#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 7.11 0.00 0.00 0.15 -1.26 -4.93 113.70 114.77 1y2m s SER 27 Ca 0.00 2.31 0.25 0.00 0.70 0.00 0.00 55.95 59.21 1y2m s SER 27 Cb 0.00 -2.62 0.34 0.00 -1.71 0.00 0.00 66.02 62.03 1y2m s SER 27 CO 0.00 -0.30 1.33 0.35 1.20 0.00 0.00 173.24 175.81 1y2m n THR 28 N 1.75 0.00 -2.26 6.45 -2.24 -1.26 -4.88 114.28 111.84 1y2m n THR 28 Ca 0.02 -0.36 -0.43 0.00 -2.27 0.00 0.00 64.05 61.01 1y2m n THR 28 Cb 0.44 1.16 -0.02 0.00 -2.10 0.00 0.00 70.33 69.80 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 -2.18 6.83 0.49 3.42 2.47 -1.26 -4.92 114.94 119.79 1y2m s ASN 29 Ca 0.27 1.88 0.24 0.00 0.42 0.00 0.00 52.86 55.68 1y2m s ASN 29 Cb 0.20 -2.54 1.27 0.00 -1.45 0.00 0.00 41.25 38.73 1y2m s ASN 29 CO 0.40 -0.84 2.01 -0.07 -3.72 0.00 0.00 177.10 174.88 1y2m h LEU 30 N 9.97 0.00 -1.81 3.21 3.38 -1.90 -0.27 115.31 127.89 1y2m h LEU 30 Ca -0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.66 1y2m h LEU 30 Cb 1.13 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 1y2m h LEU 30 CO 0.97 0.16 0.14 0.00 0.09 0.00 0.00 178.44 179.80 1y2m h ALA 31 N 1.84 1.87 0.00 1.53 0.00 -1.88 -3.47 119.26 119.14 1y2m h ALA 31 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1y2m h ALA 31 Cb 0.42 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1y2m h ALA 31 CO 0.02 0.12 0.00 0.28 0.00 0.00 0.00 179.25 179.67 1y2m n VAL 32 N -4.51 0.00 0.00 0.00 0.31 -0.12 -4.18 118.33 109.84 1y2m n VAL 32 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1y2m n VAL 32 Cb 0.08 -0.62 0.00 0.00 -0.91 0.00 0.00 33.84 32.39 1y2m n VAL 32 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 1y2m n THR 39 N -0.97 -0.99 1.67 2.52 5.66 -1.26 -4.87 114.28 116.04 1y2m n THR 39 Ca 0.16 0.00 0.14 0.00 -3.05 0.00 0.00 64.05 61.30 1y2m n THR 39 Cb 0.07 -0.18 0.81 0.00 -1.55 0.00 0.00 70.33 69.49 1y2m n THR 39 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 1y2m n THR 40 N -0.88 0.03 1.25 1.09 -2.24 -1.26 -3.58 114.28 108.70 1y2m n THR 40 Ca 0.00 0.01 0.14 0.00 -2.27 0.00 0.00 64.05 61.93 1y2m n THR 40 Cb 0.00 -0.55 0.59 0.00 -2.10 0.00 0.00 70.33 68.26 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 -1.08 0.38 -3.61 -0.78 6.02 -1.26 -4.81 117.38 112.23 1y2m n GLN 41 Ca 0.19 -0.10 -0.02 0.00 -0.01 0.00 0.00 57.00 57.06 1y2m n GLN 41 Cb 0.13 -1.50 -0.05 0.00 1.02 0.00 0.00 30.24 29.85 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 -2.69 -0.58 0.32 5.09 0.11 -1.23 -4.85 120.40 116.56 1y2m s VAL 42 Ca 0.23 0.00 0.08 0.00 -2.93 0.00 0.00 61.98 59.35 1y2m s VAL 42 Cb 0.19 -1.00 -0.04 0.00 -1.53 0.00 0.00 36.38 34.01 1y2m s VAL 42 CO 0.52 0.00 0.20 0.42 -3.33 0.00 0.00 175.10 172.91 1y2m s THR 43 N 2.37 3.45 0.25 5.04 -4.23 -1.26 -4.90 115.64 116.36 1y2m s THR 43 Ca -0.07 -1.54 -0.05 0.00 -1.18 0.00 0.00 61.69 58.85 1y2m s THR 43 Cb -0.09 -3.11 0.25 0.00 1.34 0.00 0.00 72.50 70.90 1y2m s THR 43 CO -0.19 -0.22 1.90 -0.61 -0.54 0.00 0.00 174.62 174.97 1y2m h GLN 44 N 1.45 1.22 -0.54 3.99 4.15 -1.99 -1.21 115.11 122.17 1y2m h GLN 44 Ca -0.45 -0.07 0.04 0.00 0.77 0.00 0.00 58.65 58.94 1y2m h GLN 44 Cb 1.25 -0.27 -0.04 0.00 0.21 0.00 0.00 27.48 28.62 1y2m h GLN 44 CO 0.61 0.80 0.29 0.28 -1.93 0.00 0.00 178.83 178.88 1y2m h VAL 45 N 1.25 0.97 -0.39 2.39 2.07 -1.98 0.07 116.25 120.64 1y2m h VAL 45 Ca 0.38 -0.19 0.05 0.00 0.82 0.00 0.00 66.70 67.76 1y2m h VAL 45 Cb -0.02 0.37 -0.04 0.00 -1.52 0.00 0.00 31.29 30.07 1y2m h VAL 45 CO -0.12 0.10 0.14 0.44 0.02 0.00 0.00 177.57 178.15 1y2m h ASP 46 N 0.56 0.15 -0.43 0.57 3.32 -1.78 0.12 116.42 118.93 1y2m h ASP 46 Ca 0.24 0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.32 1y2m h ASP 46 Cb 0.12 0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 1y2m h ASP 46 CO -0.15 0.12 0.25 0.40 -1.72 0.00 0.00 179.24 178.15 1y2m h ILE 47 N 0.30 1.14 -0.37 0.35 2.04 -0.84 -2.11 117.51 118.01 1y2m h ILE 47 Ca 0.18 -0.33 -0.01 0.00 1.00 0.00 0.00 64.86 65.69 1y2m h ILE 47 Cb 0.16 0.59 -0.02 0.00 -0.74 0.00 0.00 36.82 36.80 1y2m h ILE 47 CO -0.18 0.14 0.19 0.58 0.00 0.00 0.00 178.15 178.88 1y2m h VAL 48 N 0.57 1.16 -0.51 1.67 2.07 -0.68 -2.85 116.25 117.68 1y2m h VAL 48 Ca 0.15 -0.44 0.08 0.00 0.82 0.00 0.00 66.70 67.31 1y2m h VAL 48 Cb 0.01 0.77 -0.06 0.00 -1.52 0.00 0.00 31.29 30.49 1y2m h VAL 48 CO -0.03 0.17 0.17 -0.08 0.02 0.00 0.00 177.57 177.82 1y2m h GLU 49 N 0.47 0.33 -1.21 1.57 4.81 -0.66 -0.33 114.58 119.55 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 0.10 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.40 1y2m h GLU 49 CO -0.02 0.22 0.00 1.17 -0.73 0.00 0.00 179.01 179.65 1y2m n LYS 50 N -5.03 0.27 0.00 1.92 4.81 -0.80 -1.72 118.16 117.61 1y2m n LYS 50 Ca 0.06 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.50 1y2m n LYS 50 Cb 0.22 -1.28 0.00 0.00 0.02 0.00 0.00 35.03 33.99 1y2m n LYS 50 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1y2m n LEU 52 N 0.69 0.00 0.00 3.14 4.77 -0.14 -3.30 117.00 122.16 1y2m n LEU 52 Ca 0.00 0.00 0.15 0.00 -0.03 0.00 0.00 56.01 56.13 1y2m n LEU 52 Cb 0.11 0.00 0.88 0.00 -2.33 0.00 0.00 43.42 42.08 1y2m n LEU 52 CO 0.00 0.00 1.07 0.00 -1.33 0.00 0.00 177.39 177.13 1y2m n ALA 53 N 0.00 2.61 -1.70 -1.18 0.00 -0.70 -4.88 120.51 114.66 1y2m n ALA 53 Ca 0.00 -0.18 -0.43 0.00 0.00 0.00 0.00 53.44 52.82 1y2m n ALA 53 Cb 0.00 -1.50 -0.03 0.00 0.00 0.00 0.00 19.45 17.92 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 -1.06 2.33 -1.46 0.00 0.00 -1.21 -4.93 120.51 114.18 1y2m n ALA 54 Ca 0.21 0.42 -0.36 0.00 0.00 0.00 0.00 53.44 53.71 1y2m n ALA 54 Cb 0.14 -2.47 0.09 0.00 0.00 0.00 0.00 19.45 17.21 1y2m n ALA 54 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1y2m n PRO 55 N 3.81 0.70 -0.00 0.00 -0.02 -1.26 -4.95 135.00 133.28 1y2m n PRO 55 Ca 0.16 0.30 0.03 0.00 -2.02 0.00 0.00 63.50 61.98 1y2m n PRO 55 Cb 0.33 -2.43 -0.05 0.00 -0.02 0.00 0.00 33.50 31.33 1y2m n PRO 55 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1y2m n THR 56 N -2.45 0.00 -0.10 3.45 -2.24 -1.26 -4.84 114.28 106.84 1y2m n THR 56 Ca 0.15 -0.20 -0.24 0.00 -2.27 0.00 0.00 64.05 61.49 1y2m n THR 56 Cb 0.49 0.52 -0.12 0.00 -2.10 0.00 0.00 70.33 69.13 1y2m n THR 56 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1y2m n ASP 57 N -1.57 1.97 -4.79 3.42 5.75 -1.26 -4.00 116.55 116.07 1y2m n ASP 57 Ca -0.01 0.22 -0.36 0.00 -0.01 0.00 0.00 54.79 54.64 1y2m n ASP 57 Cb 0.15 -0.76 -0.04 0.00 -1.03 0.00 0.00 41.12 39.44 1y2m n ASP 57 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 1y2m s SER 58 N -7.03 6.55 0.21 -1.12 1.04 -1.26 -4.55 113.70 107.54 1y2m s SER 58 Ca -0.33 2.02 -0.32 0.00 0.48 0.00 0.00 55.95 57.81 1y2m s SER 58 Cb 0.10 -2.58 -0.11 0.00 0.10 0.00 0.00 66.02 63.53 1y2m s SER 58 CO 0.59 -0.64 1.66 -0.89 0.98 0.00 0.00 173.24 174.94 1y2m s THR 59 N -1.76 2.19 -0.34 2.02 2.01 -1.26 -4.52 115.64 113.97 1y2m s THR 59 Ca 0.62 0.14 -0.29 0.00 0.31 0.00 0.00 61.69 62.47 1y2m s THR 59 Cb -0.21 -3.09 0.02 0.00 0.01 0.00 0.00 72.50 69.23 1y2m s THR 59 CO 0.25 0.01 1.11 -0.22 -0.69 0.00 0.00 174.62 175.09 1y2m s LEU 60 N 0.86 3.89 -0.28 4.42 2.96 0.23 -4.97 118.68 125.79 1y2m s LEU 60 Ca 0.71 1.00 -0.12 0.00 -0.22 0.00 0.00 54.13 55.51 1y2m s LEU 60 Cb -0.48 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 42.62 1y2m s LEU 60 CO 0.35 -0.95 0.22 -1.61 -1.32 0.00 0.00 176.35 173.04 1y2m s GLU 61 N 3.82 3.96 -0.20 1.98 2.02 -1.26 -0.89 118.70 128.13 1y2m s GLU 61 Ca 0.47 -0.26 -0.18 0.00 0.02 0.00 0.00 54.97 55.02 1y2m s GLU 61 Cb -0.12 -3.66 -0.03 0.00 0.10 0.00 0.00 34.13 30.42 1y2m s GLU 61 CO 0.18 -0.19 0.52 -0.51 0.02 0.00 0.00 175.26 175.28 1y2m s LEU 62 N 1.80 4.14 0.00 1.80 1.43 0.64 -4.72 118.68 123.78 1y2m s LEU 62 Ca 0.08 0.67 0.00 0.00 -1.03 0.00 0.00 54.13 53.85 1y2m s LEU 62 Cb -0.16 -2.70 0.00 0.00 0.03 0.00 0.00 46.19 43.36 1y2m s LEU 62 CO 0.11 -0.18 0.52 -0.90 0.23 0.00 0.00 176.35 176.12 1y2m n ASP 63 N 4.80 1.00 0.00 2.29 5.68 -1.26 -0.50 116.55 128.56 1y2m n ASP 63 Ca -0.05 -1.16 0.00 0.00 -0.50 0.00 0.00 54.79 53.08 1y2m n ASP 63 Cb 0.50 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.48 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 -0.08 1.14 0.00 6.12 0.00 -1.26 -4.76 105.19 106.36 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 0.34 1.61 4.01 -1.20 -4.24 117.16 115.68 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 0.17 0.00 -0.31 0.00 0.00 39.34 39.20 1y2m n TYR 65 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 1y2m h SER 66 N 0.00 0.00 -2.60 7.72 0.02 -1.88 -3.27 113.55 113.54 1y2m h SER 66 Ca 0.00 -0.04 -0.52 0.00 -0.84 0.00 0.00 61.79 60.38 1y2m h SER 66 Cb 0.15 0.00 0.05 0.00 0.14 0.00 0.00 62.40 62.73 1y2m h SER 66 CO 0.00 0.02 1.07 -0.22 -1.14 0.00 0.00 176.83 176.56 1y2m s LEU 67 N -5.26 4.39 0.42 5.07 2.96 -1.26 -4.82 118.68 120.18 1y2m s LEU 67 Ca 0.06 2.80 0.06 0.00 -0.22 0.00 0.00 54.13 56.83 1y2m s LEU 67 Cb 0.09 -3.58 -0.07 0.00 0.50 0.00 0.00 46.19 43.14 1y2m s LEU 67 CO 0.70 -0.99 0.04 0.54 -1.32 0.00 0.00 176.35 175.32 1y2m s ASN 68 N 2.05 4.00 0.20 3.68 2.20 -1.26 -4.23 114.94 121.58 1y2m s ASN 68 Ca 0.78 -1.35 -0.09 0.00 -0.94 0.00 0.00 52.86 51.26 1y2m s ASN 68 Cb -0.47 -0.30 0.13 0.00 -2.00 0.00 0.00 41.25 38.60 1y2m s ASN 68 CO 0.34 -0.51 1.76 -0.07 -2.94 0.00 0.00 177.10 175.68 1y2m h LEU 69 N 1.66 1.01 -0.92 3.54 3.38 -1.92 -1.37 115.31 120.69 1y2m h LEU 69 Ca -0.44 -0.18 0.05 0.00 0.09 0.00 0.00 57.88 57.40 1y2m h LEU 69 Cb 1.25 -0.26 -0.06 0.00 0.09 0.00 0.00 40.66 41.68 1y2m h LEU 69 CO 0.78 0.92 0.59 1.23 0.09 0.00 0.00 178.44 182.05 1y2m h GLY 70 N 1.05 1.36 0.79 0.83 0.00 -1.96 -0.54 103.07 104.60 1y2m h GLY 70 Ca 0.24 -0.44 0.02 0.00 0.00 0.00 0.00 47.33 47.15 1y2m h GLY 70 CO -0.02 0.34 -0.03 -0.55 