68 1y2m s PRO 487 Cb -0.38 -2.49 -0.23 0.00 0.04 0.00 0.00 34.50 31.45 1y2m s PRO 487 CO 0.42 -0.44 0.89 0.28 0.04 0.00 0.00 177.00 178.18 1y2m h VAL 488 N 2.02 1.18 0.00 -0.36 2.07 -1.92 -3.40 116.25 115.83 1y2m h VAL 488 Ca -0.49 -2.96 0.00 0.00 0.82 0.00 0.00 66.70 64.07 1y2m h VAL 488 Cb 1.24 2.60 0.00 0.00 -1.52 0.00 0.00 31.29 33.61 1y2m h VAL 488 CO 0.61 0.70 0.00 0.35 0.02 0.00 0.00 177.57 179.25 1y2m n THR 489 N -3.20 0.83 1.77 2.57 -2.24 -1.26 -1.56 114.28 111.20 1y2m n THR 489 Ca -0.11 0.21 0.12 0.00 -2.27 0.00 0.00 64.05 62.00 1y2m n THR 489 Cb 1.01 -0.95 0.63 0.00 -2.10 0.00 0.00 70.33 68.93 1y2m n THR 489 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1y2m n THR 490 N -1.44 0.04 -1.29 4.28 -2.24 -1.26 -4.13 114.28 108.24 1y2m n THR 490 Ca 0.05 -0.11 -0.04 0.00 -2.27 0.00 0.00 64.05 61.67 1y2m n THR 490 Cb 0.16 -0.09 0.22 0.00 -2.10 0.00 0.00 70.33 68.52 1y2m n THR 490 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1y2m n HIS 491 N -0.48 1.45 -2.03 4.78 8.25 -0.60 -5.02 115.22 121.58 1y2m n HIS 491 Ca 0.18 -1.45 -0.42 0.00 -0.26 0.00 0.00 57.72 55.77 1y2m n HIS 491 Cb 0.18 -0.54 -0.03 0.00 1.12 0.00 0.00 29.99 30.72 1y2m n HIS 491 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1y2m s VAL 492 N -3.15 3.07 0.16 1.59 1.01 -1.26 -5.02 120.40 116.80 1y2m s VAL 492 Ca 0.47 0.67 0.03 0.00 0.00 0.00 0.00 61.98 63.14 1y2m s VAL 492 Cb 0.41 -3.43 -0.03 0.00 0.00 0.00 0.00 36.38 33.32 1y2m s VAL 492 CO 0.04 0.03 0.29 -1.10 0.00 0.00 0.00 175.10 174.36 1y2m s GLN 493 N 1.79 3.42 -1.02 2.72 -1.52 -1.26 -5.03 119.66 118.76 1y2m s GLN 493 Ca 0.69 -0.63 -0.19 0.00 -1.95 0.00 0.00 55.36 53.28 1y2m s GLN 493 Cb -0.39 -2.95 -0.09 0.00 -0.22 0.00 0.00 33.01 29.37 1y2m s GLN 493 CO 0.31 0.51 2.03 -0.35 -0.25 0.00 0.00 175.29 177.54 1y2m n PRO 494 N -0.63 1.99 -2.37 2.91 -0.04 -1.26 -4.71 135.00 130.89 1y2m n PRO 494 Ca -0.07 -2.12 -0.36 0.00 -0.04 0.00 0.00 63.50 60.90 1y2m n PRO 494 Cb 0.54 -3.06 -0.02 0.00 -0.04 0.00 0.00 33.50 30.93 1y2m n PRO 494 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1y2m s ALA 495 N 4.39 2.98 0.00 0.55 0.00 -1.22 -3.24 121.76 125.22 1y2m s ALA 495 Ca 0.54 0.83 0.00 0.00 0.00 0.00 0.00 51.96 53.33 1y2m s ALA 495 Cb 0.14 -3.34 0.00 0.00 0.00 0.00 0.00 23.12 19.92 1y2m s ALA 495 CO 0.04 -0.50 0.00 -1.91 0.00 0.00 0.00 175.76 173.39 1y2m n GLU 496 N -0.45 0.00 0.00 0.00 2.13 -1.26 -1.27 120.64 119.79 1y2m n GLU 496 Ca 0.07 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.89 1y2m n GLU 496 Cb 0.49 -3.78 0.00 0.00 0.27 0.00 0.00 31.44 28.42 1y2m n GLU 496 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1y2m n ALA 498 N 0.98 0.22 -0.20 4.31 0.00 -1.20 -4.01 120.51 120.62 1y2m n ALA 498 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.38 1y2m n ALA 498 Cb 0.00 -0.17 0.10 0.00 0.00 0.00 0.00 19.45 19.37 1y2m n ALA 498 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 1y2m h ASN 499 N 0.07 0.95 -1.56 0.00 -1.24 -1.85 -2.84 115.58 109.11 1y2m h ASN 499 Ca 0.00 -0.21 -0.72 0.00 0.71 0.00 0.00 56.30 56.08 1y2m h ASN 499 Cb 0.00 -0.25 -0.29 0.00 0.73 0.00 0.00 38.32 38.51 1y2m h ASN 499 CO 0.00 0.95 0.88 0.00 -1.29 0.00 0.00 177.43 177.97 1y2m n GLN 500 N -4.23 2.77 0.28 6.67 6.02 -0.40 -4.75 117.38 123.75 1y2m n GLN 500 Ca 0.04 -3.48 0.16 0.00 -0.01 0.00 0.00 57.00 53.71 1y2m n GLN 500 Cb 0.27 -2.28 0.83 0.00 1.02 0.00 0.00 30.24 30.09 1y2m n GLN 500 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1y2m h ALA 501 N 2.57 1.13 -3.34 -1.58 0.00 -1.63 -3.24 119.26 113.18 1y2m h ALA 501 Ca 0.57 -0.06 -0.67 0.00 0.00 0.00 0.00 54.91 54.76 1y2m h ALA 501 Cb 0.40 -0.01 -0.29 0.00 0.00 0.00 0.00 17.79 17.89 1y2m h ALA 501 CO 1.46 0.08 -0.81 0.14 0.00 0.00 0.00 179.25 180.12 1y2m s VAL 502 N -4.03 2.64 -0.10 0.00 -7.23 -1.26 -4.50 120.40 105.92 1y2m s VAL 502 Ca -0.02 -0.81 -0.10 0.00 -1.81 0.00 0.00 61.98 59.24 1y2m s VAL 502 Cb 0.12 -2.07 0.03 0.00 0.56 0.00 0.00 36.38 35.01 1y2m s VAL 502 CO 0.53 0.54 0.27 0.54 -0.31 0.00 0.00 175.10 176.68 1y2m s ASN 503 N 0.33 -0.28 0.34 4.85 2.20 -1.26 -4.97 114.94 116.15 1y2m s ASN 503 Ca -0.14 0.53 0.17 0.00 -0.94 0.00 0.00 52.86 52.48 1y2m s ASN 503 Cb -0.17 0.55 0.50 0.00 -2.00 0.00 0.00 41.25 40.13 1y2m s ASN 503 CO 0.07 -0.11 1.65 0.77 -2.94 0.00 0.00 177.10 176.54 1y2m h SER 504 N 5.63 0.00 -3.33 3.54 4.64 -1.62 -3.46 113.55 118.94 1y2m h SER 504 Ca -0.26 0.00 -0.39 0.00 -0.47 0.00 0.00 61.79 60.67 1y2m h SER 504 Cb 1.19 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.27 1y2m h SER 504 CO 0.34 0.43 -0.51 0.18 -0.87 0.00 0.00 176.83 176.40 1y2m n LEU 505 N -3.45 -1.91 -0.17 5.97 4.77 -0.35 -4.78 117.00 117.07 1y2m n LEU 505 Ca 0.00 -0.02 -0.07 0.00 -0.03 0.00 0.00 56.01 55.89 1y2m n LEU 505 Cb 0.58 -2.82 0.02 0.00 -2.33 0.00 0.00 43.42 38.86 1y2m n LEU 505 CO 0.38 -0.15 1.04 0.00 -1.33 0.00 0.00 177.39 177.34 1y2m h ALA 506 N 1.00 0.63 -0.47 -1.18 0.00 -1.82 -1.22 119.26 116.20 1y2m h ALA 506 Ca -0.47 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.27 1y2m h ALA 506 Cb 1.34 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 1y2m h ALA 506 CO 0.55 0.12 -0.08 1.25 0.00 0.00 0.00 179.25 181.09 1y2m h LEU 507 N 0.66 0.90 -0.35 0.00 5.85 -1.90 0.13 115.31 120.60 1y2m h LEU 507 Ca 0.18 -0.35 0.02 0.00 0.84 0.00 0.00 57.88 58.57 1y2m h LEU 507 Cb 0.00 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.76 1y2m h LEU 507 CO -0.03 1.03 0.20 0.40 -0.34 0.00 0.00 178.44 179.70 1y2m h ILE 508 N 0.74 1.02 -0.16 4.05 2.04 -1.77 0.12 117.51 123.55 1y2m h ILE 508 Ca 0.12 -0.14 0.01 0.00 1.00 0.00 0.00 64.86 65.86 1y2m h ILE 508 Cb 0.62 0.59 -0.01 0.00 -0.74 0.00 0.00 36.82 37.28 1y2m h ILE 508 CO 0.04 0.07 0.07 -1.28 0.00 0.00 0.00 178.15 177.05 1y2m h SER 509 N 0.40 0.10 -0.75 1.72 0.87 -0.90 -1.21 113.55 113.77 1y2m h SER 509 Ca 0.14 0.01 0.06 0.00 -1.23 0.00 0.00 61.79 60.77 1y2m h SER 509 Cb 0.01 -0.01 -0.05 0.00 -0.44 0.00 0.00 62.40 61.92 1y2m h SER 509 CO -0.07 0.08 0.49 0.00 -0.53 0.00 0.00 176.83 176.80 1y2m h ALA 510 N 1.09 1.68 -0.61 6.23 0.00 -0.42 0.28 119.26 127.51 1y2m h ALA 510 Ca 0.07 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 1y2m h ALA 510 Cb 0.02 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1y2m h ALA 510 CO -0.06 0.21 0.12 0.00 0.00 0.00 0.00 179.25 179.52 1y2m h ARG 511 N 0.80 0.99 -0.36 0.00 3.08 -0.02 -0.65 114.38 118.22 1y2m h ARG 511 Ca 0.33 -0.25 -0.14 0.00 0.07 0.00 0.00 59.98 59.98 1y2m h ARG 511 Cb 0.25 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 1y2m h ARG 511 CO -0.11 0.92 -0.33 0.00 -1.07 0.00 0.00 179.97 179.38 1y2m h ARG 512 N 0.90 0.80 -0.48 0.04 2.47 -0.35 -1.88 114.38 115.88 1y2m h ARG 512 Ca 0.19 -0.38 -0.08 0.00 -1.26 0.00 0.00 59.98 58.44 1y2m h ARG 512 Cb 0.40 -0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 28.69 1y2m h ARG 512 CO 0.01 1.01 -0.04 1.15 0.56 0.00 0.00 179.97 182.66 1y2m h THR 513 N 0.67 1.25 -0.80 2.04 2.02 -0.82 -0.68 112.91 116.59 1y2m h THR 513 Ca 0.07 -1.08 0.04 0.00 0.77 0.00 0.00 66.41 66.21 1y2m h THR 513 Cb 0.88 0.93 -0.05 0.00 -1.74 0.00 0.00 68.15 68.16 1y2m h THR 513 CO 0.08 0.38 0.51 0.74 0.37 0.00 0.00 175.52 177.59 1y2m h THR 514 N 0.76 1.11 -0.43 3.16 2.02 -0.88 0.28 112.91 118.92 1y2m h THR 514 Ca 0.14 -0.34 -0.05 0.00 0.77 0.00 0.00 66.41 66.93 1y2m h THR 514 Cb 0.51 0.04 -0.02 0.00 -1.74 0.00 0.00 68.15 66.95 1y2m h THR 514 CO 0.03 0.18 0.06 -0.08 0.37 0.00 0.00 175.52 176.07 1y2m h GLU 515 N 0.98 0.71 -0.88 6.66 4.81 -0.87 -2.23 114.58 123.76 1y2m h GLU 515 Ca 0.32 -0.20 0.06 0.00 -0.13 0.00 0.00 59.36 59.41 1y2m h GLU 515 Cb 0.03 -0.08 -0.06 0.00 0.63 0.00 0.00 28.75 29.27 1y2m h GLU 515 CO -0.12 0.75 0.55 0.77 -0.73 0.00 0.00 179.01 180.23 1y2m h SER 516 N 0.56 0.88 -0.82 1.04 0.02 -0.62 0.00 113.55 114.62 1y2m h SER 516 Ca 0.13 0.01 0.05 0.00 -0.84 0.00 0.00 61.79 61.14 1y2m h SER 516 Cb 0.39 -0.18 -0.05 0.00 0.14 0.00 0.00 62.40 62.71 1y2m h SER 516 CO 0.01 0.57 0.54 0.78 -1.14 0.00 0.00 176.83 177.59 1y2m h ASN 517 N 1.02 0.83 -0.08 3.07 2.35 -0.64 0.72 115.58 122.85 1y2m h ASN 517 Ca 0.37 -0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 56.10 1y2m h ASN 517 Cb 0.13 -0.18 -0.00 0.00 0.05 0.00 0.00 38.32 38.32 1y2m h ASN 517 CO -0.16 0.55 -0.03 -0.78 -1.65 0.00 0.00 177.43 175.35 1y2m h ASP 518 N 0.95 0.17 -0.66 5.81 3.58 -0.61 0.02 116.42 125.68 1y2m h ASP 518 Ca 0.34 -0.40 -0.08 0.00 0.42 0.00 0.00 57.03 57.31 1y2m h ASP 518 Cb 0.15 -0.05 -0.03 0.00 1.72 0.00 0.00 39.33 41.13 1y2m h ASP 518 CO -0.12 0.53 0.09 0.58 -2.88 0.00 0.00 179.24 177.45 1y2m h VAL 519 N -0.19 1.26 -0.17 2.25 2.07 -0.87 -1.78 116.25 118.83 1y2m h VAL 519 Ca 0.02 -1.07 -0.07 0.00 0.82 0.00 0.00 66.70 66.40 1y2m h VAL 519 Cb 0.46 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 1y2m h VAL 519 CO 0.01 0.40 -0.21 0.25 0.02 0.00 0.00 177.57 178.04 1y2m h LEU 520 N 1.03 0.29 -0.93 2.57 5.85 -0.78 -1.53 115.31 121.80 1y2m h LEU 520 Ca 0.20 -0.08 -0.05 0.00 0.84 0.00 0.00 57.88 58.79 1y2m h LEU 520 Cb 0.47 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.39 1y2m h LEU 520 CO 0.02 0.52 0.24 0.28 -0.34 0.00 0.00 178.44 179.15 1y2m h SER 521 N 0.27 0.94 -0.42 1.25 0.02 -0.40 0.15 113.55 115.36 1y2m h SER 521 Ca 0.05 -0.15 -0.01 0.00 -0.84 0.00 0.00 61.79 60.84 1y2m h SER 521 Cb 0.53 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.81 1y2m h SER 521 CO 0.04 0.86 0.24 -0.07 -1.14 0.00 0.00 176.83 176.75 1y2m h LEU 522 N 0.99 0.52 -0.38 5.07 3.38 -0.80 -0.54 115.31 123.55 1y2m h LEU 522 Ca 0.22 -0.08 -0.07 0.00 0.09 0.00 0.00 57.88 58.04 1y2m h LEU 522 Cb 0.24 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1y2m h LEU 522 CO -0.01 0.45 -0.05 0.25 0.09 0.00 0.00 178.44 179.17 1y2m h LEU 523 N 0.55 0.71 -0.63 1.67 5.85 -0.81 -1.59 115.31 121.06 1y2m h LEU 523 Ca 0.15 -0.34 -0.15 0.00 0.84 0.00 0.00 57.88 58.38 1y2m h LEU 523 Cb 0.04 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 40.87 1y2m h LEU 523 CO -0.02 0.88 -0.64 -0.07 -0.34 0.00 0.00 178.44 178.24 1y2m h LEU 524 N 0.53 0.19 -0.79 2.25 3.38 -0.68 0.07 115.31 120.26 1y2m h LEU 524 Ca 0.10 -0.12 0.01 0.00 0.09 0.00 0.00 57.88 57.97 1y2m h LEU 524 Cb 0.55 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.20 1y2m h LEU 524 CO 0.03 0.78 0.52 0.00 0.09 0.00 0.00 178.44 179.86 1y2m h ALA 525 N 1.22 1.00 -0.13 1.53 0.00 -1.01 -0.34 119.26 121.53 1y2m h ALA 525 Ca -0.01 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1y2m h ALA 525 Cb 1.16 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 1y2m h ALA 525 CO 0.09 0.41 0.01 1.15 0.00 0.00 0.00 179.25 180.91 1y2m h THR 526 N 1.06 1.24 -0.45 0.00 2.02 -0.90 -1.38 112.91 114.49 1y2m h THR 526 Ca 0.29 -0.78 0.04 0.00 0.77 0.00 0.00 66.41 66.73 1y2m h THR 526 Cb -0.11 1.51 -0.04 0.00 -1.74 0.00 0.00 68.15 67.76 1y2m h THR 526 CO -0.07 0.23 0.23 -0.74 0.37 0.00 0.00 175.52 175.54 1y2m h HIS 527 N -0.03 0.41 -0.42 3.16 6.17 -0.85 -1.58 115.15 122.01 1y2m h HIS 527 Ca 0.04 0.02 -0.00 0.00 0.71 0.00 0.00 60.37 61.13 1y2m h HIS 527 Cb 0.34 -0.12 -0.02 0.00 2.52 0.00 0.00 27.41 30.13 1y2m h HIS 527 CO 0.03 0.21 0.25 1.25 0.71 0.00 0.00 177.93 180.37 1y2m h LEU 528 N 0.45 0.52 -0.12 0.26 5.85 -0.87 0.18 115.31 121.58 1y2m h LEU 528 Ca 0.20 -0.07 0.04 0.00 0.84 0.00 0.00 57.88 58.89 1y2m h LEU 528 Cb 0.10 -0.13 -0.05 0.00 0.37 0.00 0.00 40.66 40.96 1y2m h LEU 528 CO -0.14 0.44 -0.15 0.22 -0.34 0.00 0.00 178.44 178.47 1y2m h TYR 529 N 0.56 -0.39 -0.58 1.25 3.20 -1.00 -2.32 116.97 117.69 1y2m h TYR 529 Ca 0.15 0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.98 1y2m h TYR 529 Cb 0.02 0.19 -0.02 0.00 1.54 0.00 0.00 36.73 38.46 1y2m h TYR 529 CO -0.03 -0.22 0.12 0.00 -1.64 0.00 0.00 178.16 176.39 1y2m h VAL 531 N 0.85 1.34 -0.36 0.00 3.04 -0.40 -0.78 116.25 119.94 1y2m h VAL 531 Ca 0.18 -1.66 -0.14 0.00 -1.01 0.00 0.00 66.70 64.06 1y2m h VAL 531 Cb 0.38 1.90 -0.01 0.00 -2.01 0.00 0.00 31.29 31.56 1y2m h VAL 531 CO 0.01 0.47 -0.34 -0.07 -1.01 0.00 0.00 177.57 176.63 1y2m h LEU 532 N 0.00 0.92 -0.45 3.16 3.38 -1.23 -0.07 115.31 121.02 1y2m h LEU 532 Ca -0.00 -0.46 0.00 0.00 0.09 0.00 0.00 57.88 57.50 1y2m h LEU 532 Cb 0.86 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 1y2m h LEU 532 CO 0.06 1.19 0.29 -0.61 0.09 0.00 0.00 178.44 179.46 1y2m h GLN 533 N 0.66 0.60 -0.55 1.13 5.75 -1.21 -1.81 115.11 119.67 1y2m h GLN 533 Ca 0.06 -0.04 0.02 0.00 -0.15 0.00 0.00 58.65 58.54 1y2m h GLN 533 Cb 0.93 -0.13 -0.04 0.00 1.07 0.00 0.00 27.48 29.31 1y2m h GLN 533 CO 0.09 0.41 0.33 0.00 -2.65 0.00 0.00 178.83 177.01 1y2m h ALA 534 N 1.15 0.71 -0.51 3.38 0.00 -0.91 -0.20 119.26 122.89 1y2m h ALA 534 Ca 0.16 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.07 1y2m h ALA 534 Cb -0.05 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 1y2m h ALA 534 CO -0.03 0.05 0.33 0.82 0.00 0.00 0.00 179.25 180.42 1y2m h ILE 535 N 0.66 1.11 -0.68 0.00 2.04 -0.82 0.18 117.51 119.99 1y2m h ILE 535 Ca 0.22 -0.23 -0.06 0.00 1.00 0.00 0.00 64.86 65.80 1y2m h ILE 535 Cb 0.02 0.39 -0.03 0.00 -0.74 0.00 0.00 36.82 36.45 1y2m h ILE 535 CO -0.09 0.12 0.20 0.44 0.00 0.00 0.00 178.15 178.81 1y2m h ASP 536 N 0.66 0.98 -0.04 1.72 3.32 -0.93 -0.63 116.42 121.51 1y2m h ASP 536 Ca 0.19 -0.18 -0.10 0.00 0.02 0.00 0.00 57.03 56.96 1y2m h ASP 536 Cb -0.05 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.23 1y2m h ASP 536 CO -0.06 0.93 -0.28 -0.07 -1.72 0.00 0.00 179.24 178.04 1y2m h LEU 537 N 1.01 0.49 -0.42 1.55 3.38 -0.50 -0.74 115.31 120.08 1y2m h LEU 537 Ca 0.22 -0.17 -0.18 0.00 0.09 0.00 0.00 57.88 57.84 1y2m h LEU 537 Cb 0.31 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.92 1y2m h LEU 537 CO -0.01 0.75 -0.68 -0.09 0.09 0.00 0.00 178.44 178.51 1y2m h ARG 538 N 0.42 0.48 -0.53 1.13 9.65 -0.35 -1.23 114.38 123.95 1y2m h ARG 538 Ca 0.06 -0.36 -0.01 0.00 -1.10 0.00 0.00 59.98 58.56 1y2m h ARG 538 Cb 0.71 0.07 -0.02 0.00 -1.39 0.00 0.00 29.97 29.33 1y2m h ARG 538 CO 0.05 0.99 0.28 0.00 2.80 0.00 0.00 179.97 184.09 1y2m h ALA 539 N 0.92 0.68 -0.78 2.80 0.00 -0.77 -0.23 119.26 121.88 1y2m h ALA 539 Ca -0.02 -0.10 0.02 0.00 0.00 0.00 0.00 54.91 54.81 1y2m h ALA 539 Cb 1.24 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.78 1y2m h ALA 539 CO 0.12 0.21 0.51 0.82 0.00 0.00 0.00 179.25 180.91 1y2m h ILE 540 N 0.71 1.15 -0.55 0.00 2.04 -0.90 -0.47 117.51 119.49 1y2m h ILE 540 Ca 0.19 -0.35 0.00 0.00 1.00 0.00 0.00 64.86 65.70 1y2m h ILE 540 Cb 0.06 0.06 -0.03 0.00 -0.74 0.00 0.00 36.82 36.17 1y2m h ILE 540 CO -0.03 0.18 0.36 -0.08 0.00 0.00 0.00 178.15 178.59 1y2m h GLU 541 N 1.01 0.73 -0.64 2.37 4.81 -0.77 -0.76 114.58 121.33 1y2m h GLU 541 Ca 0.30 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.45 1y2m h GLU 541 Cb -0.04 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 29.15 1y2m h GLU 541 CO -0.09 0.49 0.27 0.74 -0.73 0.00 0.00 179.01 179.69 1y2m h PHE 542 N 0.75 0.96 -0.69 0.92 -1.00 -0.40 0.77 116.94 118.25 1y2m h PHE 542 Ca 0.20 -0.06 -0.05 0.00 2.81 0.00 0.00 57.97 60.87 1y2m h PHE 542 Cb -0.08 -0.29 -0.03 0.00 3.61 0.00 0.00 35.95 39.16 1y2m h PHE 542 CO -0.03 0.74 0.25 0.93 -1.61 0.00 0.00 178.31 178.59 1y2m h GLU 543 N 0.89 1.04 0.05 1.51 4.39 -0.83 -1.78 114.58 119.86 1y2m h GLU 543 Ca 0.22 -0.20 0.00 0.00 0.34 0.00 0.00 59.36 59.71 1y2m h GLU 543 Cb 0.18 -0.16 -0.00 0.00 -0.10 0.00 0.00 28.75 28.66 1y2m h GLU 543 CO -0.02 0.88 -0.04 0.35 -1.16 0.00 0.00 179.01 179.02 1y2m h PHE 544 N 0.99 -0.11 -0.85 4.33 3.57 -0.67 -2.94 116.94 121.25 1y2m h PHE 544 Ca 0.23 0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.75 1y2m h PHE 544 Cb 0.24 0.04 -0.05 0.00 2.79 0.00 0.00 35.95 38.98 1y2m h PHE 544 CO 0.02 -0.07 0.56 0.87 -2.23 0.00 0.00 178.31 177.46 1y2m h LYS 545 N -0.10 1.07 -0.81 1.11 1.57 -0.62 0.30 116.57 119.08 1y2m h LYS 545 Ca 0.00 -0.06 0.08 0.00 -1.87 0.00 0.00 60.65 58.80 1y2m h LYS 545 Cb 0.10 -0.24 -0.07 0.00 0.08 0.00 0.00 32.23 32.10 1y2m h LYS 545 CO -0.01 0.71 0.48 0.87 -0.57 0.00 0.00 179.45 180.93 1y2m h LYS 546 N 1.10 0.80 0.00 3.15 1.57 -1.16 -2.33 116.57 119.70 1y2m h LYS 546 Ca 0.33 -0.05 -0.23 0.00 -1.87 0.00 0.00 60.65 58.83 1y2m h LYS 546 Cb -0.04 -0.18 -0.04 0.00 0.08 0.00 0.00 32.23 32.05 1y2m h LYS 546 CO -0.09 0.53 -1.39 1.96 -0.57 0.00 0.00 179.45 179.89 1y2m h GLN 547 N 0.82 0.00 0.00 3.15 4.20 -1.20 -3.38 115.11 118.70 1y2m h GLN 547 Ca 0.38 0.00 -0.20 0.00 0.06 0.00 0.00 58.65 58.89 1y2m h GLN 547 Cb 0.29 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.04 1y2m h GLN 547 CO -0.22 0.55 -0.98 0.35 -0.67 0.00 0.00 178.83 177.86 1y2m h PHE 548 N 0.00 0.00 0.06 2.96 3.57 -0.23 -3.23 116.94 120.07 1y2m h PHE 548 Ca -0.18 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.35 1y2m h PHE 548 Cb 1.81 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 40.51 1y2m h PHE 548 CO 0.00 0.92 -0.29 0.78 -2.23 0.00 0.00 178.31 177.49 1y2m h GLY 549 N 3.12 -0.51 1.53 2.40 0.00 -1.60 0.64 103.07 108.65 1y2m h GLY 549 Ca -0.03 0.35 0.05 0.00 0.00 0.00 0.00 47.33 47.70 1y2m h GLY 549 CO 0.12 -0.23 0.21 -2.55 0.00 0.00 0.00 176.54 174.09 1y2m h PRO 550 N -0.47 0.21 -0.40 4.80 0.11 -1.78 -2.73 132.00 131.74 1y2m h PRO 550 Ca 0.05 -0.01 -0.13 0.00 0.11 0.00 0.00 66.00 66.01 1y2m h PRO 550 Cb 0.53 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 31.58 1y2m h PRO 550 CO -0.21 0.14 -0.26 0.00 -0.21 0.00 0.00 178.00 177.46 1y2m h ALA 551 N 1.83 0.77 -0.20 -0.75 0.00 -0.97 -0.81 119.26 119.13 1y2m h ALA 551 Ca 0.14 -0.40 0.01 0.00 0.00 0.00 0.00 54.91 54.65 1y2m h ALA 551 Cb 0.26 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1y2m h ALA 551 CO -0.02 0.65 0.12 0.82 0.00 0.00 0.00 179.25 180.82 1y2m h ILE 552 N 0.73 1.03 -0.63 0.00 2.04 -0.76 0.01 117.51 119.93 1y2m h ILE 552 Ca 0.09 -0.08 -0.03 0.00 1.00 0.00 0.00 64.86 65.84 1y2m h ILE 552 Cb 0.81 0.76 -0.03 0.00 -0.74 0.00 0.00 36.82 37.62 1y2m h ILE 552 CO 0.07 0.05 0.28 0.58 0.00 0.00 0.00 178.15 179.12 1y2m h VAL 553 N 0.25 1.22 -0.53 1.67 2.07 -1.34 -0.87 116.25 118.72 1y2m h VAL 553 Ca 0.08 -0.67 -0.00 0.00 0.82 0.00 0.00 66.70 66.93 1y2m h VAL 553 Cb -0.01 0.50 -0.03 0.00 -1.52 0.00 0.00 31.29 30.24 1y2m h VAL 553 CO -0.03 0.27 0.32 -1.28 0.02 0.00 0.00 177.57 176.87 1y2m h SER 554 N 0.87 0.63 -0.38 0.57 0.87 -0.73 -0.07 113.55 115.30 1y2m h SER 554 Ca 0.21 -0.05 -0.12 0.00 -1.23 0.00 0.00 61.79 60.60 1y2m h SER 554 Cb 0.16 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 61.95 1y2m h SER 554 CO -0.02 0.49 -0.21 -0.07 -0.53 0.00 0.00 176.83 176.49 1y2m h LEU 555 N 0.71 0.90 -0.39 2.23 3.38 -0.79 -0.22 115.31 121.13 1y2m h LEU 555 Ca 0.19 -0.33 0.01 0.00 0.09 0.00 0.00 57.88 57.84 1y2m h LEU 555 Cb -0.02 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.45 1y2m h LEU 555 CO -0.04 1.08 0.23 0.40 0.09 0.00 0.00 178.44 180.21 1y2m h ILE 556 N 0.77 1.05 -0.39 1.22 2.04 -0.90 -1.08 117.51 120.22 1y2m h ILE 556 Ca 0.10 -0.16 -0.00 0.00 1.00 0.00 0.00 64.86 65.80 1y2m h ILE 556 Cb 0.76 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 37.36 1y2m h ILE 556 CO 0.06 0.09 0.23 0.44 0.00 0.00 0.00 178.15 178.97 1y2m h ASP 557 N 0.47 0.47 -0.14 1.72 3.32 -0.82 0.27 116.42 121.72 1y2m h ASP 557 Ca 0.15 -0.05 0.02 0.00 0.02 0.00 0.00 57.03 57.16 1y2m h ASP 557 Cb -0.01 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.41 1y2m h ASP 557 CO -0.06 0.38 0.03 -0.61 -1.72 0.00 0.00 179.24 177.26 1y2m h GLN 558 N 0.51 0.09 0.04 3.56 4.15 -0.83 0.59 115.11 123.22 1y2m h GLN 558 Ca 0.14 -0.01 -0.29 0.00 0.77 0.00 0.00 58.65 59.26 1y2m h GLN 558 Cb 0.00 -0.02 -0.03 0.00 0.21 0.00 0.00 27.48 27.64 1y2m h GLN 558 CO -0.03 0.06 -1.62 0.45 -1.93 0.00 0.00 178.83 175.77 1y2m h HIS 559 N 0.09 0.17 -0.00 3.99 3.86 -1.14 -3.41 115.15 118.71 1y2m h HIS 559 Ca 0.06 -0.12 0.00 0.00 -1.16 0.00 0.00 60.37 59.15 1y2m h HIS 559 Cb 0.05 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 28.51 1y2m h HIS 559 CO -0.12 1.19 -0.07 1.19 0.86 0.00 0.00 177.93 180.99 1y2m n PHE 560 N -3.24 0.00 -0.02 2.45 3.72 0.94 -4.76 117.46 116.55 1y2m n PHE 560 Ca -0.17 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.15 1y2m n PHE 560 Cb 1.03 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 39.54 1y2m n PHE 560 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 1y2m h GLY 561 N 0.81 0.08 0.93 1.37 0.00 -0.73 -2.01 103.07 103.51 1y2m h GLY 561 Ca 0.00 0.09 0.01 0.00 0.00 0.00 0.00 47.33 47.44 1y2m h GLY 561 CO 0.00 -0.10 0.19 1.76 0.00 0.00 0.00 176.54 178.39 1y2m h SER 562 N -0.05 0.30 0.00 0.19 0.02 -1.86 -2.62 113.55 109.53 1y2m h SER 562 Ca 0.09 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 1y2m h SER 562 Cb 0.19 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.67 1y2m h SER 562 CO -0.20 0.22 0.00 0.00 -1.14 0.00 0.00 176.83 175.71 1y2m n ALA 563 N -2.21 1.65 -0.18 3.77 0.00 -0.76 -4.90 120.51 117.88 1y2m n ALA 563 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1y2m n ALA 563 Cb 0.05 -1.25 0.00 0.00 0.00 0.00 0.00 19.45 18.25 1y2m n ALA 563 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1y2m n THR 565 N 1.23 -1.48 -0.60 0.00 -2.24 -0.99 -4.73 114.28 105.47 1y2m n THR 565 Ca 0.00 0.27 0.00 0.00 -2.27 0.00 0.00 64.05 62.05 1y2m n THR 565 Cb 0.05 -1.01 0.00 0.00 -2.10 0.00 0.00 70.33 67.27 1y2m n THR 565 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1y2m n GLY 566 N -0.56 0.80 3.73 3.38 0.00 -1.26 -5.04 105.19 106.24 1y2m n GLY 566 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 1y2m n GLY 566 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1y2m s SER 567 N -2.97 4.57 -0.21 1.61 1.04 -1.26 -5.04 113.70 111.45 1y2m s SER 567 Ca 0.00 -0.87 0.12 0.00 0.48 0.00 0.00 55.95 55.68 1y2m s SER 567 Cb 0.00 -0.64 0.72 0.00 0.10 0.00 0.00 66.02 66.21 1y2m s SER 567 CO 0.00 -0.37 1.60 -0.46 0.98 0.00 0.00 173.24 175.00 1y2m n ASN 568 N -1.17 5.16 0.15 7.02 6.94 -1.26 -4.70 115.26 127.41 1y2m n ASN 568 Ca -0.02 -2.81 0.12 0.00 -0.02 0.00 0.00 54.58 51.85 1y2m n ASN 568 Cb 0.62 -0.66 0.21 0.00 -2.36 0.00 0.00 39.78 37.59 1y2m n ASN 568 CO 0.00 0.00 0.00 -0.07 -1.03 0.00 0.00 177.26 176.16 1y2m h LEU 569 N 3.54 0.00 -0.09 -4.53 3.38 -1.96 -3.38 115.31 112.28 1y2m h LEU 569 Ca 0.00 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 1y2m h LEU 569 Cb 1.79 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.54 1y2m h LEU 569 CO 0.43 0.01 0.05 -0.09 0.09 0.00 0.00 178.44 178.93 1y2m h ARG 570 N 0.00 0.13 -0.58 1.13 2.43 -1.99 0.11 114.38 115.61 1y2m h ARG 570 Ca 0.00 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.14 1y2m h ARG 570 Cb 0.90 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.40 1y2m h ARG 570 CO 0.00 0.18 0.32 -0.44 -1.51 0.00 0.00 179.97 178.52 1y2m h ASP 571 N 0.04 0.72 -0.59 -3.80 3.32 -1.98 -1.71 116.42 112.42 1y2m h ASP 571 Ca 0.03 -0.09 -0.01 0.00 0.02 0.00 0.00 57.03 56.98 1y2m h ASP 571 Cb 0.09 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.43 1y2m h ASP 571 CO -0.00 0.60 0.33 -0.08 -1.72 0.00 0.00 179.24 178.37 1y2m h GLU 572 N 0.78 0.82 -0.21 3.56 4.81 -1.73 -0.84 114.58 121.76 1y2m h GLU 572 Ca 0.20 -0.09 -0.00 0.00 -0.13 0.00 0.00 59.36 59.34 1y2m h GLU 572 Cb 0.04 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.25 1y2m h GLU 572 CO -0.03 0.62 0.13 1.25 -0.73 0.00 0.00 179.01 180.24 1y2m h LEU 573 N 0.80 0.26 -0.23 1.64 5.85 -0.65 -0.25 115.31 122.72 1y2m h LEU 573 Ca 0.21 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.89 1y2m h LEU 573 Cb 0.03 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 1y2m h LEU 573 CO -0.04 0.22 0.15 0.58 -0.34 0.00 0.00 178.44 179.02 1y2m h VAL 574 N 0.27 1.07 -0.06 1.05 2.07 -1.18 0.12 116.25 119.59 1y2m h VAL 574 Ca 0.08 -0.13 