0.00 0.00 0.00 176.54 176.28 1y2m h ASP 71 N 1.10 -0.12 -0.36 0.19 3.32 -1.85 -0.62 116.42 118.08 1y2m h ASP 71 Ca 0.38 0.03 0.06 0.00 0.02 0.00 0.00 57.03 57.52 1y2m h ASP 71 Cb 0.09 0.07 -0.05 0.00 0.22 0.00 0.00 39.33 39.66 1y2m h ASP 71 CO -0.15 -0.05 0.04 0.58 -1.72 0.00 0.00 179.24 177.94 1y2m h VAL 72 N -0.02 0.77 -0.92 -1.35 2.07 -0.67 -1.50 116.25 114.63 1y2m h VAL 72 Ca 0.05 -0.05 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 1y2m h VAL 72 Cb 0.09 0.61 -0.04 0.00 -1.52 0.00 0.00 31.29 30.43 1y2m h VAL 72 CO -0.10 0.03 0.57 0.58 0.02 0.00 0.00 177.57 178.67 1y2m h VAL 73 N 0.14 1.25 -0.87 2.57 2.07 -0.81 -0.34 116.25 120.26 1y2m h VAL 73 Ca 0.18 -0.51 -0.03 0.00 0.82 0.00 0.00 66.70 67.16 1y2m h VAL 73 Cb 0.23 -0.07 -0.04 0.00 -1.52 0.00 0.00 31.29 29.89 1y2m h VAL 73 CO -0.26 0.25 0.45 0.77 0.02 0.00 0.00 177.57 178.79 1y2m h SER 74 N 1.26 1.12 -0.16 0.57 4.64 -0.42 0.69 113.55 121.25 1y2m h SER 74 Ca 0.33 -0.12 -0.16 0.00 -0.47 0.00 0.00 61.79 61.37 1y2m h SER 74 Cb -0.08 -0.29 0.01 0.00 -0.31 0.00 0.00 62.40 61.72 1y2m h SER 74 CO -0.07 0.92 -0.53 0.00 -0.87 0.00 0.00 176.83 176.29 1y2m h ALA 75 N 1.25 0.28 -0.26 5.18 0.00 -1.08 -1.49 119.26 123.14 1y2m h ALA 75 Ca 0.30 -0.51 -0.09 0.00 0.00 0.00 0.00 54.91 54.61 1y2m h ALA 75 Cb 0.08 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1y2m h ALA 75 CO -0.04 0.48 -0.20 0.00 0.00 0.00 0.00 179.25 179.49 1y2m h ALA 76 N 0.55 0.37 0.00 0.00 0.00 -0.77 -3.34 119.26 116.07 1y2m h ALA 76 Ca -0.02 -0.35 -0.11 0.00 0.00 0.00 0.00 54.91 54.42 1y2m h ALA 76 Cb 1.15 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 1y2m h ALA 76 CO 0.11 0.30 -1.65 0.54 0.00 0.00 0.00 179.25 178.55 1y2m n ARG 77 N -4.39 1.45 -0.12 0.00 1.74 0.21 -4.54 116.66 111.01 1y2m n ARG 77 Ca -0.04 -0.05 0.05 0.00 -0.77 0.00 0.00 57.85 57.04 1y2m n ARG 77 Cb 0.41 -1.28 0.11 0.00 -1.02 0.00 0.00 32.46 30.68 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 -2.19 2.35 -1.28 5.56 4.76 -0.60 -4.99 118.16 121.77 1y2m n LYS 78 Ca -0.11 -1.78 -0.08 0.00 -2.87 0.00 0.00 58.31 53.47 1y2m n LYS 78 Cb 0.62 -1.22 -0.03 0.00 -1.84 0.00 0.00 35.03 32.56 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 0.41 0.93 3.74 0.72 0.00 -1.05 -4.95 105.19 104.99 1y2m n GLY 79 Ca 0.09 -0.69 -0.42 0.00 0.00 0.00 0.00 46.02 45.01 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 -2.75 4.17 0.54 1.61 3.52 -0.99 -4.95 118.95 120.10 1y2m s ARG 80 Ca 0.00 2.49 -0.22 0.00 -0.13 0.00 0.00 55.73 57.87 1y2m s ARG 80 Cb 0.00 -3.06 -0.05 0.00 -1.56 0.00 0.00 34.95 30.28 1y2m s ARG 80 CO 0.00 -0.59 1.34 -2.14 -0.81 0.00 0.00 175.30 173.10 1y2m s PRO 81 N -0.12 3.16 -0.01 5.12 0.02 -1.26 -4.67 135.00 137.23 1y2m s PRO 81 Ca 0.64 2.19 0.02 0.00 0.02 0.00 0.00 61.00 63.87 1y2m s PRO 81 Cb -0.46 -2.25 -0.00 0.00 0.02 0.00 0.00 34.50 31.81 1y2m s PRO 81 CO 0.43 -1.16 -0.07 0.08 -0.33 0.00 0.00 177.00 175.96 1y2m s VAL 82 N -1.33 0.59 0.04 3.83 1.01 -1.26 -0.60 120.40 122.69 1y2m s VAL 82 Ca 0.71 -0.29 -0.12 0.00 0.00 0.00 0.00 61.98 62.29 1y2m s VAL 82 Cb -0.39 -0.52 0.01 0.00 0.00 0.00 0.00 36.38 35.48 1y2m s VAL 82 CO 0.46 0.18 0.25 -0.13 0.00 0.00 0.00 175.10 175.87 1y2m s ARG 83 N 0.04 0.76 0.25 2.72 0.52 -0.07 -4.83 118.95 118.34 1y2m s ARG 83 Ca -0.00 -0.57 -0.30 0.00 -0.52 0.00 0.00 55.73 54.33 1y2m s ARG 83 Cb -0.05 0.32 -0.10 0.00 0.52 0.00 0.00 34.95 35.64 1y2m s ARG 83 CO -0.00 -0.23 1.46 0.08 0.02 0.00 0.00 175.30 176.63 1y2m s VAL 84 N -2.59 2.61 0.26 3.52 1.01 -1.26 -0.26 120.40 123.69 1y2m s VAL 84 Ca -0.05 0.51 -0.30 0.00 0.00 0.00 0.00 61.98 62.14 1y2m s VAL 84 Cb -0.01 -3.32 -0.14 0.00 0.00 0.00 0.00 36.38 32.91 1y2m s VAL 84 CO -0.04 0.08 1.29 1.17 0.00 0.00 0.00 175.10 177.60 1y2m n LYS 85 N 2.45 1.84 -2.62 2.72 4.81 0.35 -4.71 118.16 123.00 1y2m n LYS 85 Ca 0.07 0.65 -0.41 0.00 -0.87 0.00 0.00 58.31 57.75 1y2m n LYS 85 Cb 0.40 -2.22 -0.03 0.00 0.02 0.00 0.00 35.03 33.20 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 -0.02 6.38 -0.24 3.14 2.15 -1.26 -4.82 116.67 121.99 1y2m s ASP 86 Ca 0.64 -1.16 -0.20 0.00 0.43 0.00 0.00 52.55 52.26 1y2m s ASP 86 Cb -0.66 -2.54 0.07 0.00 -0.30 0.00 0.00 42.92 39.48 1y2m s ASP 86 CO 0.55 -1.56 0.63 -0.94 -0.17 0.00 0.00 175.17 173.68 1y2m s SER 87 N 4.34 -0.71 0.33 -0.34 1.04 -1.26 -5.03 113.70 112.07 1y2m s SER 87 Ca 0.39 1.31 0.02 0.00 0.48 0.00 0.00 55.95 58.15 1y2m s SER 87 Cb -0.04 1.29 0.60 0.00 0.10 0.00 0.00 66.02 67.97 1y2m s SER 87 CO -0.00 -0.22 1.97 0.44 0.98 0.00 0.00 173.24 176.40 1y2m h ASP 88 N 5.59 0.79 -0.14 7.02 3.32 -1.99 -1.45 116.42 129.57 1y2m h ASP 88 Ca -0.29 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 56.75 1y2m h ASP 88 Cb 1.18 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.54 1y2m h ASP 88 CO 0.12 0.55 0.08 -0.33 -1.72 0.00 0.00 179.24 177.94 1y2m h GLU 89 N 0.92 0.19 0.19 3.56 5.08 -1.97 0.21 114.58 122.75 1y2m h GLU 89 Ca 0.30 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.63 1y2m h GLU 89 Cb 0.05 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.26 1y2m h GLU 89 CO -0.09 0.19 -0.09 0.82 -1.00 0.00 0.00 179.01 178.84 1y2m h ILE 90 N 0.14 0.85 -0.87 3.13 1.08 -1.85 -2.03 117.51 117.96 1y2m h ILE 90 Ca 0.05 -0.17 0.09 0.00 -0.39 0.00 0.00 64.86 64.43 1y2m h ILE 90 Cb 0.05 0.96 -0.07 0.00 -3.07 0.00 0.00 36.82 34.69 1y2m h ILE 90 CO -0.01 0.04 0.52 0.03 -0.69 0.00 0.00 178.15 178.04 1y2m h ARG 91 N -0.34 0.86 -0.59 2.37 3.08 -1.10 -1.46 114.38 117.21 1y2m h ARG 91 Ca -0.03 -0.05 -0.04 0.00 0.07 0.00 0.00 59.98 59.93 1y2m h ARG 91 Cb 0.26 -0.19 -0.03 0.00 0.08 0.00 0.00 29.97 30.09 1y2m h ARG 91 CO 0.04 0.57 0.20 1.03 -1.07 0.00 0.00 179.97 180.74 1y2m h SER 92 N 0.89 0.84 -0.10 7.04 0.87 -0.48 0.11 113.55 122.72 1y2m h SER 92 Ca 0.41 -0.20 0.01 0.00 -1.23 0.00 0.00 61.79 60.78 1y2m h SER 92 Cb 0.31 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.04 1y2m h SER 92 CO -0.22 0.81 0.02 0.50 -0.53 0.00 0.00 176.83 177.41 1y2m h LYS 93 N 0.83 0.06 0.18 2.24 3.64 -0.92 0.13 116.57 122.73 1y2m h LYS 93 Ca 0.19 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.56 1y2m h LYS 93 Cb 0.26 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.07 1y2m h LYS 93 CO -0.01 0.04 -0.08 0.82 -2.27 0.00 0.00 179.45 177.95 1y2m h ILE 94 N 0.06 0.85 -0.85 2.00 2.04 -1.10 -2.75 117.51 117.76 1y2m h ILE 94 Ca 0.04 -0.08 -0.03 0.00 1.00 0.00 0.00 64.86 65.80 1y2m h ILE 94 Cb 0.03 0.90 -0.04 0.00 -0.74 0.00 0.00 36.82 36.97 1y2m h ILE 94 CO -0.06 0.02 0.42 0.44 0.00 0.00 0.00 178.15 178.97 1y2m h ASP 95 N -0.27 1.10 -0.01 1.72 3.32 -0.61 -2.54 116.42 119.12 1y2m h ASP 95 Ca -0.02 -0.13 -0.04 0.00 0.02 0.00 0.00 57.03 56.85 1y2m h ASP 95 Cb 0.21 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 1y2m h ASP 95 CO 0.04 0.92 -0.10 0.11 -1.72 0.00 0.00 179.24 178.49 1y2m h LYS 96 N 1.20 0.26 -0.31 3.56 6.56 -0.66 -0.78 116.57 126.39 1y2m h LYS 96 Ca 0.29 -0.05 -0.14 0.00 -1.06 0.00 0.00 60.65 59.69 1y2m h LYS 96 Cb 0.10 -0.04 -0.00 0.00 -0.57 0.00 0.00 32.23 31.72 1y2m h LYS 96 CO -0.04 0.37 -0.34 0.66 -2.06 0.00 0.00 179.45 178.04 1y2m h SER 97 N 0.25 0.84 -0.49 0.86 4.64 -1.16 0.35 113.55 118.84 1y2m h SER 97 Ca 0.05 -0.48 -0.00 0.00 -0.47 0.00 0.00 61.79 60.89 1y2m h SER 97 Cb 0.34 -0.24 -0.02 0.00 -0.31 0.00 0.00 62.40 62.17 1y2m h SER 97 CO 0.02 1.15 0.30 0.58 -0.87 0.00 0.00 176.83 178.00 1y2m h VAL 98 N 0.55 1.15 -0.44 0.95 2.07 -1.26 -2.63 116.25 116.64 1y2m h VAL 98 Ca 0.05 -0.32 -0.12 0.00 0.82 0.00 0.00 66.70 67.13 1y2m h VAL 98 Cb 0.92 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.15 1y2m h VAL 98 CO 0.08 0.15 -0.20 -0.08 0.02 0.00 0.00 177.57 177.54 1y2m h GLU 99 N 0.65 0.87 -0.40 1.57 4.57 -1.00 -1.31 114.58 119.53 1y2m h GLU 99 Ca 0.18 -0.35 0.05 0.00 -1.18 0.00 0.00 59.36 58.05 1y2m h GLU 99 Cb -0.02 -0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 28.48 1y2m h GLU 99 CO -0.03 0.99 0.14 0.35 -1.18 0.00 0.00 179.01 179.28 1y2m h PHE 100 N 0.76 0.25 -0.66 0.92 3.57 -0.81 0.40 116.94 121.36 1y2m h PHE 100 Ca 0.11 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.54 1y2m h PHE 100 Cb 0.74 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.40 1y2m h PHE 100 CO 0.04 0.10 0.08 1.25 -2.23 0.00 0.00 178.31 177.55 1y2m h LEU 101 N 0.30 1.06 -0.42 0.59 5.85 -1.09 -2.80 115.31 118.80 1y2m h LEU 101 Ca 0.18 -0.27 -0.09 0.00 0.84 0.00 0.00 57.88 58.54 1y2m h LEU 101 Cb 0.17 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.90 1y2m h LEU 101 CO -0.19 1.07 -0.10 0.03 -0.34 0.00 0.00 178.44 178.91 1y2m h ARG 102 N 1.03 0.82 -2.53 1.25 -0.00 -0.58 -3.52 114.38 110.84 1y2m h ARG 102 Ca 0.20 -0.31 -0.55 0.00 -0.50 0.00 0.00 59.98 58.82 1y2m h ARG 102 Cb 0.47 -0.05 -0.06 0.00 0.00 0.00 0.00 29.97 30.34 1y2m h ARG 102 CO 0.02 0.93 2.04 -1.13 0.00 0.00 0.00 179.97 181.83 1y2m n SER 103 N -4.31 7.45 0.00 7.04 3.41 0.13 -5.09 113.62 122.26 1y2m n SER 103 Ca -0.01 -2.77 0.00 0.00 -0.26 0.00 0.00 58.87 55.83 1y2m n SER 103 Cb 0.37 -1.44 0.00 0.00 -0.26 0.00 0.00 64.21 62.88 1y2m n SER 103 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1y2m n THR 124 N 2.52 0.00 -0.14 6.66 -2.24 -1.26 -4.96 114.28 114.86 1y2m n THR 124 Ca 0.62 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 62.29 1y2m n THR 124 Cb 0.44 -0.25 -0.01 0.00 -2.10 0.00 0.00 70.33 68.41 1y2m n THR 124 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1y2m h GLU 125 N 0.00 0.91 -0.26 -0.78 5.08 -2.02 -2.41 114.58 115.09 1y2m h GLU 125 Ca 0.00 -0.41 -0.06 0.00 -1.00 0.00 0.00 59.36 57.90 1y2m h GLU 125 Cb 0.00 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 1y2m h GLU 125 CO 0.00 1.06 -0.09 -0.44 -1.00 0.00 0.00 179.01 178.54 1y2m h ASP 126 N 0.73 0.40 -0.42 1.42 3.32 -2.03 0.65 116.42 