0.01 0.00 0.82 0.00 0.00 66.70 67.48 1y2m h VAL 574 Cb 0.01 0.74 -0.01 0.00 -1.52 0.00 0.00 31.29 30.51 1y2m h VAL 574 CO -0.01 0.06 -0.02 -0.08 0.02 0.00 0.00 177.57 177.54 1y2m h GLU 575 N 0.31 -0.01 -0.07 1.57 4.81 -0.95 -1.42 114.58 118.82 1y2m h GLU 575 Ca 0.08 0.00 -0.18 0.00 -0.13 0.00 0.00 59.36 59.14 1y2m h GLU 575 Cb -0.02 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.35 1y2m h GLU 575 CO -0.02 -0.01 -0.71 0.87 -0.73 0.00 0.00 179.01 178.41 1y2m h LYS 576 N -0.01 0.36 -0.13 1.92 1.57 -0.87 -1.34 116.57 118.07 1y2m h LYS 576 Ca 0.03 -0.29 0.00 0.00 -1.87 0.00 0.00 60.65 58.52 1y2m h LYS 576 Cb 0.06 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 1y2m h LYS 576 CO -0.06 0.93 0.08 0.28 -0.57 0.00 0.00 179.45 180.11 1y2m h VAL 577 N 0.25 1.04 -0.43 0.50 2.07 -0.71 0.02 116.25 118.99 1y2m h VAL 577 Ca -0.03 -0.10 0.07 0.00 0.82 0.00 0.00 66.70 67.46 1y2m h VAL 577 Cb 1.28 0.88 -0.06 0.00 -1.52 0.00 0.00 31.29 31.88 1y2m h VAL 577 CO 0.12 0.04 0.10 0.78 0.02 0.00 0.00 177.57 178.63 1y2m h ASN 578 N 0.16 0.03 -0.49 0.57 2.35 -1.13 0.57 115.58 117.64 1y2m h ASN 578 Ca 0.05 0.07 -0.02 0.00 -0.55 0.00 0.00 56.30 55.85 1y2m h ASN 578 Cb -0.00 0.09 -0.02 0.00 0.05 0.00 0.00 38.32 38.43 1y2m h ASN 578 CO -0.01 0.05 0.23 0.11 -1.65 0.00 0.00 177.43 176.16 1y2m h LYS 579 N 0.23 0.71 -0.09 0.81 1.57 -1.04 -0.39 116.57 118.38 1y2m h LYS 579 Ca 0.21 -0.11 0.01 0.00 -1.87 0.00 0.00 60.65 58.89 1y2m h LYS 579 Cb 0.25 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 1y2m h LYS 579 CO -0.26 0.60 0.02 1.15 -0.57 0.00 0.00 179.45 180.39 1y2m h THR 580 N 0.65 0.97 0.03 -0.16 2.02 -0.59 -1.68 112.91 114.14 1y2m h THR 580 Ca 0.17 -0.02 0.02 0.00 0.77 0.00 0.00 66.41 67.34 1y2m h THR 580 Cb 0.13 0.90 -0.02 0.00 -1.74 0.00 0.00 68.15 67.42 1y2m h THR 580 CO -0.02 0.01 -0.11 -0.07 0.37 0.00 0.00 175.52 175.70 1y2m h LEU 581 N 0.07 -0.31 -0.58 2.58 3.38 -0.72 -1.81 115.31 117.92 1y2m h LEU 581 Ca 0.04 0.04 0.06 0.00 0.09 0.00 0.00 57.88 58.11 1y2m h LEU 581 Cb 0.02 0.13 -0.05 0.00 0.09 0.00 0.00 40.66 40.85 1y2m h LEU 581 CO -0.04 -0.16 0.29 0.00 0.09 0.00 0.00 178.44 178.62 1y2m h ALA 582 N 0.75 0.75 -0.29 1.53 0.00 -0.94 0.95 119.26 122.01 1y2m h ALA 582 Ca 0.03 0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.84 1y2m h ALA 582 Cb 0.24 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1y2m h ALA 582 CO -0.09 -0.05 -0.35 1.57 0.00 0.00 0.00 179.25 180.33 1y2m h LYS 583 N 0.55 0.65 -0.07 0.00 2.10 -1.20 -3.03 116.57 115.57 1y2m h LYS 583 Ca 0.26 -0.31 -0.24 0.00 -2.00 0.00 0.00 60.65 58.37 1y2m h LYS 583 Cb 0.18 -0.01 0.01 0.00 -0.90 0.00 0.00 32.23 31.52 1y2m h LYS 583 CO -0.18 0.90 -0.90 -0.09 -2.00 0.00 0.00 179.45 177.18 1y2m h ARG 584 N 0.54 0.69 0.00 0.07 9.65 -0.57 -3.20 114.38 121.56 1y2m h ARG 584 Ca 0.06 -0.64 -0.05 0.00 -1.10 0.00 0.00 59.98 58.25 1y2m h ARG 584 Cb 0.85 0.16 -0.01 0.00 -1.39 0.00 0.00 29.97 29.59 1y2m h ARG 584 CO 0.07 1.24 -0.22 -0.07 2.80 0.00 0.00 179.97 183.79 1y2m h LEU 585 N 0.43 0.00 -1.90 3.80 3.38 -0.81 -1.72 115.31 118.50 1y2m h LEU 585 Ca -0.08 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 1y2m h LEU 585 Cb 1.53 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.28 1y2m h LEU 585 CO 0.18 0.22 -0.13 -0.08 0.09 0.00 0.00 178.44 178.72 1y2m h GLU 586 N 0.00 0.00 -0.02 1.13 4.81 -1.52 -2.68 114.58 116.30 1y2m h GLU 586 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1y2m h GLU 586 Cb 0.55 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.93 1y2m h GLU 586 CO 0.03 0.13 -0.35 1.04 -0.73 0.00 0.00 179.01 179.12 1y2m n GLN 587 N -3.80 1.49 -0.52 1.92 6.02 -0.66 -3.94 117.38 117.89 1y2m n GLN 587 Ca -0.02 -1.15 0.04 0.00 -0.01 0.00 0.00 57.00 55.86 1y2m n GLN 587 Cb 0.23 -1.43 0.20 0.00 1.02 0.00 0.00 30.24 30.25 1y2m n GLN 587 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1y2m n THR 588 N 0.24 2.24 0.80 5.09 -2.24 -1.01 -4.73 114.28 114.68 1y2m n THR 588 Ca 0.10 -2.75 0.08 0.00 -2.27 0.00 0.00 64.05 59.21 1y2m n THR 588 Cb 0.47 -0.26 0.43 0.00 -2.10 0.00 0.00 70.33 68.86 1y2m n THR 588 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1y2m n ASN 589 N -1.13 0.00 -0.88 3.42 6.94 -1.25 -1.34 115.26 121.02 1y2m n ASN 589 Ca 0.23 0.06 0.11 0.00 -0.02 0.00 0.00 54.58 54.96 1y2m n ASN 589 Cb 0.80 -0.30 0.09 0.00 -2.36 0.00 0.00 39.78 38.01 1y2m n ASN 589 CO 0.00 0.00 0.00 -1.54 -1.03 0.00 0.00 177.26 174.69 1y2m n SER 590 N -1.30 2.84 -4.82 0.53 3.41 -1.26 -1.79 113.62 111.23 1y2m n SER 590 Ca 0.08 -1.92 -0.33 0.00 -0.26 0.00 0.00 58.87 56.44 1y2m n SER 590 Cb 0.14 0.01 -0.07 0.00 -0.26 0.00 0.00 64.21 64.04 1y2m n SER 590 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 1y2m s TYR 591 N -1.88 3.32 0.72 7.33 4.12 -0.45 -4.72 117.35 125.79 1y2m s TYR 591 Ca 0.26 1.59 -0.13 0.00 0.02 0.00 0.00 57.07 58.81 1y2m s TYR 591 Cb 0.19 -2.84 0.03 0.00 -1.52 0.00 0.00 41.96 37.82 1y2m s TYR 591 CO 0.29 -0.12 1.10 -0.51 0.02 0.00 0.00 175.55 176.32 1y2m s ASP 592 N -2.25 4.83 0.13 2.29 1.01 -1.26 -4.65 116.67 116.76 1y2m s ASP 592 Ca 0.62 1.89 -0.22 0.00 0.71 0.00 0.00 52.55 55.55 1y2m s ASP 592 Cb -0.09 -2.53 -0.04 0.00 1.01 0.00 0.00 42.92 41.27 1y2m s ASP 592 CO 0.15 -1.82 1.69 0.25 0.21 0.00 0.00 175.17 175.64 1y2m h LEU 593 N -0.58 -0.33 0.51 1.23 5.85 -1.97 0.35 115.31 120.38 1y2m h LEU 593 Ca -0.45 0.07 -0.03 0.00 0.84 0.00 0.00 57.88 58.31 1y2m h LEU 593 Cb 1.24 0.17 0.01 0.00 0.37 0.00 0.00 40.66 42.44 1y2m h LEU 593 CO 0.53 -0.14 -0.25 0.58 -0.34 0.00 0.00 178.44 178.82 1y2m h VAL 594 N -0.12 0.43 0.00 1.05 2.07 -1.99 -2.57 116.25 115.13 1y2m h VAL 594 Ca 0.08 -0.29 -0.04 0.00 0.82 0.00 0.00 66.70 67.27 1y2m h VAL 594 Cb 0.24 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 30.55 1y2m h VAL 594 CO -0.20 0.04 -0.19 1.55 0.02 0.00 0.00 177.57 178.80 1y2m h PRO 595 N -0.89 0.00 -0.33 1.57 0.13 -1.94 -2.66 132.00 127.88 1y2m h PRO 595 Ca -0.07 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 65.12 1y2m h PRO 595 Cb 0.60 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.67 1y2m h PRO 595 CO 0.12 0.19 -0.05 -0.09 -0.23 0.00 0.00 178.00 177.93 1y2m h ARG 596 N 0.00 0.03 -0.15 0.86 2.43 -0.73 0.30 114.38 117.12 1y2m h ARG 596 Ca -0.00 -0.00 -0.19 0.00 -0.81 0.00 0.00 59.98 58.97 1y2m h ARG 596 Cb 0.34 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.88 1y2m h ARG 596 CO 0.02 0.02 -0.69 -1.49 -1.51 0.00 0.00 179.97 176.33 1y2m h TRP 597 N 0.03 0.81 -0.56 2.20 4.06 -1.25 -0.67 115.95 120.58 1y2m h TRP 597 Ca 0.16 -0.34 -0.09 0.00 2.06 0.00 0.00 58.89 60.69 1y2m h TRP 597 Cb 0.23 -0.13 -0.02 0.00 -1.00 0.00 0.00 29.16 28.24 1y2m h TRP 597 CO -0.28 1.12 0.00 0.45 -3.56 0.00 0.00 178.44 176.17 1y2m h HIS 598 N 0.44 1.03 -0.32 0.49 3.86 -1.31 -1.19 115.15 118.15 1y2m h HIS 598 Ca -0.02 -0.16 -0.01 0.00 -1.16 0.00 0.00 60.37 59.01 1y2m h HIS 598 Cb 1.27 -0.27 -0.01 0.00 1.06 0.00 0.00 27.41 29.46 1y2m h HIS 598 CO 0.06 0.92 0.16 0.22 0.86 0.00 0.00 177.93 180.15 1y2m h ASP 599 N 0.88 0.41 -0.05 2.45 1.82 -0.68 -0.32 116.42 120.92 1y2m h ASP 599 Ca 0.16 -0.11 -0.00 0.00 -0.39 0.00 0.00 57.03 56.69 1y2m h ASP 599 Cb 0.51 -0.10 -0.00 0.00 0.68 0.00 0.00 39.33 40.41 1y2m h ASP 599 CO 0.03 0.41 0.03 0.00 -1.61 0.00 0.00 179.24 178.09 1y2m h ALA 600 N 1.02 0.07 0.00 -0.78 0.00 -0.88 -1.81 119.26 116.88 1y2m h ALA 600 Ca 0.11 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1y2m h ALA 600 Cb 0.10 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 1y2m h ALA 600 CO -0.02 -0.41 -0.11 0.74 0.00 0.00 0.00 179.25 179.45 1y2m h PHE 601 N 0.03 0.00 -0.57 0.00 0.04 -1.22 -1.16 116.94 114.07 1y2m h PHE 601 Ca 0.02 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.75 1y2m h PHE 601 Cb 0.04 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.16 1y2m h PHE 601 CO -0.06 0.11 0.21 1.03 -0.60 0.00 0.00 178.31 178.99 1y2m h SER 602 N 0.00 0.80 -0.42 2.17 0.87 -0.75 0.37 113.55 116.59 1y2m h SER 602 Ca -0.00 -0.19 -0.05 0.00 -1.23 0.00 0.00 61.79 60.33 1y2m h SER 602 Cb 0.82 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 62.56 1y2m h SER 602 CO 0.01 0.77 0.08 0.15 -0.53 0.00 0.00 176.83 177.32 1y2m h PHE 603 N 0.78 0.73 0.00 2.24 -0.00 -0.99 -2.71 116.94 117.00 1y2m h PHE 603 Ca 0.19 -0.10 -0.06 0.00 -0.00 0.00 0.00 57.97 58.00 1y2m h PHE 603 Cb 0.24 -0.20 -0.01 0.00 -0.00 0.00 0.00 35.95 35.97 1y2m h PHE 603 CO 0.01 0.70 -0.29 0.00 -0.00 0.00 0.00 178.31 178.73 1y2m h ALA 604 N 0.95 1.45 -0.30 2.41 0.00 -0.98 -0.85 119.26 121.93 1y2m h ALA 604 Ca 0.13 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1y2m h ALA 604 Cb 0.35 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1y2m h ALA 604 CO 0.01 0.37 0.15 0.00 0.00 0.00 0.00 179.25 179.77 1y2m h ALA 605 N 1.71 1.70 -0.64 0.00 0.00 -0.59 -0.34 119.26 121.09 1y2m h ALA 605 Ca -0.00 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1y2m h ALA 605 Cb 0.54 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 1y2m h ALA 605 CO 0.04 0.25 0.26 0.78 0.00 0.00 0.00 179.25 180.58 1y2m h GLY 606 N 0.51 1.02 1.00 0.00 0.00 -1.09 -1.13 103.07 103.39 1y2m h GLY 606 Ca 0.11 -0.55 0.01 0.00 0.00 0.00 0.00 47.33 46.89 1y2m h GLY 606 CO -0.02 0.52 0.50 -0.84 0.00 0.00 0.00 176.54 176.71 1y2m h THR 607 N 0.90 1.19 -0.83 4.70 2.02 -1.09 -2.53 112.91 117.28 1y2m h THR 607 Ca 0.21 -0.35 0.01 0.00 0.77 0.00 0.00 66.41 67.05 1y2m h THR 607 Cb 0.20 0.08 -0.04 0.00 -1.74 0.00 0.00 68.15 66.64 1y2m h THR 607 CO -0.02 0.19 0.55 0.58 0.37 0.00 0.00 175.52 177.18 1y2m h VAL 608 N 1.02 1.20 -0.84 3.16 2.07 -0.56 -0.17 116.25 122.14 1y2m h VAL 608 Ca 0.28 -0.38 0.03 0.00 0.82 0.00 0.00 66.70 67.44 1y2m h VAL 608 Cb -0.11 -0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 29.60 1y2m h VAL 608 CO -0.06 0.20 0.54 0.58 0.02 0.00 0.00 177.57 178.85 1y2m h VAL 609 N 1.11 1.15 0.27 2.57 2.07 -0.92 0.34 116.25 122.83 1y2m h VAL 609 Ca 0.31 -0.37 -0.01 0.00 0.82 0.00 0.00 66.70 67.44 1y2m h VAL 609 Cb -0.12 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 29.64 1y2m h VAL 609 CO -0.07 0.20 -0.13 -0.08 0.02 0.00 0.00 177.57 177.51 1y2m h GLU 610 N 1.07 -0.35 -0.68 1.57 4.81 -0.98 -2.44 114.58 117.58 1y2m h GLU 610 Ca 0.33 0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.54 1y2m h GLU 610 Cb -0.02 0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.41 1y2m h GLU 610 CO -0.10 -0.04 0.23 0.28 -0.73 0.00 0.00 179.01 178.65 1y2m h VAL 611 N -0.98 1.24 -0.71 0.32 2.07 -0.98 -2.68 116.25 114.53 1y2m h VAL 611 Ca -0.04 -0.81 -0.19 0.00 0.82 0.00 0.00 66.70 66.48 1y2m h VAL 611 Cb 0.47 0.48 -0.12 0.00 -1.52 0.00 0.00 31.29 30.60 1y2m h VAL 611 CO 0.06 0.32 0.24 0.18 0.02 0.00 0.00 177.57 178.39 1y2m n LEU 612 N -4.28 6.02 0.19 2.57 4.77 0.10 -4.64 117.00 121.73 1y2m n LEU 612 Ca 0.06 -3.21 0.18 0.00 -0.03 0.00 0.00 56.01 53.01 1y2m n LEU 612 Cb 0.20 -0.74 0.82 0.00 -2.33 0.00 0.00 43.42 41.38 1y2m n LEU 612 CO 0.40 0.80 1.15 0.77 -1.33 0.00 0.00 177.39 179.19 1y2m h SER 613 N 2.76 0.00 0.05 -1.43 4.64 -1.07 -1.12 113.55 117.37 1y2m h SER 613 Ca 0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 1y2m h SER 613 Cb 2.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.38 1y2m h SER 613 CO 0.71 0.00 -0.08 -1.54 -0.87 0.00 0.00 176.83 175.05 1y2m n SER 614 N -3.73 1.54 -4.80 4.97 3.41 -1.26 -4.95 113.62 108.79 1y2m n SER 614 Ca 0.02 -1.39 -0.23 0.00 -0.26 0.00 0.00 58.87 57.01 1y2m n SER 614 Cb 0.38 0.05 0.08 0.00 -0.26 0.00 0.00 64.21 64.45 1y2m n SER 614 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1y2m s THR 615 N -2.14 2.34 -2.11 6.66 -4.23 -0.43 -5.01 115.64 110.72 1y2m s THR 615 Ca 0.33 -0.58 0.17 0.00 -1.18 0.00 0.00 61.69 60.43 1y2m s THR 615 Cb 0.20 -2.76 0.44 0.00 1.34 0.00 0.00 72.50 71.73 1y2m s THR 615 CO 0.39 0.00 1.41 -1.54 -0.54 0.00 0.00 174.62 174.33 1y2m n SER 616 N -2.68 2.60 -4.77 3.99 3.41 -1.26 -4.98 113.62 109.94 1y2m n SER 616 Ca 0.12 -1.95 -0.40 0.00 -0.26 0.00 0.00 58.87 56.39 1y2m n SER 616 Cb 0.60 -0.28 0.01 0.00 -0.26 0.00 0.00 64.21 64.28 1y2m n SER 616 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1y2m s LEU 617 N -1.17 4.15 0.59 1.04 1.43 -1.26 -5.01 118.68 118.45 1y2m s LEU 617 Ca 0.34 2.80 -0.07 0.00 -1.03 0.00 0.00 54.13 56.16 1y2m s LEU 617 Cb 0.18 -3.93 -0.00 0.00 0.03 0.00 0.00 46.19 42.47 1y2m s LEU 617 CO 0.25 -1.04 0.92 -0.94 0.23 0.00 0.00 176.35 175.77 1y2m s SER 618 N -0.63 5.76 0.38 2.29 1.04 -1.26 -4.99 113.70 116.30 1y2m s SER 618 Ca 0.59 0.89 0.11 0.00 0.48 0.00 0.00 55.95 58.02 1y2m s SER 618 Cb -0.41 -1.92 0.76 0.00 0.10 0.00 0.00 66.02 64.55 1y2m s SER 618 CO 0.53 -1.00 1.87 -0.07 0.98 0.00 0.00 173.24 175.55 1y2m h LEU 619 N -0.19 0.13 -0.85 2.42 3.38 -2.00 -2.71 115.31 115.49 1y2m h LEU 619 Ca -0.45 -0.03 0.01 0.00 0.09 0.00 0.00 57.88 57.49 1y2m h LEU 619 Cb 1.24 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.91 1y2m h LEU 619 CO 0.61 0.38 0.56 0.00 0.09 0.00 0.00 178.44 180.09 1y2m h ALA 620 N 1.63 1.08 -0.52 1.53 0.00 -1.99 -0.39 119.26 120.61 1y2m h ALA 620 Ca 0.02 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1y2m h ALA 620 Cb 0.51 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1y2m h ALA 620 CO 0.04 0.48 0.18 0.00 0.00 0.00 0.00 179.25 179.94 1y2m h ALA 621 N 1.31 0.68 -0.29 0.00 0.00 -1.89 0.69 119.26 119.76 1y2m h ALA 621 Ca 0.31 -0.18 -0.14 0.00 0.00 0.00 0.00 54.91 54.90 1y2m h ALA 621 Cb -0.13 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.46 1y2m h ALA 621 CO -0.07 0.32 -0.38 0.28 0.00 0.00 0.00 179.25 179.40 1y2m h VAL 622 N 0.70 1.29 -0.69 0.00 2.07 -1.19 -1.77 116.25 116.67 1y2m h VAL 622 Ca 0.17 -1.56 -0.02 0.00 0.82 0.00 0.00 66.70 66.11 1y2m h VAL 622 Cb 0.24 1.60 -0.03 0.00 -1.52 0.00 0.00 31.29 31.58 1y2m h VAL 622 CO -0.01 0.50 0.35 -1.13 0.02 0.00 0.00 177.57 177.31 1y2m h ASN 623 N 0.53 0.87 -0.63 0.57 -1.24 -0.89 -0.76 115.58 114.03 1y2m h ASN 623 Ca 0.04 -0.08 -0.07 0.00 0.71 0.00 0.00 56.30 56.89 1y2m h ASN 623 Cb 0.97 -0.22 -0.02 0.00 0.73 0.00 0.00 38.32 39.77 1y2m h ASN 623 CO 0.09 0.72 0.11 0.00 -1.29 0.00 0.00 177.43 177.06 1y2m h ALA 624 N 1.42 0.83 -0.34 1.57 0.00 -0.66 -0.52 119.26 121.56 1y2m h ALA 624 Ca 0.24 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1y2m h ALA 624 Cb 0.07 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1y2m h ALA 624 CO -0.04 0.59 0.22 2.35 0.00 0.00 0.00 179.25 182.37 1y2m h TRP 625 N 0.95 0.43 -0.54 0.00 7.01 -0.89 -1.32 115.95 121.59 1y2m h TRP 625 Ca 0.19 0.01 0.06 0.00 2.11 0.00 0.00 58.89 61.26 1y2m h TRP 625 Cb 0.42 -0.15 -0.05 0.00 -2.10 0.00 0.00 29.16 27.29 1y2m h TRP 625 CO 0.03 0.28 0.25 -0.22 -2.79 0.00 0.00 178.44 175.99 1y2m h LYS 626 N 0.45 0.46 -0.18 2.65 3.11 -0.58 0.23 116.57 122.71 1y2m h LYS 626 Ca 0.12 -0.03 -0.03 0.00 -2.81 0.00 0.00 60.65 57.90 1y2m h LYS 626 Cb -0.04 -0.10 -0.01 0.00 -1.00 0.00 0.00 32.23 31.08 1y2m h LYS 626 CO -0.03 0.30 -0.01 0.28 -2.81 0.00 0.00 179.45 177.18 1y2m h VAL 627 N 0.47 1.27 -0.78 2.00 2.07 -0.96 -0.54 116.25 119.78 1y2m h VAL 627 Ca 0.25 -0.91 -0.05 0.00 0.82 0.00 0.00 66.70 66.80 1y2m h VAL 627 Cb 0.21 1.51 -0.03 0.00 -1.52 0.00 0.00 31.29 31.45 1y2m h VAL 627 CO -0.20 0.28 0.29 0.00 0.02 0.00 0.00 177.57 177.95 1y2m h ALA 628 N 0.76 1.02 -0.23 1.67 0.00 -0.94 -0.60 119.26 120.93 1y2m h ALA 628 Ca 0.05 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.69 1y2m h ALA 628 Cb 0.42 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1y2m h ALA 628 CO 0.01 0.67 -0.11 0.00 0.00 0.00 0.00 179.25 179.82 1y2m h ALA 629 N 1.15 0.33 -0.42 0.00 0.00 -0.46 0.76 119.26 120.62 1y2m h ALA 629 Ca 0.26 -0.30 0.04 0.00 0.00 0.00 0.00 54.91 54.90 1y2m h ALA 629 Cb 0.25 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 1y2m h ALA 629 CO -0.02 0.18 0.20 0.00 0.00 0.00 0.00 179.25 179.61 1y2m