120.48 1y2m h ASP 126 Ca 0.09 -0.09 -0.09 0.00 0.02 0.00 0.00 57.03 56.96 1y2m h ASP 126 Cb 0.80 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.23 1y2m h ASP 126 CO 0.07 0.54 -0.08 0.00 -1.72 0.00 0.00 179.24 178.04 1y2m h ALA 127 N 1.51 0.58 -0.44 3.45 0.00 -1.95 -0.52 119.26 121.90 1y2m h ALA 127 Ca 0.08 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 1y2m h ALA 127 Cb 0.41 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1y2m h ALA 127 CO 0.02 0.44 0.25 0.82 0.00 0.00 0.00 179.25 180.78 1y2m h ILE 128 N 0.63 1.15 -0.80 0.00 2.04 -0.96 -2.57 117.51 117.00 1y2m h ILE 128 Ca 0.11 -0.38 -0.01 0.00 1.00 0.00 0.00 64.86 65.58 1y2m h ILE 128 Cb 0.60 0.60 -0.04 0.00 -0.74 0.00 0.00 36.82 37.24 1y2m h ILE 128 CO 0.04 0.16 0.45 0.28 0.00 0.00 0.00 178.15 179.07 1y2m h SER 129 N 0.58 0.99 -0.78 1.72 0.02 -0.71 -2.52 113.55 112.85 1y2m h SER 129 Ca 0.16 -0.09 -0.01 0.00 -0.84 0.00 0.00 61.79 61.01 1y2m h SER 129 Cb 0.03 -0.25 -0.04 0.00 0.14 0.00 0.00 62.40 62.28 1y2m h SER 129 CO -0.03 0.79 0.45 0.25 -1.14 0.00 0.00 176.83 177.16 1y2m h LEU 130 N 1.10 0.97 -0.75 5.07 5.85 -0.81 0.12 115.31 126.86 1y2m h LEU 130 Ca 0.28 -0.07 -0.10 0.00 0.84 0.00 0.00 57.88 58.83 1y2m h LEU 130 Cb 0.02 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.78 1y2m h LEU 130 CO -0.05 0.76 -0.15 1.56 -0.34 0.00 0.00 178.44 180.23 1y2m h GLN 131 N 1.10 0.79 -0.41 1.25 1.08 -1.07 -1.14 115.11 116.71 1y2m h GLN 131 Ca 0.28 -0.28 -0.08 0.00 -1.45 0.00 0.00 58.65 57.12 1y2m h GLN 131 Cb -0.01 -0.06 -0.02 0.00 -0.05 0.00 0.00 27.48 27.35 1y2m h GLN 131 CO -0.05 0.89 -0.06 0.87 -0.95 0.00 0.00 178.83 179.54 1y2m h LYS 132 N 0.71 0.69 -0.31 1.46 1.57 -0.95 -1.23 116.57 118.52 1y2m h LYS 132 Ca 0.11 -0.20 -0.09 0.00 -1.87 0.00 0.00 60.65 58.60 1y2m h LYS 132 Cb 0.64 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.86 1y2m h LYS 132 CO 0.05 0.75 -0.20 0.00 -0.57 0.00 0.00 179.45 179.47 1y2m h ALA 133 N 1.29 1.08 -0.09 3.86 0.00 -0.46 0.35 119.26 125.30 1y2m h ALA 133 Ca 0.12 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 1y2m h ALA 133 Cb 0.49 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 1y2m h ALA 133 CO 0.03 0.56 0.04 -0.07 0.00 0.00 0.00 179.25 179.81 1y2m h LEU 134 N 0.51 0.12 -0.64 0.00 3.38 -0.80 -3.04 115.31 114.83 1y2m h LEU 134 Ca 0.08 -0.15 -0.10 0.00 0.09 0.00 0.00 57.88 57.81 1y2m h LEU 134 Cb 0.64 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 1y2m h LEU 134 CO 0.05 0.23 -0.00 -0.07 0.09 0.00 0.00 178.44 178.73 1y2m h LEU 135 N -0.01 1.04 -0.36 1.67 3.38 -1.05 -3.22 115.31 116.75 1y2m h LEU 135 Ca 0.03 -0.30 0.06 0.00 0.09 0.00 0.00 57.88 57.76 1y2m h LEU 135 Cb 0.15 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.57 1y2m h LEU 135 CO -0.00 1.09 0.04 -0.08 0.09 0.00 0.00 178.44 179.57 1y2m h GLU 136 N 0.97 0.14 0.00 1.13 4.81 -0.82 -1.64 114.58 119.17 1y2m h GLU 136 Ca 0.17 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.36 1y2m h GLU 136 Cb 0.56 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.90 1y2m h GLU 136 CO 0.03 0.09 -0.15 1.12 -0.73 0.00 0.00 179.01 179.37 1y2m h HIS 137 N 0.14 0.00 0.00 0.92 2.07 -1.60 -3.11 115.15 113.58 1y2m h HIS 137 Ca 0.18 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.70 1y2m h HIS 137 Cb 0.23 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.21 1y2m h HIS 137 CO -0.22 0.15 -0.55 1.04 -3.07 0.00 0.00 177.93 175.28 1y2m n GLN 138 N -3.21 0.20 -1.70 5.12 1.13 -0.73 -4.32 117.38 113.86 1y2m n GLN 138 Ca 0.02 0.06 -0.41 0.00 -1.94 0.00 0.00 57.00 54.73 1y2m n GLN 138 Cb 0.47 -1.63 -0.01 0.00 0.11 0.00 0.00 30.24 29.18 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 -1.92 7.74 -0.13 1.08 4.77 -0.70 -4.51 117.00 123.33 1y2m n LEU 139 Ca 0.04 -4.41 0.02 0.00 -0.03 0.00 0.00 56.01 51.64 1y2m n LEU 139 Cb 0.41 -1.55 0.03 0.00 -2.33 0.00 0.00 43.42 39.98 1y2m n LEU 139 CO 0.35 1.65 0.40 0.00 -1.33 0.00 0.00 177.39 178.46 1y2m s GLY 141 N -1.19 1.87 -0.18 0.00 0.00 -1.26 -5.08 107.32 101.47 1y2m s GLY 141 Ca 0.08 -1.56 -0.09 0.00 0.00 0.00 0.00 44.72 43.15 1y2m s GLY 141 CO 0.01 -1.29 0.11 0.14 0.00 0.00 0.00 173.10 172.07 1y2m s VAL 142 N -2.61 5.24 0.06 1.40 1.01 -1.26 -4.95 120.40 119.29 1y2m s VAL 142 Ca 0.57 0.13 -0.00 0.00 0.00 0.00 0.00 61.98 62.68 1y2m s VAL 142 Cb -0.10 -3.37 -0.04 0.00 0.00 0.00 0.00 36.38 32.88 1y2m s VAL 142 CO 0.37 0.47 -0.04 -0.76 0.00 0.00 0.00 175.10 175.14 1y2m s LEU 143 N 0.18 2.47 0.25 3.92 1.43 -1.26 -4.57 118.68 121.11 1y2m s LEU 143 Ca 0.08 -0.96 -0.31 0.00 -1.03 0.00 0.00 54.13 51.91 1y2m s LEU 143 Cb -0.11 0.13 -0.13 0.00 0.03 0.00 0.00 46.19 46.10 1y2m s LEU 143 CO -0.01 -0.54 1.49 -0.81 0.23 0.00 0.00 176.35 176.72 1y2m n PRO 144 N 0.21 2.30 0.15 1.29 -0.04 -1.26 -4.89 135.00 132.76 1y2m n PRO 144 Ca -0.14 0.82 0.02 0.00 -0.04 0.00 0.00 63.50 64.16 1y2m n PRO 144 Cb 0.60 -2.53 0.12 0.00 -0.04 0.00 0.00 33.50 31.65 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 4.59 0.00 -5.11 3.54 4.64 -2.00 -3.47 113.55 115.75 1y2m h SER 145 Ca -0.46 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 60.80 1y2m h SER 145 Cb 1.25 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 63.21 1y2m h SER 145 CO 0.78 0.52 -0.20 -0.55 -0.87 0.00 0.00 176.83 176.51 1y2m s SER 146 N -6.48 -0.08 0.23 4.97 0.15 -1.26 -5.01 113.70 106.22 1y2m s SER 146 Ca 0.02 -0.46 0.19 0.00 0.70 0.00 0.00 55.95 56.41 1y2m s SER 146 Cb 0.09 0.41 0.92 0.00 -1.71 0.00 0.00 66.02 65.74 1y2m s SER 146 CO 0.73 -0.80 1.59 0.49 1.20 0.00 0.00 173.24 176.46 1y2m n PHE 147 N -0.14 0.62 0.31 3.44 3.72 -1.26 -3.12 117.46 121.03 1y2m n PHE 147 Ca -0.16 0.28 0.18 0.00 -0.05 0.00 0.00 57.45 57.71 1y2m n PHE 147 Cb 0.63 -0.96 1.03 0.00 -0.94 0.00 0.00 39.48 39.25 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 0.96 4.37 3.32 -2.00 -1.68 116.42 121.38 1y2m h ASP 148 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1y2m h ASP 148 Cb 0.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.71 1y2m h ASP 148 CO 0.00 0.00 -0.60 0.77 -1.72 0.00 0.00 179.24 177.69 1y2m h SER 149 N 0.00 0.00 -4.16 6.45 4.64 -1.98 -3.47 113.55 115.04 1y2m h SER 149 Ca 0.00 -0.17 -0.50 0.00 -0.47 0.00 0.00 61.79 60.65 1y2m h SER 149 Cb 0.01 0.00 0.09 0.00 -0.31 0.00 0.00 62.40 62.18 1y2m h SER 149 CO -0.00 0.09 0.39 -0.36 -0.87 0.00 0.00 176.83 176.08 1y2m s PHE 150 N -3.18 2.69 0.19 4.77 0.40 -0.64 -4.82 117.98 117.39 1y2m s PHE 150 Ca 0.06 1.55 -0.08 0.00 -0.60 0.00 0.00 56.93 57.85 1y2m s PHE 150 Cb 0.13 -3.19 -0.02 0.00 0.51 0.00 0.00 43.02 40.45 1y2m s PHE 150 CO 0.72 -1.56 0.29 1.03 0.70 0.00 0.00 175.22 176.40 1y2m s ARG 151 N -3.79 1.25 0.06 0.44 1.81 -1.19 -5.01 118.95 112.53 1y2m s ARG 151 Ca 0.69 -1.30 -0.33 0.00 -1.72 0.00 0.00 55.73 53.07 1y2m s ARG 151 Cb -0.21 0.37 -0.12 0.00 -0.45 0.00 0.00 34.95 34.54 1y2m s ARG 151 CO 0.35 -0.47 1.75 -0.11 -0.68 0.00 0.00 175.30 176.15 1y2m n LEU 152 N -0.26 3.47 0.00 2.53 7.94 -1.26 -1.35 117.00 128.07 1y2m n LEU 152 Ca -0.04 1.02 0.00 0.00 -1.11 0.00 0.00 56.01 55.88 1y2m n LEU 152 Cb 0.63 -1.44 0.00 0.00 0.53 0.00 0.00 43.42 43.14 1y2m n LEU 152 CO 0.26 -0.08 0.00 0.61 -1.11 0.00 0.00 177.39 177.06 1y2m n GLY 153 N 3.98 0.45 3.26 -3.96 0.00 -1.26 -4.98 105.19 102.68 1y2m n GLY 153 Ca 0.19 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.12 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 -0.50 1.03 0.00 1.61 1.81 -0.45 -5.01 118.95 117.44 1y2m s ARG 154 Ca 0.00 -1.21 0.00 0.00 -1.72 0.00 0.00 55.73 52.80 1y2m s ARG 154 Cb 0.00 0.33 0.00 0.00 -0.45 0.00 0.00 34.95 34.83 1y2m s ARG 154 CO 0.00 -0.35 0.00 0.41 -0.68 0.00 0.00 175.30 174.68 1y2m n GLY 155 N -0.15 2.13 0.97 -3.53 0.00 -1.26 -3.14 105.19 100.21 1y2m n GLY 155 Ca -0.08 -0.21 0.08 0.00 0.00 0.00 0.00 46.02 45.81 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 3.91 0.16 0.99 4.77 -1.26 -4.65 117.00 120.92 1y2m n LEU 156 Ca 0.00 -2.76 0.14 0.00 -0.03 0.00 0.00 56.01 53.36 1y2m n LEU 156 Cb 0.00 -0.49 0.70 0.00 -2.33 0.00 0.00 43.42 41.30 1y2m n LEU 156 CO 0.00 0.69 1.12 1.05 -1.33 0.00 0.00 177.39 178.93 1y2m h GLU 157 N 2.20 0.00 -0.42 3.23 9.09 -1.99 -0.56 114.58 126.12 1y2m h GLU 157 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1y2m h GLU 157 Cb 1.35 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.45 1y2m h GLU 157 CO 0.20 0.00 0.00 0.09 0.05 0.00 0.00 179.01 179.35 1y2m n ASN 158 N -4.33 1.76 -4.48 3.06 3.02 -1.26 -4.87 115.26 108.15 1y2m n ASN 158 Ca 0.02 -2.09 -0.26 0.00 -0.03 0.00 0.00 54.58 52.22 1y2m n ASN 158 Cb 0.31 -0.28 -0.11 0.00 -0.61 0.00 0.00 39.78 39.09 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 -0.81 3.73 0.35 6.41 1.04 -0.22 -0.72 113.70 123.48 1y2m s SER 159 Ca 0.18 -0.80 -0.28 0.00 0.48 0.00 0.00 55.95 55.54 1y2m s SER 159 Cb 0.11 -0.42 -0.09 0.00 0.10 0.00 0.00 66.02 65.72 1y2m s SER 159 CO 0.10 0.10 1.22 -0.76 0.98 0.00 0.00 173.24 174.88 1y2m s LEU 160 N -2.88 4.36 0.37 2.42 1.43 0.12 -4.52 118.68 119.99 1y2m s LEU 160 Ca 0.24 2.49 -0.26 0.00 -1.03 0.00 0.00 54.13 55.57 1y2m s LEU 160 Cb -0.08 -3.78 -0.12 0.00 0.03 0.00 0.00 46.19 42.24 1y2m s LEU 160 CO 0.12 -0.52 1.02 -2.65 0.23 0.00 0.00 176.35 174.55 1y2m n PRO 161 N 0.60 1.40 -0.35 1.29 -0.02 -1.26 -4.77 135.00 131.88 1y2m n PRO 161 Ca 0.01 0.50 0.05 0.00 -2.02 0.00 0.00 63.50 62.05 1y2m n PRO 161 Cb 0.44 -1.98 0.21 0.00 -0.02 0.00 0.00 33.50 32.15 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 1.77 0.90 -1.06 2.45 3.38 -1.93 -1.52 115.31 119.29 1y2m h LEU 162 Ca -0.43 0.04 -0.05 0.00 0.09 0.00 0.00 57.88 57.53 1y2m h LEU 162 Cb 1.34 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.92 1y2m h LEU 162 CO 0.58 0.51 0.12 1.05 0.09 0.00 0.00 178.44 180.79 1y2m h GLU 163 N 0.99 0.79 -0.37 1.13 