h ALA 630 N 0.72 0.52 -0.91 0.00 0.00 -0.90 -1.07 119.26 117.62 1y2m h ALA 630 Ca 0.05 0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.01 1y2m h ALA 630 Cb 0.61 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.31 1y2m h ALA 630 CO 0.03 -0.17 0.60 0.93 0.00 0.00 0.00 179.25 180.64 1y2m h GLU 631 N 0.40 1.15 -0.38 0.00 5.08 -0.95 0.28 114.58 120.16 1y2m h GLU 631 Ca 0.19 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.46 1y2m h GLU 631 Cb 0.11 -0.26 -0.02 0.00 0.50 0.00 0.00 28.75 29.09 1y2m h GLU 631 CO -0.14 0.76 0.17 1.03 -1.00 0.00 0.00 179.01 179.83 1y2m h SER 632 N 1.19 0.50 -0.69 1.42 0.87 -0.42 -0.91 113.55 115.51 1y2m h SER 632 Ca 0.35 -0.15 -0.05 0.00 -1.23 0.00 0.00 61.79 60.71 1y2m h SER 632 Cb -0.07 -0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 61.73 1y2m h SER 632 CO -0.10 0.51 0.22 0.00 -0.53 0.00 0.00 176.83 176.94 1y2m h ALA 633 N 1.01 0.90 0.40 6.23 0.00 -0.68 0.06 119.26 127.19 1y2m h ALA 633 Ca 0.13 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1y2m h ALA 633 Cb 0.15 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1y2m h ALA 633 CO -0.01 0.58 -0.19 0.82 0.00 0.00 0.00 179.25 180.44 1y2m h ILE 634 N 1.01 0.61 -0.86 0.00 2.04 -0.79 -0.16 117.51 119.36 1y2m h ILE 634 Ca 0.22 -0.07 0.01 0.00 1.00 0.00 0.00 64.86 66.02 1y2m h ILE 634 Cb 0.29 0.65 -0.04 0.00 -0.74 0.00 0.00 36.82 36.98 1y2m h ILE 634 CO -0.01 0.01 0.57 0.77 0.00 0.00 0.00 178.15 179.50 1y2m h SER 635 N -0.58 1.00 -0.65 1.72 4.64 -1.07 -1.91 113.55 116.70 1y2m h SER 635 Ca -0.06 -0.03 -0.05 0.00 -0.47 0.00 0.00 61.79 61.18 1y2m h SER 635 Cb 0.44 -0.25 -0.03 0.00 -0.31 0.00 0.00 62.40 62.25 1y2m h SER 635 CO 0.09 0.73 0.21 0.25 -0.87 0.00 0.00 176.83 177.24 1y2m h LEU 636 N 1.17 0.94 -0.67 5.97 5.85 -0.84 -1.73 115.31 126.00 1y2m h LEU 636 Ca 0.32 -0.20 0.01 0.00 0.84 0.00 0.00 57.88 58.84 1y2m h LEU 636 Cb -0.13 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 40.62 1y2m h LEU 636 CO -0.07 0.89 0.44 0.74 -0.34 0.00 0.00 178.44 180.11 1y2m h THR 637 N 0.93 1.15 -0.68 1.05 2.02 -0.60 0.31 112.91 117.09 1y2m h THR 637 Ca 0.21 -0.30 -0.02 0.00 0.77 0.00 0.00 66.41 67.07 1y2m h THR 637 Cb 0.29 0.19 -0.03 0.00 -1.74 0.00 0.00 68.15 66.85 1y2m h THR 637 CO -0.01 0.16 0.36 0.03 0.37 0.00 0.00 175.52 176.43 1y2m h ARG 638 N 0.89 0.96 -0.29 6.66 3.08 -0.95 -1.09 114.38 123.64 1y2m h ARG 638 Ca 0.25 -0.12 -0.03 0.00 0.07 0.00 0.00 59.98 60.15 1y2m h ARG 638 Cb -0.07 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 29.78 1y2m h ARG 638 CO -0.07 0.74 0.08 0.37 -1.07 0.00 0.00 179.97 180.03 1y2m h GLN 639 N 0.94 0.46 -0.78 0.04 4.15 -0.77 -1.11 115.11 118.05 1y2m h GLN 639 Ca 0.24 -0.10 -0.04 0.00 0.77 0.00 0.00 58.65 59.51 1y2m h GLN 639 Cb 0.07 -0.06 -0.04 0.00 0.21 0.00 0.00 27.48 27.66 1y2m h GLN 639 CO -0.04 0.52 0.33 0.28 -1.93 0.00 0.00 178.83 178.00 1y2m h VAL 640 N 0.31 1.25 0.08 2.39 2.07 -0.75 -0.22 116.25 121.39 1y2m h VAL 640 Ca 0.09 -0.77 -0.00 0.00 0.82 0.00 0.00 66.70 66.84 1y2m h VAL 640 Cb 0.26 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 1y2m h VAL 640 CO -0.00 0.32 -0.04 0.03 0.02 0.00 0.00 177.57 177.90 1y2m h ARG 641 N 1.13 -0.11 -0.91 1.57 3.08 -1.09 -2.16 114.38 115.89 1y2m h ARG 641 Ca 0.26 0.01 0.04 0.00 0.07 0.00 0.00 59.98 60.36 1y2m h ARG 641 Cb 0.18 0.02 -0.06 0.00 0.08 0.00 0.00 29.97 30.20 1y2m h ARG 641 CO -0.03 -0.01 0.59 0.93 -1.07 0.00 0.00 179.97 180.38 1y2m h GLU 642 N -0.18 1.09 -0.67 0.04 4.39 -0.86 -1.02 114.58 117.37 1y2m h GLU 642 Ca -0.01 -0.07 0.04 0.00 0.34 0.00 0.00 59.36 59.66 1y2m h GLU 642 Cb 0.15 -0.25 -0.05 0.00 -0.10 0.00 0.00 28.75 28.50 1y2m h GLU 642 CO 0.02 0.72 0.40 1.15 -1.16 0.00 0.00 179.01 180.14 1y2m h THR 643 N 1.12 1.05 -0.16 1.13 2.02 -0.92 -0.45 112.91 116.70 1y2m h THR 643 Ca 0.37 -0.27 -0.00 0.00 0.77 0.00 0.00 66.41 67.28 1y2m h THR 643 Cb 0.05 0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 66.66 1y2m h THR 643 CO -0.13 0.14 0.08 0.15 0.37 0.00 0.00 175.52 176.13 1y2m h PHE 644 N 0.78 0.22 0.00 3.16 3.57 -0.68 -3.18 116.94 120.81 1y2m h PHE 644 Ca 0.28 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.77 1y2m h PHE 644 Cb 0.07 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 38.75 1y2m h PHE 644 CO -0.06 0.24 0.00 -1.49 -2.23 0.00 0.00 178.31 174.77 1y2m h TRP 645 N 0.14 0.00 0.00 0.41 4.06 -0.89 -3.16 115.95 116.50 1y2m h TRP 645 Ca 0.05 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.00 1y2m h TRP 645 Cb 0.10 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.26 1y2m h TRP 645 CO -0.03 0.00 -0.45 0.77 -3.56 0.00 0.00 178.44 175.16 1y2m h SER 646 N 0.00 0.00 -2.38 -3.49 0.02 -1.10 -3.46 113.55 103.14 1y2m h SER 646 Ca 0.00 -0.00 -0.46 0.00 -0.84 0.00 0.00 61.79 60.49 1y2m h SER 646 Cb 0.86 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.40 1y2m h SER 646 CO 0.00 0.00 -0.32 0.00 -1.14 0.00 0.00 176.83 175.37 1y2m s ALA 647 N -3.28 3.88 0.66 3.77 0.00 -1.20 -5.09 121.76 120.50 1y2m s ALA 647 Ca 0.04 -1.14 -0.14 0.00 0.00 0.00 0.00 51.96 50.71 1y2m s ALA 647 Cb 0.07 -1.87 -0.00 0.00 0.00 0.00 0.00 23.12 21.31 1y2m s ALA 647 CO 0.72 0.08 1.08 0.00 0.00 0.00 0.00 175.76 177.65 1y2m s ALA 648 N -2.15 2.57 0.28 0.00 0.00 -1.26 -4.93 121.76 116.27 1y2m s ALA 648 Ca 0.38 0.39 0.37 0.00 0.00 0.00 0.00 51.96 53.10 1y2m s ALA 648 Cb -0.09 -3.26 1.68 0.00 0.00 0.00 0.00 23.12 21.45 1y2m s ALA 648 CO 0.32 -1.17 2.10 0.66 0.00 0.00 0.00 175.76 177.68 1y2m h SER 649 N -0.07 0.00 0.66 0.00 4.64 -1.96 -0.35 113.55 116.46 1y2m h SER 649 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1y2m h SER 649 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1y2m h SER 649 CO 0.55 0.01 0.00 0.35 -0.87 0.00 0.00 176.83 176.87 1y2m n THR 650 N -3.12 0.88 -1.14 2.95 -2.24 -1.26 -1.45 114.28 108.91 1y2m n THR 650 Ca -0.01 0.24 0.04 0.00 -2.27 0.00 0.00 64.05 62.06 1y2m n THR 650 Cb 0.24 -1.13 0.23 0.00 -2.10 0.00 0.00 70.33 67.57 1y2m n THR 650 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1y2m n SER 651 N -2.05 3.37 -4.76 3.42 7.64 -0.15 -5.05 113.62 116.05 1y2m n SER 651 Ca 0.02 -3.26 -0.41 0.00 1.01 0.00 0.00 58.87 56.23 1y2m n SER 651 Cb 0.21 -0.57 -0.00 0.00 -1.01 0.00 0.00 64.21 62.84 1y2m n SER 651 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1y2m n SER 652 N -0.76 3.66 0.30 6.43 2.88 -0.53 -4.86 113.62 120.73 1y2m n SER 652 Ca 0.25 1.22 0.19 0.00 -1.33 0.00 0.00 58.87 59.20 1y2m n SER 652 Cb 0.94 -1.60 0.85 0.00 -0.75 0.00 0.00 64.21 63.65 1y2m n SER 652 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1y2m h PRO 653 N 3.02 0.00 -1.02 -1.46 0.13 -1.93 -1.44 132.00 129.31 1y2m h PRO 653 Ca -0.50 0.00 0.26 0.00 -0.87 0.00 0.00 66.00 64.89 1y2m h PRO 653 Cb 1.25 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.30 1y2m h PRO 653 CO 0.65 0.01 0.67 0.00 -0.23 0.00 0.00 178.00 179.10 1y2m h ALA 654 N 1.99 2.36 0.00 -0.56 0.00 -1.89 0.00 119.26 121.17 1y2m h ALA 654 Ca -0.00 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1y2m h ALA 654 Cb 0.35 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1y2m h ALA 654 CO 0.00 -0.72 0.00 -0.07 0.00 0.00 0.00 179.25 178.46 1y2m h LEU 655 N 0.33 0.00 -0.40 0.00 3.38 -1.62 -1.23 115.31 115.78 1y2m h LEU 655 Ca 0.55 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.52 1y2m h LEU 655 Cb 1.