4.11 -1.90 -0.90 114.58 118.43 1y2m h GLU 163 Ca 0.47 -0.16 -0.01 0.00 0.07 0.00 0.00 59.36 59.73 1y2m h GLU 163 Cb 0.40 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 1y2m h GLU 163 CO -0.24 0.72 0.21 0.28 0.07 0.00 0.00 179.01 180.04 1y2m h VAL 164 N 0.76 1.14 -0.54 -1.06 2.07 -1.62 -1.23 116.25 115.76 1y2m h VAL 164 Ca 0.17 -0.37 -0.05 0.00 0.82 0.00 0.00 66.70 67.28 1y2m h VAL 164 Cb 0.29 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 1y2m h VAL 164 CO -0.00 0.15 0.16 0.58 0.02 0.00 0.00 177.57 178.48 1y2m h VAL 165 N 0.48 1.24 -0.40 2.57 2.07 -1.00 -0.48 116.25 120.72 1y2m h VAL 165 Ca 0.13 -0.81 0.01 0.00 0.82 0.00 0.00 66.70 66.85 1y2m h VAL 165 Cb 0.05 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 30.53 1y2m h VAL 165 CO -0.02 0.30 0.26 0.03 0.02 0.00 0.00 177.57 178.16 1y2m h ARG 166 N 0.76 0.52 -0.93 1.57 3.08 -1.06 -2.34 114.38 115.97 1y2m h ARG 166 Ca 0.17 -0.03 0.02 0.00 0.07 0.00 0.00 59.98 60.21 1y2m h ARG 166 Cb 0.29 -0.12 -0.05 0.00 0.08 0.00 0.00 29.97 30.18 1y2m h ARG 166 CO -0.00 0.34 0.61 0.78 -1.07 0.00 0.00 179.97 180.63 1y2m h GLY 167 N 0.53 1.32 -1.62 0.04 0.00 -1.01 -1.96 103.07 100.36 1y2m h GLY 167 Ca 0.15 -0.47 0.00 0.00 0.00 0.00 0.00 47.33 47.01 1y2m h GLY 167 CO -0.04 0.44 0.00 0.00 0.00 0.00 0.00 176.54 176.94 1y2m n ALA 168 N -2.39 1.65 0.00 3.60 0.00 -0.21 -1.40 120.51 121.76 1y2m n ALA 168 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 1y2m n ALA 168 Cb 0.06 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.51 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 0.67 0.00 -0.22 0.00 -1.04 -0.74 -0.19 114.28 112.76 1y2m n THR 170 Ca 0.00 0.00 -0.08 0.00 -2.04 0.00 0.00 64.05 61.93 1y2m n THR 170 Cb 0.12 0.00 0.03 0.00 -1.82 0.00 0.00 70.33 68.66 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 1.24 -0.43 12.58 2.04 -1.51 -2.01 117.51 129.42 1y2m h ILE 171 Ca 0.00 -0.83 0.03 0.00 1.00 0.00 0.00 64.86 65.07 1y2m h ILE 171 Cb 0.00 0.63 -0.04 0.00 -0.74 0.00 0.00 36.82 36.67 1y2m h ILE 171 CO 0.00 0.31 0.22 -0.09 0.00 0.00 0.00 178.15 178.60 1y2m h ARG 172 N 0.87 0.43 -0.26 2.37 9.65 -0.82 -0.13 114.38 126.49 1y2m h ARG 172 Ca 0.20 -0.03 -0.02 0.00 -1.10 0.00 0.00 59.98 59.03 1y2m h ARG 172 Cb 0.28 -0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 28.76 1y2m h ARG 172 CO -0.01 0.29 0.10 0.28 2.80 0.00 0.00 179.97 183.43 1y2m h VAL 173 N 0.45 1.18 -0.56 0.20 2.07 -1.76 -2.53 116.25 115.30 1y2m h VAL 173 Ca 0.18 -0.54 0.09 0.00 0.82 0.00 0.00 66.70 67.25 1y2m h VAL 173 Cb 0.08 1.05 -0.07 0.00 -1.52 0.00 0.00 31.29 30.83 1y2m h VAL 173 CO -0.12 0.18 0.16 -1.13 0.02 0.00 0.00 177.57 176.68 1y2m h ASN 174 N 0.27 0.10 0.60 0.57 -1.24 -0.76 -1.28 115.58 113.84 1y2m h ASN 174 Ca 0.09 0.09 -0.01 0.00 0.71 0.00 0.00 56.30 57.17 1y2m h ASN 174 Cb 0.19 0.10 -0.00 0.00 0.73 0.00 0.00 38.32 39.33 1y2m h ASN 174 CO -0.01 0.07 -0.05 0.77 -1.29 0.00 0.00 177.43 176.93 1y2m h SER 175 N 0.32 0.00 0.20 1.15 4.64 -0.80 -2.34 113.55 116.72 1y2m h SER 175 Ca 0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.60 1y2m h SER 175 Cb 0.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 1y2m h SER 175 CO -0.32 0.05 -0.97 0.18 -0.87 0.00 0.00 176.83 174.90 1y2m n LEU 176 N -3.26 0.74 0.00 5.97 4.77 -0.55 -4.00 117.00 120.67 1y2m n LEU 176 Ca -0.01 -0.25 0.12 0.00 -0.03 0.00 0.00 56.01 55.84 1y2m n LEU 176 Cb 0.24 -0.08 0.60 0.00 -2.33 0.00 0.00 43.42 41.86 1y2m n LEU 176 CO 0.27 0.16 0.92 0.35 -1.33 0.00 0.00 177.39 177.76 1y2m n THR 177 N -1.65 0.21 0.91 -5.08 -2.24 -0.80 -3.72 114.28 101.92 1y2m n THR 177 Ca 0.03 0.05 0.12 0.00 -2.27 0.00 0.00 64.05 61.98 1y2m n THR 177 Cb 0.37 -0.62 0.54 0.00 -2.10 0.00 0.00 70.33 68.51 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 -1.39 0.10 -1.01 -0.78 1.74 -1.25 -4.73 116.66 109.35 1y2m n ARG 178 Ca 0.09 0.08 -0.00 0.00 -0.77 0.00 0.00 57.85 57.25 1y2m n ARG 178 Cb 0.25 -1.50 -0.00 0.00 -1.02 0.00 0.00 32.46 30.19 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 0.89 0.42 0.72 -0.13 0.00 -1.24 -4.93 105.19 100.92 1y2m n GLY 179 Ca 0.07 -0.80 0.09 0.00 0.00 0.00 0.00 46.02 45.38 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 -2.99 0.05 0.00 1.61 8.25 -1.26 -4.65 115.22 116.22 1y2m n HIS 180 Ca -0.00 -0.03 0.00 0.00 -0.26 0.00 0.00 57.72 57.43 1y2m n HIS 180 Cb 0.01 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.12 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 0.99 2.86 -2.82 0.41 7.64 -1.26 0.05 113.62 121.49 1y2m n SER 181 Ca 0.11 -0.15 -0.21 0.00 1.01 0.00 0.00 58.87 59.63 1y2m n SER 181 Cb 0.44 0.87 0.03 0.00 -1.01 0.00 0.00 64.21 64.55 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 -1.16 -0.91 -2.76 -0.43 0.00 -1.26 -4.79 120.51 109.20 1y2m n ALA 182 Ca 0.00 0.27 -0.35 0.00 0.00 0.00 0.00 53.44 53.37 1y2m n ALA 182 Cb 0.00 -3.70 -0.09 0.00 0.00 0.00 0.00 19.45 15.66 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 5.19 0.57 0.00 1.01 -1.26 -4.64 120.40 118.13 1y2m s VAL 183 Ca 0.29 0.11 -0.19 0.00 0.00 0.00 0.00 61.98 62.19 1y2m s VAL 183 Cb -0.13 -3.36 -0.05 0.00 0.00 0.00 0.00 36.38 32.85 1y2m s VAL 183 CO 0.36 0.44 1.18 -0.13 0.00 0.00 0.00 175.10 176.95 1y2m s ARG 184 N 0.39 3.13 0.30 2.72 0.52 -1.26 -4.89 118.95 119.86 1y2m s ARG 184 Ca 0.06 1.77 0.03 0.00 -0.52 0.00 0.00 55.73 57.07 1y2m s ARG 184 Cb -0.12 -1.98 0.63 0.00 0.52 0.00 0.00 34.95 34.01 1y2m s ARG 184 CO -0.01 -1.06 1.83 1.25 0.02 0.00 0.00 175.30 177.32 1y2m h LEU 185 N 1.05 0.86 -2.05 2.53 5.85 -1.96 -0.80 115.31 120.79 1y2m h LEU 185 Ca -0.50 0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.28 1y2m h LEU 185 Cb 1.28 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 42.20 1y2m h LEU 185 CO 0.56 0.42 0.01 1.62 -0.34 0.00 0.00 178.44 180.71 1y2m h VAL 186 N 0.90 0.94 -0.10 1.05 3.04 -1.98 0.14 116.25 120.24 1y2m h VAL 186 Ca 0.51 0.00 -0.20 0.00 -1.01 0.00 0.00 66.70 66.00 1y2m h VAL 186 Cb 0.62 0.99 0.01 0.00 -2.01 0.00 0.00 31.29 30.90 1y2m h VAL 186 CO -0.28 0.00 -0.71 0.58 -1.01 0.00 0.00 177.57 176.14 1y2m h VAL 187 N 0.00 1.32 -0.81 1.51 2.07 -1.51 -1.00 116.25 117.83 1y2m h VAL 187 Ca 0.01 -1.97 -0.03 0.00 0.82 0.00 0.00 66.70 65.52 1y2m h VAL 187 Cb 0.03 2.16 -0.04 0.00 -1.52 0.00 0.00 31.29 31.93 1y2m h VAL 187 CO -0.00 0.61 0.37 -0.07 0.02 0.00 0.00 177.57 178.50 1y2m h LEU 188 N 0.33 1.07 -1.29 2.57 3.38 -0.97 -2.33 115.31 118.07 1y2m h LEU 188 Ca -0.06 -0.14 -0.07 0.00 0.09 0.00 0.00 57.88 57.71 1y2m h LEU 188 Cb 1.36 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.82 1y2m h LEU 188 CO 0.15 0.92 -0.31 -0.33 0.09 0.00 0.00 178.44 178.95 1y2m h GLU 189 N 1.16 0.00 -0.86 1.13 5.08 -0.66 -1.49 114.58 118.93 1y2m h GLU 189 Ca 0.28 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.62 1y2m h GLU 189 Cb 0.14 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.35 1y2m h GLU 189 CO -0.03 0.31 0.47 0.00 -1.00 0.00 0.00 179.01 178.77 1y2m h ALA 190 N 1.69 1.21 -0.14 3.43 0.00 -0.62 0.76 119.26 125.59 1y2m h ALA 190 Ca -0.00 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.72 1y2m h ALA 190 Cb 0.68 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 1y2m h ALA 190 CO 0.04 0.64 -0.14 -0.07 0.00 0.00 0.00 179.25 179.72 1y2m h LEU 191 N 1.21 0.36 -1.10 0.00 3.38 -1.20 -1.65 115.31 116.31 1y2m h LEU 191 Ca 0.30 -0.48 -0.06 0.00 0.09 0.00 0.00 57.88 57.74 1y2m h LEU 191 Cb 0.02 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1y2m h LEU 191 CO -0.05 0.76 0.01 0.71 0.09 0.00 0.00 178.44 179.97 1y2m h THR 192 N -0.04 1.22 -0.80 0.22 1.35 -1.16 -1.24 112.91 112.46 1y2m h THR 192 Ca 0.02 -0.87 -0.04 0.00 -0.55 0.00 0.00 66.41 64.98 1y2m h THR 192 Cb 0.66 0.90 -0.04 0.00 -1.73 0.00 0.00 68.15 67.95 1y2m h THR 192 CO 0.03 0.30 0.35 0.78 -0.25 0.00 0.00 175.52 176.74 1y2m h ASN 193 N 0.61 1.08 -0.63 5.36 2.35 -0.81 0.18 115.58 123.71 1y2m h ASN 193 Ca 0.13 -0.16 -0.02 0.00 -0.55 0.00 0.00 56.30 55.70 1y2m h ASN 193 Cb 0.37 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 38.43 1y2m h ASN 193 CO 0.01 0.93 0.33 -0.26 -1.65 0.00 0.00 177.43 176.79 1y2m h PHE 194 N 1.15 0.89 -0.20 1.19 -1.00 -0.73 -1.11 116.94 117.12 1y2m h PHE 194 Ca 0.27 -0.03 0.01 0.00 2.81 0.00 0.00 57.97 61.03 1y2m h PHE 194 Cb 0.17 -0.28 -0.02 0.00 3.61 0.00 0.00 35.95 39.43 1y2m h PHE 194 CO 0.02 0.66 0.09 -0.07 -1.61 0.00 0.00 178.31 177.40 1y2m h LEU 195 N 0.87 0.13 -0.27 1.54 3.38 -0.84 0.77 115.31 120.89 1y2m h LEU 195 Ca 0.22 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1y2m h LEU 195 Cb 0.08 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1y2m h LEU 195 CO -0.03 0.11 0.00 0.78 0.09 0.00 0.00 178.44 179.39 1y2m h ASN 196 N 0.21 0.00 -0.48 -0.43 2.35 -0.36 -2.39 115.58 114.48 1y2m h ASN 196 Ca 0.08 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 1y2m h ASN 196 Cb 0.03 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.40 1y2m h ASN 196 CO -0.06 0.00 0.00 1.41 -1.65 0.00 0.00 177.43 177.13 1y2m n HIS 197 N -2.66 0.62 -2.81 1.19 8.25 -0.45 -4.97 115.22 114.39 1y2m n HIS 197 Ca 0.04 -0.32 -0.20 0.00 -0.26 0.00 0.00 57.72 56.98 1y2m n HIS 197 Cb 0.42 -0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.56 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 1.50 -0.41 3.56 -1.41 0.00 -0.63 -4.82 105.19 102.97 1y2m n GLY 198 Ca 0.20 0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 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 -3.08 4.88 -0.21 -0.61 1.01 0.17 -4.20 121.20 119.15 1y2m s ILE 199 Ca 0.21 0.50 0.02 0.00 0.00 0.00 0.00 60.65 61.38 1y2m s ILE 199 Cb -0.09 -4.10 0.04 0.00 0.01 0.00 0.00 42.46 38.32 1y2m s ILE 199 CO 0.26 -0.36 -0.14 -0.89 0.00 0.00 0.00 174.94 173.81 1y2m s THR 200 N 2.73 1.99 0.33 2.92 2.01 -0.09 -4.37 115.64 121.16 1y2m s THR 200 Ca 0.24 -1.22 -0.28 0.00 0.31 0.00 0.00 61.69 60.74 1y2m s THR 200 Cb -0.14 -1.98 -0.13 0.00 0.01 0.00 0.00 72.50 70.26 1y2m s THR 200 CO 0.16 0.23 1.14 -2.65 -0.69 0.00 0.00 174.62 172.81 1y2m n PRO 201 N 4.56 1.72 -2.93 4.92 -0.02 -1.26 -0.61 135.00 141.39 1y2m n PRO 201 Ca -0.17 0.60 -0.42 0.00 -2.02 0.00 0.00 63.50 61.50 1y2m n PRO 201 Cb 0.46 -2.09 -0.05 0.00 -0.02 0.00 0.00 33.50 31.80 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 -1.10 4.82 -0.05 4.25 -1.09 -0.60 -4.78 121.20 122.65 1y2m s ILE 202 Ca 0.58 1.36 0.03 0.00 -2.23 0.00 0.00 60.65 60.38 1y2m s ILE 202 Cb -0.62 -4.12 0.01 0.00 -1.58 0.00 0.00 42.46 36.14 1y2m s ILE 202 CO 0.61 -0.16 -0.12 -0.69 -1.23 0.00 0.00 174.94 173.35 1y2m s VAL 203 N 2.89 1.10 0.52 2.92 1.01 -1.26 -4.74 120.40 122.85 1y2m s VAL 203 Ca 0.33 -0.49 -0.22 0.00 0.00 0.00 0.00 61.98 61.60 1y2m s VAL 203 Cb -0.15 -0.99 -0.06 0.00 0.00 0.00 0.00 36.38 35.18 1y2m s VAL 203 CO 0.10 0.34 1.19 -2.65 0.00 0.00 0.00 175.10 174.07 1y2m n PRO 204 N 3.55 1.46 -0.24 2.72 -0.02 -1.26 -0.70 135.00 140.51 1y2m n PRO 204 Ca -0.21 0.54 -0.07 0.00 -2.02 0.00 0.00 63.50 61.74 1y2m n PRO 204 Cb 0.53 -2.35 0.04 0.00 -0.02 0.00 0.00 33.50 31.69 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 1.29 0.97 -9.06 2.45 5.85 -1.15 -3.38 115.31 112.27 1y2m h LEU 205 Ca -0.49 -0.21 -0.64 0.00 0.84 0.00 0.00 57.88 57.39 1y2m h LEU 205 Cb 1.32 -0.25 -0.17 0.00 0.37 0.00 0.00 40.66 41.92 1y2m h LEU 205 CO 0.56 0.93 -0.81 -0.13 -0.34 0.00 0.00 178.44 178.65 1y2m s ARG 206 N -5.40 1.54 0.00 1.25 0.52 -1.26 -4.85 118.95 110.75 1y2m s ARG 206 Ca -0.12 -1.58 0.00 0.00 -0.52 0.00 0.00 55.73 53.51 1y2m s ARG 206 Cb 0.14 -1.79 0.00 0.00 0.52 0.00 0.00 34.95 33.82 1y2m s ARG 206 CO 0.83 0.37 0.00 0.41 0.02 0.00 0.00 175.30 176.93 1y2m n GLY 207 N 0.05 1.20 3.87 -3.53 0.00 -1.26 -4.58 105.19 100.94 1y2m n GLY 207 Ca -0.11 0.00 -0.34 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 -0.29 5.13 -2.50 2.61 -1.32 -1.26 -4.89 115.64 113.11 1y2m s THR 208 Ca 0.00 0.34 0.21 0.00 -1.21 0.00 0.00 61.69 61.03 1y2m s THR 208 Cb 0.00 -3.63 0.12 0.00 -1.51 0.00 0.00 72.50 67.48 1y2m s THR 208 CO 0.00 0.24 1.14 2.30 -2.21 0.00 0.00 174.62 176.10 1y2m n ILE 209 N 0.76 0.00 -3.36 5.08 -5.35 -1.26 -4.77 119.36 110.46 1y2m n ILE 209 Ca -0.07 -0.44 -0.19 0.00 -0.27 0.00 0.00 62.75 61.78 1y2m n ILE 209 Cb 0.52 1.40 0.07 0.00 -1.74 0.00 0.00 39.64 39.89 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 0.89 -5.01 0.00 7.28 7.64 -1.17 -0.90 113.62 122.35 1y2m n SER 210 Ca 0.12 -0.45 0.00 0.00 1.01 0.00 0.00 58.87 59.54 1y2m n SER 210 Cb 0.51 -4.23 0.00 0.00 -1.01 0.00 0.00 64.21 59.49 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 -4.39 0.00 0.00 -0.43 0.00 -1.26 -2.78 120.51 111.65 1y2m n ALA 211 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 1y2m n ALA 211 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.01 1y2m n ALA 211 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1y2m n SER 212 N 0.00 0.00 0.00 0.00 7.64 -1.26 -5.70 113.62 114.29 1y2m n SER 212 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1y2m n SER 212 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1y2m n SER 212 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1y2m n GLY 213 N 0.00 -0.19 2.22 0.23 0.00 -1.04 -1.57 105.19 104.84 1y2m n GLY 213 Ca 0.00 -1.22 -0.29 0.00 0.00 0.00 0.00 46.02 44.51 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 1.26 7.30 0.13 1.61 8.00 0.80 -3.06 116.55 132.59 1y2m n ASP 214 Ca 0.00 -2.62 -0.14 0.00 0.71 0.00 0.00 54.79 52.74 1y2m n ASP 214 Cb 0.00 -1.47 -0.06 0.00 -0.02 0.00 0.00 41.12 39.56 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 5.97 -0.96 0.47 0.64 3.38 -1.77 -0.99 115.31 122.06 1y2m h LEU 215 Ca 0.59 0.11 -0.02 0.00 0.09 0.00 0.00 57.88 58.64 1y2m h LEU 215 Cb 0.76 0.36 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1y2m h LEU 215 CO 1.14 -0.43 -0.23 -1.28 0.09 0.00 0.00 178.44 177.73 1y2m h SER 216 N -0.59 -0.54 -0.21 -0.43 0.87 -1.85 0.01 113.55 110.82 1y2m h SER 216 Ca 0.02 -0.03 -0.04 0.00 -1.23 0.00 0.00 61.79 60.51 1y2m h SER 216 Cb 0.60 0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 62.68 1y2m h SER 216 CO -0.17 -0.31 0.01 1.55 -0.53 0.00 0.00 176.83 177.38 1y2m h PRO 217 N -0.73 0.48 -0.19 2.24 0.13 -1.85 -1.05 132.00 131.03 1y2m h PRO 217 Ca -0.06 -0.09 -0.05 0.00 -0.87 0.00 0.00 66.00 64.92 1y2m h PRO 217 Cb 0.53 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 31.58 1y2m h PRO 217 CO 0.11 0.49 -0.12 -0.07 -0.23 0.00 0.00 178.00 178.18 1y2m h LEU 218 N 0.46 0.29 -0.90 1.56 3.38 -0.99 -2.42 115.31 116.69 1y2m h LEU 218 Ca 0.10 -0.06 -0.10 0.00 0.09 0.00 0.00 57.88 57.91 1y2m h LEU 218 Cb 0.28 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1y2m h LEU 218 CO 0.01 0.44 -0.29 0.28 0.09 0.00 0.00 178.44 178.96 1y2m h SER 219 N 0.29 0.47 -0.80 -0.43 0.02 0.31 -0.47 113.55 112.94 1y2m h SER 219 Ca 0.06 -0.17 -0.01 0.00 -0.84 0.00 0.00 61.79 60.83 1y2m h SER 219 Cb 0.39 -0.13 -0.04 0.00 0.14 0.00 0.00 62.40 62.76 1y2m h SER 219 CO 0.02 0.75 0.46 1.88 -1.14 0.00 0.00 176.83 178.80 1y2m h TYR 220 N 0.40 1.08 -0.11 3.45 -1.99 -0.94 0.11 116.97 118.97 1y2m h TYR 220 Ca 0.05 -0.01 -0.01 0.00 2.00 0.00 0.00 58.73 60.76 1y2m h TYR 220 Cb 0.72 -0.35 -0.00 0.00 2.00 0.00 0.00 36.73 39.10 1y2m h TYR 220 CO 0.02 0.74 0.04 0.82 -0.00 0.00 0.00 178.16 179.78 1y2m h ILE 221 N 1.10 1.17 -0.96 -2.88 2.04 -1.15 -1.45 117.51 115.38 1y2m h ILE 221 Ca 0.28 -0.53 0.02 0.00 1.00 0.00 0.00 64.86 65.64 1y2m h ILE 221 Cb -0.01 1.32 -0.05 0.00 -0.74 0.00 0.00 36.82 37.34 1y2m h ILE 221 CO -0.05 0.15 0.63 0.00 0.00 0.00 0.00 178.15 178.89 1y2m h ALA 222 N 0.85 1.24 -0.24 1.87 0.00 -0.95 -2.17 119.26 119.87 1y2m h ALA 222 Ca 0.04 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 1y2m h ALA 222 Cb 0.21 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1y2m h ALA 222 CO -0.00 0.57 -0.25 0.00 0.00 0.00 0.00 179.25 179.57 1y2m h ALA 223 N 1.37 1.13 -0.04 0.00 0.00 -0.64 -1.85 119.26 119.23 1y2m h ALA 223 Ca 0.36 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1y2m h ALA 223 Cb -0.09 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 1y2m h ALA 223 CO -0.09 0.55 -0.01 0.00 0.00 0.00 0.00 179.25 179.69 1y2m h ALA 224 N 1.34 0.06 0.00 0.00 0.00 -0.76 0.22 119.26 120.12 1y2m h ALA 224 Ca 0.06 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1y2m h ALA 224 Cb 0.66 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1y2m h ALA 224 CO 0.05 -0.23 0.00 -0.84 0.00 0.00 0.00 179.25 178.23 1y2m h ILE 225 N -0.27 0.00 -0.18 0.00 3.07 -1.28 -1.98 117.51 116.87 1y2m h ILE 225 Ca 0.01 -0.41 0.00 0.00 1.55 0.00 0.00 64.86 66.01 1y2m h ILE 225 Cb 0.40 1.30 0.00 0.00 -0.27 0.00 0.00 36.82 38.25 1y2m h ILE 225 CO 0.00 0.00 0.00 -1.54 -1.05 0.00 0.00 178.15 175.56 1y2m n SER 226 N -2.67 2.19 -2.94 2.16 3.41 -0.71 -1.98 113.62 113.08 1y2m n SER 226 Ca 0.02 -1.77 -0.18 0.00 -0.26 0.00 0.00 58.87 56.67 1y2m n SER 226 Cb 0.29 -0.11 0.06 0.00 -0.26 0.00 0.00 64.21 64.19 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 1.25 -0.23 3.73 5.00 0.00 -0.72 -4.70 105.19 109.53 1y2m n GLY 227 Ca 0.17 0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 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 -4.36 2.61 0.27 1.61 -0.00 -0.01 -4.78 115.22 110.55 1y2m n HIS 228 Ca -0.02 0.46 0.12 0.00 -0.00 0.00 0.00 57.72 58.27 1y2m n HIS 228 Cb 0.56 -2.49 0.55 0.00 -0.00 0.00 0.00 29.99 28.61 1y2m n HIS 228 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.34 174.04 1y2m n PRO 229 N 0.91 0.17 -0.24 1.57 -0.02 -1.26 -1.98 135.00 134.14 1y2m n PRO 229 Ca 0.05 0.55 0.09 0.00 -2.02 0.00 0.00 63.50 62.17 1y2m n PRO 229 Cb 0.37 -1.93 0.19 0.00 -0.02 0.00 0.00 33.50 32.11 1y2m n PRO 229 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1y2m n ASP 230 N -2.27 3.06 -4.72 2.55 2.03 -1.26 -4.95 116.55 110.98 1y2m n ASP 230 Ca 0.00 -3.04 -0.40 0.00 0.52 0.00 0.00 54.79 51.87 1y2m n ASP 230 Cb 0.12 -0.48 -0.05 0.00 -0.72 0.00 0.00 41.12 40.00 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 -2.42 7.02 0.08 1.67 0.15 -0.84 -5.03 113.70 114.33 1y2m s SER 231 Ca 0.36 1.22 0.06 0.00 0.70 0.00 0.00 55.95 58.30 1y2m s SER 231 Cb 0.31 -2.42 -0.04 0.00 -1.71 0.00 0.00 66.02 62.16 1y2m s SER 231 CO 0.06 -0.09 -0.08 -0.54 1.20 0.00 0.00 173.24 173.79 1y2m s LYS 232 N 0.64 2.28 0.04 5.44 3.01 -1.26 -0.56 119.74 129.33 1y2m s LYS 232 Ca 0.37 -0.94 0.01 0.00 -1.01 0.00 0.00 55.97 54.40 1y2m s LYS 232 Cb -0.18 -2.38 -0.03 0.00 -1.01 0.00 0.00 37.83 34.23 1y2m s LYS 232 CO 0.19 0.53 -0.05 0.14 0.51 0.00 0.00 175.35 176.67 1y2m s VAL 233 N -1.19 0.32 -0.09 3.17 -7.23 0.20 -1.55 120.40 114.02 1y2m s VAL 233 Ca 0.21 -1.28 -0.10 0.00 -1.81 0.00 0.00 61.98 59.00 1y2m s VAL 233 Cb -0.11 -0.81 -0.05 0.00 0.56 0.00 0.00 36.38 35.98 1y2m s VAL 233 CO 0.13 -0.63 0.23 -2.28 -0.31 0.00 0.00 175.10 172.24 1y2m s HIS 234 N -2.26 3.61 0.10 2.82 2.46 0.22 -0.83 115.29 121.41 1y2m s HIS 234 Ca -0.06 0.65 -0.10 0.00 0.47 0.00 0.00 55.06 56.02 1y2m s HIS 234 Cb -0.04 -2.08 0.01 0.00 -0.13 0.00 0.00 32.58 30.33 1y2m s HIS 234 CO -0.03 0.65 0.24 0.54 -2.47 0.00 0.00 174.74 173.67 1y2m s VAL 235 N -0.84 0.12 -0.20 0.89 0.11 -0.35 -0.91 120.40 119.23 1y2m s VAL 235 Ca 0.17 -1.03 -0.06 0.00 -2.93 0.00 0.00 61.98 58.13 1y2m s VAL 235 Cb -0.13 -1.29 -0.03 0.00 -1.53 0.00 0.00 36.38 33.40 1y2m s VAL 235 CO 0.06 -0.57 0.03 -0.69 -3.33 0.00 0.00 175.10 170.61 1y2m s VAL 236 N -3.82 4.36 -0.14 2.04 1.01 -1.26 -0.57 120.40 122.03 1y2m s VAL 236 Ca 0.04 -0.18 -0.10 0.00 0.00 0.00 0.00 61.98 61.74 1y2m s VAL 236 Cb 0.04 -2.97 0.04 0.00 0.00 0.00 0.00 36.38 33.49 1y2m s VAL 236 CO -0.11 0.43 0.34 -2.28 0.00 0.00 0.00 175.10 173.48 1y2m s HIS 237 N 0.77 -0.43 -1.52 5.22 5.04 -0.58 -4.86 115.29 118.93 1y2m s HIS 237 Ca 0.02 0.99 -0.13 0.00 -1.54 0.00 0.00 55.06 54.40 1y2m s HIS 237 Cb -0.14 0.15 0.08 0.00 0.04 0.00 0.00 32.58 32.71 1y2m s HIS 237 CO 0.02 -0.23 0.95 0.39 -2.34 0.00 0.00 174.74 173.53 1y2m n GLU 238 N 3.47 -5.36 -1.02 2.88 1.02 -1.26 -1.91 120.64 118.45 1y2m n GLU 238 Ca -0.18 0.59 -0.01 0.00 -0.02 0.00 0.00 57.16 57.54 1y2m n GLU 238 Cb 0.56 -5.43 -0.00 0.00 -0.02 0.00 0.00 31.44 26.55 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 -1.68 0.36 3.12 0.62 0.00 -1.26 -5.00 105.19 101.36 1y2m n GLY 239 Ca 0.01 -0.06 -0.09 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.96 0.61 0.13 1.61 -2.85 -0.81 -5.13 119.74 112.34 1y2m s LYS 240 Ca 0.00 -0.79 -0.31 0.00 -1.00 0.00 0.00 55.97 53.87 1y2m s LYS 240 Cb 0.00 0.24 -0.08 0.00 -2.06 0.00 0.00 37.83 35.93 1y2m s LYS 240 CO 0.00 -0.15 1.32 -1.21 0.10 0.00 0.00 175.35 175.40 1y2m s GLU 241 N -2.76 4.37 0.07 1.78 2.02 -1.26 -1.53 118.70 121.38 1y2m s GLU 241 Ca -0.04 1.99 0.04 0.00 0.02 0.00 0.00 54.97 56.99 1y2m s GLU 241 Cb -0.00 -3.25 -0.03 0.00 0.10 0.00 0.00 34.13 30.95 1y2m s GLU 241 CO -0.05 -0.33 -0.11 0.15 0.02 0.00 0.00 175.26 174.94 1y2m s LYS 242 N 0.69 0.73 -0.17 1.61 1.02 0.27 -4.97 119.74 118.91 1y2m s LYS 242 Ca 0.61 -0.95 -0.01 0.00 0.02 0.00 0.00 55.97 55.63 1y2m s LYS 242 Cb -0.35 -0.55 -0.00 0.00 -0.52 0.00 0.00 37.83 36.41 1y2m s LYS 242 CO 0.32 0.11 -0.13 0.42 -0.92 0.00 0.00 175.35 175.15 1y2m s ILE 243 N -1.69 2.74 0.20 2.17 1.01 -1.26 -1.21 121.20 123.17 1y2m s ILE 243 Ca -0.02 -0.73 0.03 0.00 0.00 0.00 0.00 60.65 59.93 1y2m s ILE 243 Cb -0.08 -2.18 -0.05 0.00 0.01 0.00 0.00 42.46 40.16 1y2m s ILE 243 CO 0.01 0.50 -0.02 -0.76 0.00 0.00 0.00 174.94 174.67 1y2m s LEU 244 N 1.03 2.24 0.60 2.97 1.43 -0.01 -4.95 118.68 121.99 1y2m s LEU 244 Ca -0.01 -1.17 -0.18 0.00 -1.03 0.00 0.00 54.13 51.74 1y2m s LEU 244 Cb -0.15 -0.25 -0.03 0.00 0.03 0.00 0.00 46.19 45.79 1y2m s LEU 244 CO -0.03 -0.48 1.19 -0.31 0.23 0.00 0.00 176.35 176.95 1y2m s TYR 245 N -3.44 2.42 0.18 0.29 2.02 -1.26 -0.63 117.35 116.92 1y2m s TYR 245 Ca 0.25 1.53 -0.14 0.00 -0.37 0.00 0.00 57.07 58.34 1y2m s TYR 245 Cb 0.05 -3.44 0.13 0.00 -0.40 0.00 0.00 41.96 38.30 1y2m s TYR 245 CO 0.06 -2.13 1.77 0.00 -1.57 0.00 0.00 175.55 173.68 1y2m h ALA 246 N 0.81 0.59 -0.46 3.71 0.00 -1.10 -1.50 119.26 121.30 1y2m h ALA 246 Ca -0.50 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.41 1y2m h ALA 246 Cb 1.29 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 1y2m h ALA 246 CO 0.55 -0.17 0.11 0.00 0.00 0.00 0.00 179.25 179.74 1y2m h ARG 247 N 0.40 0.70 -0.28 0.00 3.08 -1.85 -2.63 114.38 113.80 1y2m h ARG 247 Ca 0.22 -0.13 -0.00 0.00 0.07 0.00 0.00 59.98 60.13 1y2m h ARG 247 Cb 0.17 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 1y2m h ARG 247 CO -0.19 0.64 0.17 0.93 -1.07 0.00 0.00 179.97 180.45 1y2m h GLU 248 N 0.68 0.38 -1.26 0.04 5.08 -1.70 -1.49 114.58 116.30 1y2m h GLU 248 Ca 0.15 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1y2m h GLU 248 Cb 0.26 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.43 1y2m h GLU 248 CO -0.00 0.30 0.00 0.00 -1.00 0.00 0.00 179.01 178.30 1y2m n ALA 249 N -2.19 1.51 0.00 3.43 0.00 -0.65 -2.21 120.51 120.39 1y2m n ALA 249 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1y2m n ALA 249 Cb 0.05 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.50 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 0.75 0.00 0.25 0.00 0.00 -0.56 -2.82 120.51 118.13 1y2m n ALA 251 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.56 1y2m n ALA 251 Cb 0.06 0.00 0.65 0.00 0.00 0.00 0.00 19.45 20.17 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 0.00 -2.97 0.00 3.38 -1.72 -3.09 115.31 110.91 1y2m h LEU 252 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1y2m h LEU 252 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1y2m h LEU 252 CO 0.00 0.14 0.00 0.49 0.09 0.00 0.00 178.44 179.16 1y2m n PHE 253 N -3.49 0.20 -3.51 1.13 3.72 -1.13 -5.01 117.46 109.37 1y2m n PHE 253 Ca -0.01 -0.55 -0.20 0.00 -0.05 0.00 0.00 57.45 56.64 1y2m n PHE 253 Cb 0.30 -0.06 0.08 0.00 -0.94 0.00 0.00 39.48 38.86 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 -0.23 -3.55 -4.72 4.37 5.15 -1.17 -5.03 115.26 110.09 1y2m n ASN 254 Ca 0.06 -0.61 -0.30 0.00 -0.60 0.00 0.00 54.58 53.13 1y2m n ASN 254 Cb 0.36 -5.02 -0.07 0.00 -0.53 0.00 0.00 39.78 34.52 1y2m n ASN 254 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1y2m s LEU 255 N -6.72 3.57 -0.03 1.20 1.43 -1.26 -5.03 118.68 111.84 1y2m s LEU 255 Ca 0.22 -0.14 0.01 0.00 -1.03 0.00 0.00 54.13 53.19 1y2m s LEU 255 Cb -0.10 -2.28 -0.03 0.00 0.03 0.00 0.00 46.19 43.81 1y2m s LEU 255 CO 0.74 0.17 -0.01 -1.61 0.23 0.00 0.00 176.35 175.86 1y2m s GLU 256 N -2.40 2.82 0.51 1.70 0.41 -1.26 -4.37 118.70 116.10 1y2m s GLU 256 Ca 0.27 -0.56 -0.21 0.00 -0.41 0.00 0.00 54.97 54.07 1y2m s GLU 256 Cb -0.12 -2.68 -0.07 0.00 -1.78 0.00 0.00 34.13 29.49 1y2m s GLU 256 CO 0.20 0.65 1.13 -1.25 -0.49 0.00 0.00 175.26 175.50 1y2m s PRO 257 N -1.28 3.55 0.29 0.39 0.04 -1.26 -5.01 135.00 131.72 1y2m s PRO 257 Ca 0.17 1.64 -0.14 0.00 0.04 0.00 0.00 61.00 62.71 1y2m s PRO 257 Cb -0.11 -2.16 -0.08 0.00 0.04 0.00 0.00 34.50 32.18 1y2m s PRO 257 CO 0.07 -0.69 0.69 0.14 0.04 0.00 0.00 177.00 177.24 1y2m s VAL 258 N -1.71 4.73 -0.24 -0.36 -7.23 -0.84 -4.99 120.40 109.76 1y2m s VAL 258 Ca 0.69 0.86 -0.07 0.00 -1.81 0.00 0.00 61.98 61.65 1y2m s VAL 258 Cb -0.25 -3.63 -0.03 0.00 0.56 0.00 0.00 36.38 33.03 1y2m s VAL 258 CO 0.29 -0.12 0.07 -0.69 -0.31 0.00 0.00 175.10 174.34 1y2m s VAL 259 N -1.90 4.40 0.07 1.32 1.01 -1.26 -4.31 120.40 119.74 1y2m s VAL 259 Ca 0.51 -0.14 -0.31 0.00 0.00 0.00 0.00 61.98 62.04 1y2m s VAL 259 Cb -0.11 -3.05 -0.06 0.00 0.00 0.00 0.00 36.38 33.16 1y2m s VAL 259 CO 0.18 0.35 1.23 -0.76 0.00 0.00 0.00 175.10 176.10 1y2m s LEU 260 N 1.50 4.37 0.00 3.92 1.43 -1.26 -5.03 118.68 123.61 1y2m s LEU 260 Ca 0.06 2.08 0.00 0.00 -1.03 0.00 0.00 54.13 55.24 1y2m s LEU 260 Cb -0.15 -3.58 0.00 0.00 0.03 0.00 0.00 46.19 42.49 1y2m s LEU 260 CO 0.04 -0.50 0.00 0.61 0.23 0.00 0.00 176.35 176.73 1y2m n GLY 261 N 3.23 2.82 3.68 -3.19 0.00 -1.26 -4.47 105.19 106.00 1y2m n GLY 261 Ca 0.09 -2.13 -0.44 0.00 0.00 0.00 0.00 46.02 43.55 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 -0.56 2.09 0.00 1.61 -0.02 -1.26 -1.04 135.00 135.82 1y2m n PRO 262 Ca 0.00 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.22 1y2m n PRO 262 Cb 0.00 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.11 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 1.45 0.00 0.15 -0.52 3.00 -1.26 -4.82 118.16 116.16 1y2m n LYS 263 Ca 0.09 0.00 0.02 0.00 -0.00 0.00 0.00 58.31 58.42 1y2m n LYS 263 Cb 0.33 -2.70 0.11 0.00 0.00 0.00 0.00 35.03 32.77 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 0.97 0.00 0.50 1.64 5.08 -1.35 0.18 114.58 121.60 1y2m h GLU 264 Ca 0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1y2m h GLU 264 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1y2m h GLU 264 CO 0.00 0.52 -0.24 0.78 -1.00 0.00 0.00 179.01 179.07 1y2m h GLY 265 N 2.96 -0.70 1.57 -3.84 0.00 -1.88 -1.45 103.07 99.73 1y2m h GLY 265 Ca -0.01 0.26 -0.06 0.00 0.00 0.00 0.00 47.33 47.52 1y2m h GLY 265 CO 0.07 -0.26 -0.07 1.41 0.00 0.00 0.00 176.54 177.69 1y2m h LEU 266 N -0.81 0.50 -1.60 3.11 3.38 -1.89 -0.55 115.31 117.45 1y2m h LEU 266 Ca -0.07 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 57.76 1y2m h LEU 266 Cb 0.58 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 1y2m h LEU 266 CO 0.11 0.62 0.02 1.23 0.09 0.00 0.00 178.44 180.52 1y2m h GLY 267 N 0.89 0.29 0.93 0.83 0.00 -0.57 -0.96 103.07 104.48 1y2m h GLY 267 Ca 0.10 -0.14 -0.33 0.00 0.00 0.00 0.00 47.33 46.95 1y2m h GLY 267 CO 0.02 0.13 -1.76 1.41 0.00 0.00 0.00 176.54 176.35 1y2m h LEU 268 N 0.27 0.40 0.00 3.11 3.38 -0.86 -3.42 115.31 118.19 1y2m h LEU 268 Ca 0.07 -0.70 -0.17 0.00 0.09 0.00 0.00 57.88 57.17 1y2m h LEU 268 Cb 0.15 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 1y2m h LEU 268 CO 0.00 1.61 -2.06 1.33 0.09 0.00 0.00 178.44 179.40 1y2m n VAL 269 N -3.44 0.71 -2.85 1.22 0.24 -0.25 -4.80 118.33 109.16 1y2m n VAL 269 Ca -0.23 -0.67 -0.41 0.00 -2.04 0.00 0.00 64.34 60.99 1y2m n VAL 269 Cb 1.05 -0.28 -0.04 0.00 -1.47 0.00 0.00 33.84 33.11 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 -5.07 7.14 0.00 -1.34 -0.87 -0.38 -3.89 114.94 110.53 1y2m s ASN 270 Ca -0.08 1.38 0.00 0.00 -1.57 0.00 0.00 52.86 52.59 1y2m s ASN 270 Cb 0.10 -2.49 0.00 0.00 -0.02 0.00 0.00 41.25 38.84 1y2m s ASN 270 CO 0.86 -0.29 0.00 0.61 -2.57 0.00 0.00 177.10 175.72 1y2m n GLY 271 N 3.13 0.32 0.17 0.66 0.00 -0.61 -3.55 105.19 105.32 1y2m n GLY 271 Ca 0.04 -1.79 0.06 0.00 0.00 0.00 0.00 46.02 44.34 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 3.89 1.59 0.15 2.61 -2.24 -1.26 -0.14 114.28 118.88 1y2m n THR 272 Ca 0.00 -1.74 0.05 0.00 -2.27 0.00 0.00 64.05 60.08 1y2m n THR 272 Cb 0.00 0.04 0.48 0.00 -2.10 0.00 0.00 70.33 68.75 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 0.31 1.71 0.00 6.98 0.00 -1.94 0.68 119.26 127.01 1y2m h ALA 273 Ca 0.00 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 1y2m h ALA 273 Cb 0.87 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.60 1y2m h ALA 273 CO 0.02 0.22 -0.13 0.28 0.00 0.00 0.00 179.25 179.64 1y2m h VAL 274 N 0.18 1.61 -0.70 0.00 2.07 -1.87 -1.21 116.25 116.34 1y2m h VAL 274 Ca 0.04 -1.98 -0.04 0.00 0.82 0.00 0.00 66.70 65.54 1y2m h VAL 274 Cb 0.19 2.92 -0.03 0.00 -1.52 0.00 0.00 31.29 32.85 1y2m h VAL 274 CO 0.01 0.53 0.28 0.77 0.02 0.00 0.00 177.57 