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.27 1y2m h LEU 655 CO -0.22 0.00 0.00 0.28 0.09 0.00 0.00 178.44 178.59 1y2m h SER 656 N 0.00 0.00 0.00 -0.43 0.02 -1.15 -3.39 113.55 108.60 1y2m h SER 656 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1y2m h SER 656 Cb 0.31 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.85 1y2m h SER 656 CO 0.00 0.00 -0.71 -1.22 -1.14 0.00 0.00 176.83 173.76 1y2m n TYR 657 N -2.60 0.00 -2.04 3.45 4.01 -0.67 -4.86 117.16 114.45 1y2m n TYR 657 Ca 0.04 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.38 1y2m n TYR 657 Cb 0.39 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 39.42 1y2m n TYR 657 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1y2m s LEU 658 N -2.59 4.19 0.67 7.72 1.43 -0.55 0.15 118.68 129.70 1y2m s LEU 658 Ca 0.00 2.66 -0.17 0.00 -1.03 0.00 0.00 54.13 55.59 1y2m s LEU 658 Cb 0.00 -3.93 -0.03 0.00 0.03 0.00 0.00 46.19 42.26 1y2m s LEU 658 CO 0.00 -0.90 0.86 -0.24 0.23 0.00 0.00 176.35 176.30 1y2m n SER 659 N 0.05 0.18 0.20 2.29 2.88 -1.26 -4.70 113.62 113.26 1y2m n SER 659 Ca 0.04 0.71 0.03 0.00 -1.33 0.00 0.00 58.87 58.32 1y2m n SER 659 Cb 0.44 -1.35 0.40 0.00 -0.75 0.00 0.00 64.21 62.95 1y2m n SER 659 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1y2m h PRO 660 N 0.03 0.00 -0.11 -1.46 0.13 -1.84 -0.57 132.00 128.18 1y2m h PRO 660 Ca -0.47 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.45 1y2m h PRO 660 Cb 1.35 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.50 1y2m h PRO 660 CO 0.48 0.32 -0.73 0.00 -0.23 0.00 0.00 178.00 177.83 1y2m h ARG 661 N 0.00 0.69 0.00 0.86 3.08 -1.87 -3.26 114.38 113.88 1y2m h ARG 661 Ca -0.00 -0.60 -0.07 0.00 0.07 0.00 0.00 59.98 59.38 1y2m h ARG 661 Cb 0.56 0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.74 1y2m h ARG 661 CO 0.04 1.21 -0.32 1.79 -1.07 0.00 0.00 179.97 181.61 1y2m h THR 662 N 0.37 0.67 -0.50 2.04 1.35 -1.67 -2.49 112.91 112.67 1y2m h THR 662 Ca -0.06 -1.53 0.15 0.00 -0.55 0.00 0.00 66.41 64.42 1y2m h THR 662 Cb 1.38 2.02 -0.02 0.00 -1.73 0.00 0.00 68.15 69.79 1y2m h THR 662 CO 0.15 0.32 0.36 1.56 -0.25 0.00 0.00 175.52 177.66 1y2m h GLN 663 N 0.00 0.00 -0.27 4.72 4.20 -1.15 -2.21 115.11 120.40 1y2m h GLN 663 Ca -0.00 -0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 1y2m h GLN 663 Cb 0.99 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.76 1y2m h GLN 663 CO 0.04 0.00 0.14 0.82 -0.67 0.00 0.00 178.83 179.17 1y2m h ILE 664 N 0.00 1.13 -0.20 2.54 2.04 -1.51 0.21 117.51 121.73 1y2m h ILE 664 Ca 0.24 -0.36 -0.18 0.00 1.00 0.00 0.00 64.86 65.57 1y2m h ILE 664 Cb 0.96 0.88 -0.00 0.00 -0.74 0.00 0.00 36.82 37.91 1y2m h ILE 664 CO -0.00 0.13 -0.59 0.25 0.00 0.00 0.00 178.15 177.94 1y2m h LEU 665 N 0.32 0.73 -0.21 1.44 5.85 -1.57 -1.89 115.31 119.98 1y2m h LEU 665 Ca 0.09 -0.41 0.03 0.00 0.84 0.00 0.00 57.88 58.43 1y2m h LEU 665 Cb 0.08 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 40.88 1y2m h LEU 665 CO -0.01 1.16 0.04 0.22 -0.34 0.00 0.00 178.44 179.50 1y2m h TYR 666 N 0.49 0.07 -0.54 1.25 3.20 -1.19 -2.21 116.97 118.05 1y2m h TYR 666 Ca -0.00 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.81 1y2m h TYR 666 Cb 1.16 -0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.41 1y2m h TYR 666 CO 0.06 0.02 0.04 0.00 -1.64 0.00 0.00 178.16 176.64 1y2m h ALA 667 N 1.15 1.07 -0.29 1.82 0.00 -0.93 -0.66 119.26 121.42 1y2m h ALA 667 Ca 0.09 -0.26 0.03 0.00 0.00 0.00 0.00 54.91 54.77 1y2m h ALA 667 Cb 0.09 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 1y2m h ALA 667 CO -0.12 0.59 0.12 0.35 0.00 0.00 0.00 179.25 180.19 1y2m h PHE 668 N 0.82 0.22 -0.01 0.00 3.57 -0.98 0.29 116.94 120.85 1y2m h PHE 668 Ca 0.16 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.63 1y2m h PHE 668 Cb 0.43 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.12 1y2m h PHE 668 CO 0.03 0.11 -0.17 0.28 -2.23 0.00 0.00 178.31 176.33 1y2m h VAL 669 N 0.26 1.53 -0.50 1.41 2.07 -1.27 -0.33 116.25 119.41 1y2m h VAL 669 Ca 0.12 -1.81 -0.12 0.00 0.82 0.00 0.00 66.70 65.72 1y2m h VAL 669 Cb 0.07 2.67 -0.02 0.00 -1.52 0.00 0.00 31.29 32.49 1y2m h VAL 669 CO -0.11 0.49 -0.16 0.03 0.02 0.00 0.00 177.57 177.85 1y2m h ARG 670 N -0.52 0.97 0.00 1.57 2.47 -1.06 -1.96 114.38 115.86 1y2m h ARG 670 Ca -0.02 -0.38 0.00 0.00 -1.26 0.00 0.00 59.98 58.32 1y2m h ARG 670 Cb 0.89 -0.05 0.00 0.00 -1.65 0.00 0.00 29.97 29.16 1y2m h ARG 670 CO 0.03 1.05 -0.60 0.39 0.56 0.00 0.00 179.97 181.40 1y2m n GLU 671 N -4.13 0.35 -0.14 0.04 -0.58 1.00 -3.58 120.64 113.60 1y2m n GLU 671 Ca 0.01 0.23 -0.11 0.00 -0.42 0.00 0.00 57.16 56.87 1y2m n GLU 671 Cb 0.42 -1.22 -0.01 0.00 -0.57 0.00 0.00 31.44 30.06 1y2m n GLU 671 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 1y2m h GLU 672 N -0.70 0.74 0.00 3.49 5.08 -1.05 -2.80 114.58 119.35 1y2m h GLU 672 Ca 0.00 -0.25 0.00 0.00 -1.00 0.00 0.00 59.36 58.11 1y2m h GLU 672 Cb 0.60 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.79 1y2m h GLU 672 CO 0.00 0.84 -0.33 -0.07 -1.00 0.00 0.00 179.01 178.45 1y2m h LEU 673 N 0.57 0.00 0.61 1.33 3.38 -1.08 -3.48 115.31 116.63 1y2m h LEU 673 Ca 0.11 -0.06 -0.19 0.00 0.09 0.00 0.00 57.88 57.83 1y2m h LEU 673 Cb 0.53 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.22 1y2m h LEU 673 CO 0.03 0.03 -0.18 0.61 0.09 0.00 0.00 178.44 179.02 1y2m n GLY 674 N 1.25 0.87 3.54 0.83 0.00 -0.89 -4.98 105.19 105.79 1y2m n GLY 674 Ca 0.04 -0.60 -0.43 0.00 0.00 0.00 0.00 46.02 45.03 1y2m n GLY 674 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1y2m s VAL 675 N -2.36 4.76 0.31 1.61 1.01 -0.79 -4.98 120.40 119.96 1y2m s VAL 675 Ca 0.00 0.35 0.07 0.00 0.00 0.00 0.00 61.98 62.39 1y2m s VAL 675 Cb 0.00 -4.23 -0.02 0.00 0.00 0.00 0.00 36.38 32.13 1y2m s VAL 675 CO 0.00 -0.59 0.38 -0.54 0.00 0.00 0.00 175.10 174.35 1y2m s LYS 676 N 3.00 3.07 0.70 2.72 -0.14 -1.26 -3.85 119.74 123.97 1y2m s LYS 676 Ca 0.26 -1.04 -0.16 0.00 -1.36 0.00 0.00 55.97 53.67 1y2m s LYS 676 Cb -0.13 -2.73 -0.01 0.00 -1.68 0.00 0.00 37.83 33.29 1y2m s LYS 676 CO 0.20 0.18 0.96 0.00 -0.76 0.00 0.00 175.35 175.92 1y2m n ALA 677 N -1.48 -0.18 -3.39 5.17 0.00 -1.26 -5.00 120.51 114.37 1y2m n ALA 677 Ca -0.03 -0.15 -0.34 0.00 0.00 0.00 0.00 53.44 52.92 1y2m n ALA 677 Cb 0.58 -2.11 -0.14 0.00 0.00 0.00 0.00 19.45 17.78 1y2m n ALA 677 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1y2m s ARG 678 N -3.21 3.38 0.01 0.00 3.52 -1.26 -5.01 118.95 116.38 1y2m s ARG 678 Ca 0.74 -0.64 -0.01 0.00 -0.13 0.00 0.00 55.73 55.68 1y2m s ARG 678 Cb -0.36 -2.88 -0.27 0.00 -1.56 0.00 0.00 34.95 29.89 1y2m s ARG 678 CO 0.50 -0.06 0.88 -0.09 -0.81 0.00 0.00 175.30 175.71 1y2m h ARG 679 N 7.63 0.22 0.00 5.12 2.43 -1.98 -3.39 114.38 124.40 1y2m h ARG 679 Ca -0.37 -0.37 0.00 0.00 -0.81 0.00 0.00 59.98 58.43 1y2m h ARG 679 Cb 1.17 0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.86 1y2m h ARG 679 CO 0.60 1.07 0.00 0.41 -1.51 0.00 0.00 179.97 180.54 1y2m n GLY 680 N 1.64 3.60 0.33 2.80 0.00 -1.26 -4.03 105.19 108.26 1y2m n GLY 680 Ca -0.15 -0.87 0.03 0.00 0.00 0.00 0.00 46.02 45.03 1y2m n GLY 680 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1y2m h ASP 681 N 0.00 0.82 -0.08 1.61 5.19 -1.91 -1.31 116.42 120.74 1y2m h ASP 681 Ca 0.00 0.03 -0.05 0.00 -0.62 0.00 0.00 57.03 56.40 1y2m h ASP 681 Cb 0.00 -0.13 0.00 0.00 0.18 0.00 0.00 39.33 39.38 1y2m h ASP 681 CO 0.00 0.48 -0.15 0.58 -3.12 0.00 0.00 179.24 177.04 1y2m h VAL 682 N 0.93 1.41 -0.54 -1.35 2.07 -1.81 -0.77 116.25 116.19 1y2m h VAL 682 Ca 0.42 -1.44 0.08 0.00 0.82 0.00 0.00 66.70 66.58 1y2m h VAL 682 Cb 0.31 2.17 -0.06 0.00 -1.52 0.00 0.00 31.29 32.19 1y2m h VAL 682 CO -0.22 0.40 0.19 0.15 0.02 0.00 0.00 177.57 178.11 1y2m h PHE 683 N -0.24 0.32 0.00 1.57 3.57 -1.80 -2.50 116.94 117.86 1y2m h PHE 683 Ca 0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 1y2m h PHE 683 Cb 0.73 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.40 1y2m h PHE 683 CO 0.11 0.09 0.00 -0.07 -2.23 0.00 0.00 178.31 176.21 1y2m h LEU 684 N 0.36 0.00 1.57 0.59 3.38 -1.24 -3.47 115.31 116.50 1y2m h LEU 684 Ca 0.27 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 58.00 1y2m h LEU 684 Cb 0.31 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 1y2m h LEU 684 CO -0.28 0.00 -0.29 0.61 0.09 0.00 0.00 178.44 178.57 1y2m n GLY 685 N 0.46 0.02 3.42 0.83 0.00 -0.43 -5.01 105.19 104.49 1y2m n GLY 685 Ca 0.02 -0.40 -0.16 0.00 0.00 0.00 0.00 46.02 45.48 1y2m n GLY 685 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1y2m s LYS 686 N -4.43 0.94 -0.80 1.61 -2.85 -0.43 -5.04 119.74 108.76 1y2m s LYS 686 Ca 0.00 0.05 -0.19 0.00 -1.00 0.00 0.00 55.97 54.84 1y2m s LYS 686 Cb 0.00 0.44 0.13 0.00 -2.06 0.00 0.00 37.83 36.34 1y2m s LYS 686 CO 0.00 -0.30 0.95 -0.65 0.10 0.00 0.00 175.35 175.45 1y2m s GLN 687 N -1.43 3.40 0.81 1.78 -0.21 -1.26 -4.33 119.66 118.41 1y2m s GLN 687 Ca -0.11 -1.64 -0.11 0.00 0.02 0.00 0.00 55.36 53.51 1y2m s GLN 687 Cb -0.02 -4.59 0.08 0.00 1.00 0.00 0.00 33.01 29.48 1y2m s GLN 687 CO 0.06 -1.65 1.09 -1.21 -2.12 0.00 0.00 175.29 171.47 1y2m s GLU 688 N 2.47 1.98 0.08 2.91 2.02 -1.26 -4.95 118.70 121.95 1y2m s GLU 688 Ca 0.24 0.79 -0.36 0.00 0.02 0.00 0.00 54.97 55.66 1y2m s GLU 688 Cb -0.12 -1.89 -0.18 0.00 0.10 0.00 0.00 34.13 32.03 1y2m s GLU 688 CO -0.03 -1.73 1.00 0.28 0.02 0.00 0.00 175.26 174.80 1y2m n VAL 689 N -3.53 0.56 -1.27 2.63 0.31 -1.26 -4.80 118.33 110.97 1y2m n VAL 689 Ca 0.07 -0.14 -0.31 0.00 -0.01 0.00 0.00 64.34 63.95 1y2m n VAL 689 Cb 0.55 -0.23 0.09 0.00 -0.91 0.00 0.00 33.84 33.35 1y2m n VAL 689 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 1y2m s THR 690 N -0.19 3.20 0.22 2.52 -4.23 -1.26 -4.90 115.64 111.01 1y2m s THR 690 Ca 0.82 0.41 -0.08 0.00 -1.18 0.00 0.00 61.69 61.66 1y2m s THR 690 Cb -1.10 -2.86 0.18 0.00 1.34 0.00 0.00 72.50 70.06 1y2m s THR 690 CO 0.55 -0.49 1.73 0.40 -0.54 0.00 0.00 174.62 176.27 1y2m h ILE 691 N -1.05 0.71 -0.80 2.99 2.04 -1.99 -2.11 117.51 117.30 1y2m h ILE 691 Ca -0.44 -0.14 -0.00 0.00 1.00 0.00 0.00 64.86 65.28 1y2m h ILE 691 Cb 1.24 0.27 -0.04 0.00 -0.74 0.00 0.00 36.82 37.55 1y2m h ILE 691 CO 0.51 0.07 0.49 1.23 0.00 0.00 0.00 178.15 180.45 1y2m h GLY 692 N 0.40 1.15 0.72 5.37 0.00 -1.99 0.70 103.07 109.43 1y2m h GLY 692 Ca 0.35 -0.47 0.07 0.00 0.00 0.00 0.00 47.33 47.28 1y2m h GLY 692 CO -0.36 0.46 0.64 1.76 0.00 0.00 0.00 176.54 179.04 1y2m h SER 693 N 1.09 1.01 -0.03 0.19 0.02 -1.75 0.12 113.55 114.20 1y2m h SER 693 Ca 0.29 0.01 -0.06 0.00 -0.84 0.00 0.00 61.79 61.19 1y2m h SER 693 Cb -0.06 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 62.28 1y2m h SER 693 CO -0.06 0.63 -0.23 0.78 -1.14 0.00 0.00 176.83 176.81 1y2m h ASN 694 N 1.14 0.25 -0.93 3.07 2.35 -0.91 -2.77 115.58 117.78 1y2m h ASN 694 Ca 0.44 -0.70 0.13 0.00 -0.55 0.00 0.00 56.30 55.61 1y2m h ASN 694 Cb 0.21 -0.08 -0.08 0.00 0.05 0.00 0.00 38.32 38.43 1y2m h ASN 694 CO -0.18 0.92 0.60 0.58 -1.65 0.00 0.00 177.43 177.69 1y2m h VAL 695 N -0.39 0.88 -0.60 2.81 2.07 -0.72 -1.98 116.25 118.31 1y2m h VAL 695 Ca -0.02 -0.28 0.01 0.00 0.82 0.00 0.00 66.70 67.22 1y2m h VAL 695 Cb 0.93 -0.02 -0.03 0.00 -1.52 0.00 0.00 31.29 30.65 1y2m h VAL 695 CO 0.05 0.15 0.40 0.28 0.02 0.00 0.00 177.57 178.47 1y2m h SER 696 N 0.83 0.68 -0.74 0.57 0.02 -0.66 0.38 113.55 114.64 1y2m h SER 696 Ca 0.47 -0.02 -0.05 0.00 -0.84 0.00 0.00 61.79 61.35 1y2m h SER 696 Cb 0.60 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.94 1y2m h SER 696 CO -0.23 0.49 0.27 0.11 -1.14 0.00 0.00 176.83 176.34 1y2m h LYS 697 N 0.81 1.12 -0.10 3.45 1.57 -1.07 0.13 116.57 122.48 1y2m h LYS 697 Ca 0.22 -0.22 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1y2m h LYS 697 Cb -0.08 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.05 1y2m h LYS 697 CO -0.05 0.93 0.01 0.82 -0.57 0.00 0.00 179.45 180.59 1y2m h ILE 698 N 1.07 1.23 -0.60 1.86 2.04 -1.17 -2.45 117.51 119.50 1y2m h ILE 698 Ca 0.24 -0.73 0.09 0.00 1.00 0.00 0.00 64.86 65.47 1y2m h ILE 698 Cb 0.25 1.52 -0.07 0.00 -0.74 0.00 0.00 36.82 37.78 1y2m h ILE 698 CO -0.02 0.21 0.22 0.22 0.00 0.00 0.00 178.15 178.78 1y2m h TYR 699 N -0.08 0.38 -0.98 1.37 3.20 -0.65 -2.08 116.97 118.15 1y2m h TYR 699 Ca 0.03 0.03 0.02 0.00 3.14 0.00 0.00 58.73 61.95 1y2m h TYR 699 Cb 0.32 -0.08 -0.05 0.00 1.54 0.00 0.00 36.73 38.45 1y2m h TYR 699 CO 0.02 0.09 0.64 0.93 -1.64 0.00 0.00 178.16 178.21 1y2m h GLU 700 N 0.40 1.25 -0.09 1.82 5.08 -0.66 -0.61 114.58 121.75 1y2m h GLU 700 Ca 0.30 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.54 1y2m h GLU 700 Cb 0.37 -0.28 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 1y2m h GLU 700 CO -0.31 0.82 -0.17 0.00 -1.00 0.00 0.00 179.01 178.36 1y2m h ALA 701 N 1.41 1.54 0.08 3.43 0.00 -0.90 -1.04 119.26 123.78 1y2m h ALA 701 Ca 0.37 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 1y2m h ALA 701 Cb -0.09 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.64 1y2m h ALA 701 CO -0.10 0.33 -0.04 0.82 0.00 0.00 0.00 179.25 180.27 1y2m h ILE 702 N 0.14 1.17 -0.61 0.00 2.04 -0.83 -1.58 117.51 117.84 1y2m h ILE 702 Ca 0.03 -1.35 -0.02 0.00 1.00 0.00 0.00 64.86 64.52 1y2m h ILE 702 Cb 0.39 1.98 -0.03 0.00 -0.74 0.00 0.00 36.82 38.43 1y2m h ILE 702 CO 0.03 0.31 0.30 0.11 0.00 0.00 0.00 178.15 178.89 1y2m h LYS 703 N -0.77 0.86 0.00 2.37 1.79 -0.97 -1.98 116.57 117.87 1y2m h LYS 703 Ca -0.01 -0.11 0.00 0.00 -2.18 0.00 0.00 60.65 58.35 1y2m h LYS 703 Cb 0.59 -0.16 0.00 0.00 -1.58 0.00 0.00 32.23 31.08 1y2m h LYS 703 CO 0.02 0.66 0.00 -1.13 -1.08 0.00 0.00 179.45 177.92 1y2m n SER 704 N -4.36 0.79 0.00 0.86 3.41 -0.41 -4.91 113.62 109.00 1y2m n SER 704 Ca 0.06 0.61 0.00 0.00 -0.26 0.00 0.00 58.87 59.28 1y2m n SER 704 Cb 0.13 -0.81 0.00 0.00 -0.26 0.00 0.00 64.21 63.27 1y2m n SER 704 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1y2m n GLY 705 N 0.83 0.84 0.32 5.00 0.00 -0.74 -4.93 105.19 106.52 1y2m n GLY 705 Ca 0.04 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.13 1y2m n GLY 705 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1y2m h ARG 706 N 3.20 0.50 0.00 1.61 2.43 -1.62 -1.35 114.38 119.15 1y2m h ARG 706 Ca 0.00 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1y2m h ARG 706 Cb 0.00 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.44 1y2m h ARG 706 CO 0.00 0.33 0.00 0.97 -1.51 0.00 0.00 179.97 179.76 1y2m h ILE 707 N 0.52 0.00 -0.25 1.20 2.10 -1.62 -3.35 117.51 116.10 1y2m h ILE 707 Ca 0.20 -0.36 -0.00 0.00 1.08 0.00 0.00 64.86 65.77 1y2m h ILE 707 Cb 0.15 1.21 -0.01 0.00 -1.09 0.00 0.00 36.82 37.08 1y2m h ILE 707 CO -0.05 0.00 0.14 0.78 -1.08 0.00 0.00 178.15 177.94 1y2m h ASN 708 N 0.00 0.31 0.51 2.19 2.35 -1.53 -1.33 115.58 118.09 1y2m h ASN 708 Ca 0.00 -0.08 -0.03 0.00 -0.55 0.00 0.00 56.30 55.64 1y2m h ASN 708 Cb 0.44 -0.08 -0.00 0.00 0.05 0.00 0.00 38.32 38.73 1y2m h ASN 708 CO 0.00 0.30 -0.16 0.78 -1.65 0.00 0.00 177.43 176.70 1y2m h ASN 709 N 0.29 0.00 -0.11 5.81 2.35 -1.75 -1.33 115.58 120.84 1y2m h ASN 709 Ca 0.09 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.81 1y2m h ASN 709 Cb 0.06 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.43 1y2m h ASN 709 CO -0.01 0.16 -0.03 0.58 -1.65 0.00 0.00 177.43 176.47 1y2m h VAL 710 N 0.00 1.30 -0.79 2.81 2.07 -1.48 -0.26 116.25 119.89 1y2m h VAL 710 Ca -0.00 -0.99 0.02 0.00 0.82 0.00 0.00 66.70 66.54 1y2m h VAL 710 Cb 0.46 1.73 -0.04 0.00 -1.52 0.00 0.00 31.29 31.91 1y2m h VAL 710 CO 0.02 0.28 0.52 -0.07 0.02 0.00 0.00 177.57 178.34 1y2m h LEU 711 N -0.11 0.88 0.05 2.57 3.38 -0.95 -2.86 115.31 118.27 1y2m h LEU 711 Ca 0.03 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 1y2m h LEU 711 Cb 0.46 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.00 1y2m h LEU 711 CO 0.01 0.63 -0.02 0.25 0.09 0.00 0.00 178.44 179.40 1y2m h LEU 712 N 1.04 -0.05 -1.68 1.67 5.85 -1.14 -2.57 115.31 118.44 1y2m h LEU 712 Ca 0.30 -0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.93 1y2m h LEU 712 Cb -0.07 0.01 0.00 0.00 0.37 0.00 0.00 40.66 40.97 1y2m h LEU 712 CO -0.08 0.06 0.00 1.17 -0.34 0.00 0.00 178.44 179.25 1y2m n LYS 713 N -5.07 0.00 0.00 1.25 4.81 -0.12 -5.10 118.16 113.93 1y2m n LYS 713 Ca -0.08 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.36 1y2m n LYS 713 Cb 0.09 -0.97 0.00 0.00 0.02 0.00 0.00 35.03 34.17 1y2m n LYS 713 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85