179.18 1y2m h SER 275 N -0.68 0.97 -0.08 0.57 4.64 -1.91 -2.64 113.55 114.41 1y2m h SER 275 Ca -0.02 -0.17 -0.06 0.00 -0.47 0.00 0.00 61.79 61.07 1y2m h SER 275 Cb 0.94 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 62.76 1y2m h SER 275 CO 0.03 0.87 -0.12 0.00 -0.87 0.00 0.00 176.83 176.74 1y2m h ALA 276 N 1.13 1.34 0.00 5.18 0.00 -0.87 0.44 119.26 126.48 1y2m h ALA 276 Ca 0.23 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1y2m h ALA 276 Cb 0.20 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1y2m h ALA 276 CO -0.02 0.45 0.00 0.45 0.00 0.00 0.00 179.25 180.13 1y2m n SER 277 N -4.23 0.25 0.00 0.00 2.88 -0.46 -0.84 113.62 111.23 1y2m n SER 277 Ca 0.00 -0.74 0.00 0.00 -1.33 0.00 0.00 58.87 56.80 1y2m n SER 277 Cb 0.30 -0.13 0.00 0.00 -0.75 0.00 0.00 64.21 63.63 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 0.06 0.00 -0.16 -1.46 0.00 0.14 -1.86 120.51 117.23 1y2m n ALA 279 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 1y2m n ALA 279 Cb 0.06 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.52 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 1.21 -0.46 0.00 2.02 -1.22 0.10 112.91 114.57 1y2m h THR 280 Ca 0.00 -0.67 -0.02 0.00 0.77 0.00 0.00 66.41 66.50 1y2m h THR 280 Cb 0.00 0.76 -0.02 0.00 -1.74 0.00 0.00 68.15 67.15 1y2m h THR 280 CO 0.00 0.25 0.22 -0.07 0.37 0.00 0.00 175.52 176.29 1y2m h LEU 281 N 0.63 0.60 -0.57 2.58 3.38 -1.63 0.20 115.31 120.49 1y2m h LEU 281 Ca 0.16 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 1y2m h LEU 281 Cb 0.21 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1y2m h LEU 281 CO -0.01 0.56 0.22 0.00 0.09 0.00 0.00 178.44 179.30 1y2m h ALA 282 N 1.06 0.74 -0.26 1.53 0.00 -1.76 -2.07 119.26 118.50 1y2m h ALA 282 Ca 0.16 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1y2m h ALA 282 Cb 0.12 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1y2m h ALA 282 CO -0.02 0.36 0.01 1.25 0.00 0.00 0.00 179.25 180.84 1y2m h LEU 283 N 0.78 0.44 -0.54 0.00 5.85 -0.51 0.20 115.31 121.54 1y2m h LEU 283 Ca 0.19 -0.30 0.11 0.00 0.84 0.00 0.00 57.88 58.71 1y2m h LEU 283 Cb 0.21 -0.12 -0.10 0.00 0.37 0.00 0.00 40.66 41.02 1y2m h LEU 283 CO -0.01 0.64 -0.16 -0.74 -0.34 0.00 0.00 178.44 177.82 1y2m h HIS 284 N 0.24 -0.37 -0.29 1.25 2.76 -0.88 0.63 115.15 118.49 1y2m h HIS 284 Ca 0.07 0.05 -0.13 0.00 -2.20 0.00 0.00 60.37 58.16 1y2m h HIS 284 Cb 0.41 0.25 -0.01 0.00 1.55 0.00 0.00 27.41 29.60 1y2m h HIS 284 CO 0.03 -0.26 -0.36 -0.44 -1.30 0.00 0.00 177.93 175.60 1y2m h ASP 285 N -0.03 0.68 -0.35 3.26 3.32 -1.12 -2.92 116.42 119.27 1y2m h ASP 285 Ca 0.26 -0.29 -0.07 0.00 0.02 0.00 0.00 57.03 56.94 1y2m h ASP 285 Cb 0.42 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.76 1y2m h ASP 285 CO -0.57 0.98 -0.02 0.00 -1.72 0.00 0.00 179.24 177.91 1y2m h ALA 286 N 1.06 1.13 0.00 3.45 0.00 -0.17 -1.99 119.26 122.74 1y2m h ALA 286 Ca 0.05 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1y2m h ALA 286 Cb 0.88 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1y2m h ALA 286 CO 0.08 0.55 0.00 0.72 0.00 0.00 0.00 179.25 180.60 1y2m n HIS 287 N -4.21 0.00 0.00 0.00 8.25 0.14 -0.95 115.22 118.44 1y2m n HIS 287 Ca 0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.48 1y2m n HIS 287 Cb 0.30 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.39 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 0.62 0.00 0.07 2.41 4.77 -0.75 -2.02 117.00 122.10 1y2m n LEU 289 Ca 0.00 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.86 1y2m n LEU 289 Cb 0.00 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.03 1y2m n LEU 289 CO 0.00 0.00 0.83 -1.28 -1.33 0.00 0.00 177.39 175.61 1y2m h SER 290 N 0.00 -0.16 -0.54 -1.43 0.87 -1.32 0.84 113.55 111.80 1y2m h SER 290 Ca 0.00 0.02 -0.06 0.00 -1.23 0.00 0.00 61.79 60.52 1y2m h SER 290 Cb 0.00 0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 62.00 1y2m h SER 290 CO 0.00 -0.09 0.11 -0.07 -0.53 0.00 0.00 176.83 176.25 1y2m h LEU 291 N -0.13 0.88 -0.78 2.23 3.38 -1.67 -2.72 115.31 116.50 1y2m h LEU 291 Ca 0.01 -0.18 -0.08 0.00 0.09 0.00 0.00 57.88 57.72 1y2m h LEU 291 Cb 0.14 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 1y2m h LEU 291 CO -0.03 0.88 0.04 0.25 0.09 0.00 0.00 178.44 179.67 1y2m h LEU 292 N 0.89 0.93 -0.67 1.67 5.85 -1.78 -1.29 115.31 120.91 1y2m h LEU 292 Ca 0.19 -0.23 0.09 0.00 0.84 0.00 0.00 57.88 58.77 1y2m h LEU 292 Cb 0.37 -0.25 -0.07 0.00 0.37 0.00 0.00 40.66 41.08 1y2m h LEU 292 CO 0.01 0.96 0.31 -1.28 -0.34 0.00 0.00 178.44 178.10 1y2m h SER 293 N 0.90 0.39 -0.43 1.25 0.87 -0.56 0.24 113.55 116.21 1y2m h SER 293 Ca 0.17 0.06 -0.02 0.00 -1.23 0.00 0.00 61.79 60.78 1y2m h SER 293 Cb 0.46 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.41 1y2m h SER 293 CO 0.02 0.23 0.20 1.56 -0.53 0.00 0.00 176.83 178.31 1y2m h GLN 294 N 0.54 0.63 -0.72 2.24 4.20 -1.18 -0.07 115.11 120.75 1y2m h GLN 294 Ca 0.33 -0.10 0.01 0.00 0.06 0.00 0.00 58.65 58.95 1y2m h GLN 294 Cb 0.36 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 27.99 1y2m h GLN 294 CO -0.27 0.54 0.48 0.77 -0.67 0.00 0.00 178.83 179.68 1y2m h SER 295 N 0.56 0.82 -0.33 1.46 0.02 -0.80 -1.28 113.55 114.00 1y2m h SER 295 Ca 0.15 -0.02 -0.09 0.00 -0.84 0.00 0.00 61.79 60.98 1y2m h SER 295 Cb 0.13 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.45 1y2m h SER 295 CO -0.02 0.59 -0.12 -0.07 -1.14 0.00 0.00 176.83 176.07 1y2m h LEU 296 N 0.97 0.75 -0.02 5.07 3.38 -0.79 -2.55 115.31 122.12 1y2m h LEU 296 Ca 0.26 -0.23 0.01 0.00 0.09 0.00 0.00 57.88 58.02 1y2m h LEU 296 Cb -0.11 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.43 1y2m h LEU 296 CO -0.06 0.89 -0.03 0.74 0.09 0.00 0.00 178.44 180.07 1y2m h THR 297 N 0.69 0.92 0.00 0.22 2.02 -0.56 0.19 112.91 116.39 1y2m h THR 297 Ca 0.12 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.30 1y2m h THR 297 Cb 0.60 0.92 0.00 0.00 -1.74 0.00 0.00 68.15 67.92 1y2m h THR 297 CO 0.04 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.93 1y2m n ALA 298 N -2.19 1.10 0.00 6.16 0.00 -0.52 -1.28 120.51 123.77 1y2m n ALA 298 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1y2m n ALA 298 Cb 0.07 -0.93 0.00 0.00 0.00 0.00 0.00 19.45 18.59 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 0.64 0.00 -0.25 0.00 -1.04 0.06 -1.48 114.28 112.20 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 0.14 0.00 -1.82 0.00 0.00 70.33 68.65 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 0.89 -0.11 12.58 2.07 -1.43 -2.72 116.25 127.52 1y2m h VAL 301 Ca 0.00 -0.23 -0.01 0.00 0.82 0.00 0.00 66.70 67.29 1y2m h VAL 301 Cb 0.00 0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 29.93 1y2m h VAL 301 CO 0.00 0.12 0.05 -0.33 0.02 0.00 0.00 177.57 177.43 1y2m h GLU 302 N 0.67 0.17 -1.80 1.57 5.08 -1.53 0.30 114.58 119.03 1y2m h GLU 302 Ca 0.35 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 1y2m h GLU 302 Cb 0.33 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.55 1y2m h GLU 302 CO -0.24 0.25 0.00 0.00 -1.00 0.00 0.00 179.01 178.02 1y2m n ALA 303 N -2.20 1.42 -2.69 3.43 0.00 -1.03 -4.47 120.51 114.97 1y2m n ALA 303 Ca -0.05 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.33 1y2m n ALA 303 Cb 0.10 -0.97 0.10 0.00 0.00 0.00 0.00 19.45 18.68 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 0.94 0.00 -1.75 0.00 0.24 -0.77 -4.91 118.33 112.08 1y2m n VAL 305 Ca 0.00 -1.31 0.00 0.00 -2.04 0.00 0.00 64.34 60.99 1y2m n VAL 305 Cb 0.00 0.93 0.00 0.00 -1.47 0.00 0.00 33.84 33.30 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 -0.67 0.29 3.53 7.63 0.00 0.02 -4.61 105.19 111.38 1y2m n GLY 306 Ca -0.08 -1.87 -0.39 0.00 0.00 0.00 0.00 46.02 43.68 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 0.06 3.21 0.30 1.61 3.76 -1.26 -0.45 115.29 122.52 1y2m s HIS 307 Ca 0.00 -0.18 0.35 0.00 -0.15 0.00 0.00 55.06 55.08 1y2m s HIS 307 Cb 0.00 -2.41 1.61 0.00 1.11 0.00 0.00 32.58 32.90 1y2m s HIS 307 CO 0.00 -0.31 2.08 0.00 -0.85 0.00 0.00 174.74 175.66 1y2m h ALA 308 N 8.41 1.05 -0.05 -1.40 0.00 -1.16 -3.13 119.26 122.97 1y2m h ALA 308 Ca -0.33 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.56 1y2m h ALA 308 Cb 1.17 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.95 1y2m h ALA 308 CO 0.60 0.05 0.10 0.78 0.00 0.00 0.00 179.25 180.77 1y2m h GLY 309 N 1.34 0.00 1.54 0.00 0.00 -1.92 -1.82 103.07 102.20 1y2m h GLY 309 Ca -0.00 0.00 0.03 0.00 0.00 0.00 0.00 47.33 47.36 1y2m h GLY 309 CO 0.01 0.00 0.20 1.76 0.00 0.00 0.00 176.54 178.51 1y2m h SER 310 N 0.00 0.00 -0.36 0.19 0.02 -1.91 -2.28 113.55 109.20 1y2m h SER 310 Ca 0.03 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1y2m h SER 310 Cb 0.22 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.76 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 -3.38 0.86 -2.32 3.45 3.72 -0.68 -4.94 117.46 114.16 1y2m n PHE 311 Ca -0.00 -0.68 -0.40 0.00 -0.05 0.00 0.00 57.45 56.31 1y2m n PHE 311 Cb 0.29 -0.19 -0.03 0.00 -0.94 0.00 0.00 39.48 38.61 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 -1.94 3.35 0.57 1.38 2.46 -0.86 -4.69 115.29 115.57 1y2m s HIS 312 Ca 0.36 1.58 0.27 0.00 0.47 0.00 0.00 55.06 57.73 1y2m s HIS 312 Cb 0.25 -3.45 1.59 0.00 -0.13 0.00 0.00 32.58 30.84 1y2m s HIS 312 CO 0.14 -1.11 2.12 -1.35 -2.47 0.00 0.00 174.74 172.07 1y2m h PRO 313 N 3.66 0.00 -0.74 2.88 0.11 -1.95 -0.25 132.00 135.70 1y2m h PRO 313 Ca -0.48 0.00 0.05 0.00 0.11 0.00 0.00 66.00 65.68 1y2m h PRO 313 Cb 1.22 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.28 1y2m h PRO 313 CO 0.66 0.00 0.49 0.35 -0.21 0.00 0.00 178.00 179.29 1y2m h PHE 314 N 0.00 0.83 0.00 0.65 3.57 -1.96 -0.67 116.94 119.36 1y2m h PHE 314 Ca 0.08 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.60 1y2m h PHE 314 Cb 0.41 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 38.87 1y2m h PHE 314 CO 0.00 0.46 0.00 1.28 -2.23 0.00 0.00 178.31 177.82 1y2m n LEU 315 N -4.47 0.00 0.00 0.59 4.77 -0.11 -2.35 117.00 115.44 1y2m n LEU 315 Ca 0.10 0.41 0.00 0.00 -0.03 0.00 0.00 56.01 56.49 1y2m n LEU 315 Cb 0.17 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 40.86 1y2m n LEU 315 CO 0.34 -0.10 0.00 1.41 -1.33 0.00 0.00 177.39 177.71 1y2m n HIS 316 N -1.41 0.00 -0.25 -1.77 8.25 -0.87 -4.48 115.22 114.70 1y2m n HIS 316 Ca 0.08 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.59 1y2m n HIS 316 Cb 0.23 0.18 0.18 0.00 1.12 0.00 0.00 29.99 31.69 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 0.12 0.00 0.41 3.32 -1.38 -1.81 116.42 117.08 1y2m h ASP 317 Ca 0.00 0.13 -0.06 0.00 0.02 0.00 0.00 57.03 57.11 1y2m h ASP 317 Cb 0.00 0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 1y2m h ASP 317 CO 0.00 0.02 -0.36 0.58 -1.72 0.00 0.00 179.24 177.76 1y2m h VAL 318 N 0.34 1.43 0.00 -1.35 2.07 -1.57 -3.41 116.25 113.76 1y2m h VAL 318 Ca 0.41 -2.21 -0.31 0.00 0.82 0.00 0.00 66.70 65.41 1y2m h VAL 318 Cb 0.67 2.84 -0.05 0.00 -1.52 0.00 0.00 31.29 33.22 1y2m h VAL 318 CO -0.46 0.48 -1.88 0.35 0.02 0.00 0.00 177.57 176.09 1y2m n THR 319 N -4.57 1.53 -3.12 2.57 -2.24 -0.99 -4.68 114.28 102.77 1y2m n THR 319 Ca -0.16 -0.81 -0.19 0.00 -2.27 0.00 0.00 64.05 60.63 1y2m n THR 319 Cb 0.51 -0.87 -0.05 0.00 -2.10 0.00 0.00 70.33 67.82 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 -2.96 0.44 -1.31 -0.78 0.63 -0.69 -4.99 116.66 107.00 1y2m n ARG 320 Ca -0.21 -2.74 -0.25 0.00 -0.92 0.00 0.00 57.85 53.74 1y2m n ARG 320 Cb 1.07 -1.51 -0.09 0.00 0.45 0.00 0.00 32.46 32.38 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 2.47 2.79 -2.16 -0.14 -0.04 -1.16 -4.67 135.00 132.09 1y2m n PRO 321 Ca 0.23 -1.89 -0.42 0.00 -0.04 0.00 0.00 63.50 61.38 1y2m n PRO 321 Cb 0.53 -2.28 -0.03 0.00 -0.04 0.00 0.00 33.50 31.67 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 0.33 2.55 0.25 0.54 3.76 -1.26 -4.89 115.29 116.56 1y2m s HIS 322 Ca 0.64 0.61 -0.03 0.00 -0.15 0.00 0.00 55.06 56.14 1y2m s HIS 322 Cb 0.29 -3.74 0.49 0.00 1.11 0.00 0.00 32.58 30.72 1y2m s HIS 322 CO -0.08 -2.89 1.75 -1.35 -0.85 0.00 0.00 174.74 171.32 1y2m h PRO 323 N 8.44 0.54 0.00 8.40 0.11 -1.91 -0.71 132.00 146.87 1y2m h PRO 323 Ca -0.37 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.67 1y2m h PRO 323 Cb 1.17 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 1y2m h PRO 323 CO 0.93 0.36 -0.19 1.79 -0.21 0.00 0.00 178.00 180.68 1y2m h THR 324 N 0.56 0.37 -0.02 -1.15 1.35 -1.88 -1.32 112.91 110.81 1y2m h THR 324 Ca 0.43 -1.30 -0.00 0.00 -0.55 0.00 0.00 66.41 64.99 1y2m h THR 324 Cb 0.62 2.00 -0.00 0.00 -1.73 0.00 0.00 68.15 69.03 1y2m h THR 324 CO -0.37 0.19 0.00 -0.61 -0.25 0.00 0.00 175.52 174.48 1y2m h GLN 325 N 0.00 0.03 -0.71 4.72 4.15 -1.41 -1.06 115.11 120.83 1y2m h GLN 325 Ca -0.00 -0.01 0.13 0.00 0.77 0.00 0.00 58.65 59.54 1y2m h GLN 325 Cb 0.98 -0.00 -0.09 0.00 0.21 0.00 0.00 27.48 28.58 1y2m h GLN 325 CO 0.02 0.30 0.27 0.82 -1.93 0.00 0.00 178.83 178.32 1y2m h ILE 326 N -0.24 0.69 0.03 2.39 2.04 -1.18 0.19 117.51 121.43 1y2m h ILE 326 Ca 0.01 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.72 1y2m h ILE 326 Cb 0.28 0.22 -0.01 0.00 -0.74 0.00 0.00 36.82 36.58 1y2m h ILE 326 CO 0.00 0.08 -0.05 -0.08 0.00 0.00 0.00 178.15 178.10 1y2m h GLU 327 N 0.43 -0.10 -0.21 2.37 4.81 -1.05 -0.10 114.58 120.73 1y2m h GLU 327 Ca 0.38 0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.58 1y2m h GLU 327 Cb 0.55 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.94 1y2m h GLU 327 CO -0.38 -0.06 -0.03 0.28 -0.73 0.00 0.00 179.01 178.09 1y2m h VAL 328 N -0.10 1.27 -0.95 0.32 2.07 -0.86 -0.66 116.25 117.35 1y2m h VAL 328 Ca 0.01 -0.97 0.06 0.00 0.82 0.00 0.00 66.70 66.62 1y2m h VAL 328 Cb 0.11 1.50 -0.06 0.00 -1.52 0.00 0.00 31.29 31.31 1y2m h VAL 328 CO -0.03 0.30 0.60 0.00 0.02 0.00 0.00 177.57 178.46 1y2m h ALA 329 N 0.76 1.30 -0.54 1.67 0.00 -0.90 -1.69 119.26 119.87 1y2m h ALA 329 Ca 0.05 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 1y2m h ALA 329 Cb 0.46 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1y2m h ALA 329 CO 0.02 0.39 -0.05 0.78 0.00 0.00 0.00 179.25 180.39 1y2m h GLY 330 N 1.11 1.06 0.95 0.00 0.00 -0.58 0.23 103.07 105.83 1y2m h GLY 330 Ca 0.41 -0.82 0.01 0.00 0.00 0.00 0.00 47.33 46.92 1y2m h GLY 330 CO -0.17 0.75 0.12 3.43 0.00 0.00 0.00 176.54 180.67 1y2m h ASN 331 N 0.86 0.19 -0.35 0.19 2.35 -0.68 -0.89 115.58 117.24 1y2m h ASN 331 Ca 0.15 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.82 1y2m h ASN 331 Cb 0.60 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.93 1y2m h ASN 331 CO 0.04 0.14 -0.07 0.40 -1.65 0.00 0.00 177.43 176.29 1y2m h ILE 332 N 0.24 1.27 -0.68 2.81 2.04 -1.16 -1.16 117.51 120.87 1y2m h ILE 332 Ca 0.08 -1.12 0.10 0.00 1.00 0.00 0.00 64.86 64.92 1y2m h ILE 332 Cb 0.00 1.28 -0.07 0.00 -0.74 0.00 0.00 36.82 37.29 1y2m h ILE 332 CO -0.04 0.37 0.32 -0.09 0.00 0.00 0.00 178.15 178.70 1y2m h ARG 333 N 0.47 0.53 -0.40 2.37 2.43 -0.89 -0.90 114.38 117.99 1y2m h ARG 333 Ca 0.09 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.20 1y2m h ARG 333 Cb 0.57 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.98 1y2m h ARG 333 CO 0.03 0.35 0.13 -0.22 -1.51 0.00 0.00 179.97 178.75 1y2m h LYS 334 N 0.54 0.62 -0.32 0.20 3.64 -0.80 -2.22 116.57 118.24 1y2m h LYS 334 Ca 0.34 -0.13 -0.04 0.00 -1.27 0.00 0.00 60.65 59.55 1y2m h LYS 334 Cb 0.38 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.09 1y2m h LYS 334 CO -0.28 0.62 0.01 -0.07 -2.27 0.00 0.00 179.45 177.46 1y2m h LEU 335 N 0.50 0.45 0.00 5.20 3.38 -0.54 -2.93 115.31 121.37 1y2m h LEU 335 Ca 0.13 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1y2m h LEU 335 Cb 0.25 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.89 1y2m h LEU 335 CO -0.00 0.51 -0.26 0.18 0.09 0.00 0.00 178.44 178.95 1y2m n LEU 336 N -4.30 0.64 -4.68 1.67 4.77 -0.40 -4.30 117.00 110.39 1y2m n LEU 336 Ca 0.01 0.40 -0.45 0.00 -0.03 0.00 0.00 56.01 55.94 1y2m n LEU 336 Cb 0.22 -0.29 -0.03 0.00 -2.33 0.00 0.00 43.42 40.99 1y2m n LEU 336 CO 0.38 -0.09 1.14 -0.62 -1.33 0.00 0.00 177.39 176.88 1y2m n GLU 337 N -2.05 2.23 -0.89 3.23 1.02 -0.87 -1.23 120.64 122.10 1y2m n GLU 337 Ca 0.05 0.80 0.00 0.00 -0.02 0.00 0.00 57.16 57.99 1y2m n GLU 337 Cb 0.41 -2.53 0.00 0.00 -0.02 0.00 0.00 31.44 29.30 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 2.79 1.09 3.76 0.62 0.00 -1.26 -4.37 105.19 107.82 1y2m n GLY 338 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 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 -3.06 7.09 0.00 1.61 0.15 -0.36 -4.33 113.70 114.80 1y2m s SER 339 Ca 0.00 2.40 0.21 0.00 0.70 0.00 0.00 55.95 59.26 1y2m s SER 339 Cb 0.00 -2.63 0.34 0.00 -1.71 0.00 0.00 66.02 62.02 1y2m s SER 339 CO 0.00 -0.30 1.31 0.54 1.20 0.00 0.00 173.24 175.99 1y2m n ARG 340 N 1.28 2.31 -0.10 5.44 1.74 0.74 -4.42 116.66 123.64 1y2m n ARG 340 Ca 0.00 -2.10 -0.17 0.00 -0.77 0.00 0.00 57.85 54.80 1y2m n ARG 340 Cb 0.44 -1.46 -0.09 0.00 -1.02 0.00 0.00 32.46 30.33 1y2m n ARG 340 CO 0.00 0.00 0.00 0.74 -1.52 0.00 0.00 177.63 176.85 1y2m h PHE 341 N 4.14 0.00 -4.01 -1.55 0.04 -1.86 -3.48 116.94 110.22 1y2m h PHE 341 Ca 0.00 0.00 -0.51 0.00 2.80 0.00 0.00 57.97 60.26 1y2m h PHE 341 Cb 0.92 0.00 0.07 0.00 2.20 0.00 0.00 35.95 39.15 1y2m h PHE 341 CO 0.18 1.11 0.51 0.00 -0.60 0.00 0.00 178.31 179.51 1y2m s ALA 342 N -2.45 2.96 -0.07 2.45 0.00 -1.26 -4.43 121.76 118.96 1y2m s ALA 342 Ca -0.25 1.01 -0.21 0.00 0.00 0.00 0.00 51.96 52.51 1y2m s ALA 342 Cb 0.05 -3.41 -0.04 0.00 0.00 0.00 0.00 23.12 19.71 1y2m s ALA 342 CO 0.50 -0.77 0.60 0.08 0.00 0.00 0.00 175.76 176.17 1y2m s VAL 343 N -1.49 5.07 -0.12 0.00 1.01 0.40 -4.88 120.40 120.40 1y2m s VAL 343 Ca 0.64 1.23 -0.12 0.00 0.00 0.00 0.00 61.98 63.74 1y2m s VAL 343 Cb -0.31 -3.94 -0.05 0.00 0.00 0.00 0.00 36.38 32.08 1y2m s VAL 343 CO 0.37 0.31 0.27 -1.00 0.00 0.00 0.00 175.10 175.05 1y2m s HIS 344 N 0.56 3.55 0.23 5.22 3.76 -1.26 -0.55 115.29 126.79 1y2m s HIS 344 Ca 0.32 0.65 -0.07 0.00 -0.15 0.00 0.00 55.06 55.81 1y2m s HIS 344 Cb -0.17 -2.22 0.40 0.00 1.11 0.00 0.00 32.58 31.70 1y2m s HIS 344 CO 0.15 0.45 1.69 1.25 -0.85 0.00 0.00 174.74 177.44 1y2m h HIS 345 N 5.83 0.25 0.00 1.40 2.76 -1.94 0.40 115.15 123.85 1y2m h HIS 345 Ca -0.47 0.04 0.00 0.00 -2.20 0.00 0.00 60.37 57.74 1y2m h HIS 345 Cb 1.19 -0.01 0.00 0.00 1.55 0.00 0.00 27.41 30.14 1y2m h HIS 345 CO 0.66 -0.06 0.00 -0.85 -1.30 0.00 0.00 177.93 176.38 1y2m n GLU 346 N -5.14 0.13 -0.04 5.26 0.00 -1.26 -2.09 120.64 117.49 1y2m n GLU 346 Ca 0.12 0.33 -0.19 0.00 0.00 0.00 0.00 57.16 57.42 1y2m n GLU 346 Cb 0.40 -1.73 -0.13 0.00 0.00 0.00 0.00 31.44 29.98 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 -1.96 0.71 -0.26 3.44 1.02 -0.27 -4.47 120.64 118.85 1y2m n GLU 347 Ca 0.03 0.22 -0.01 0.00 -0.02 0.00 0.00 57.16 57.38 1y2m n GLU 347 Cb 0.23 -1.65 0.11 0.00 -0.02 0.00 0.00 31.44 30.11 1y2m n GLU 347 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1y2m h GLU 348 N 0.04 0.78 -5.75 3.49 5.08 -0.43 -3.50 114.58 114.30 1y2m h GLU 348 Ca -0.46 -0.05 -0.34 0.00 -1.00 0.00 0.00 59.36 57.51 1y2m h GLU 348 Cb 2.00 -0.18 -0.04 0.00 0.50 0.00 0.00 28.75 31.04 1y2m h GLU 348 CO 0.03 0.52 0.91 0.14 -1.00 0.00 0.00 179.01 179.61 1y2m s VAL 349 N -6.09 3.34 -0.13 3.13 -7.23 -0.89 -5.11 120.40 107.43 1y2m s VAL 349 Ca -0.13 -0.13 0.00 0.00 -1.81 0.00 0.00 61.98 59.91 1y2m s VAL 349 Cb 0.17 -3.81 0.00 0.00 0.56 0.00 0.00 36.38 33.30 1y2m s VAL 349 CO 0.77 -0.77 0.00 -0.90 -0.31 0.00 0.00 175.10 173.89 1y2m n ASP 354 N 14.26 -1.05 0.00 4.85 5.68 -1.26 -5.10 116.55 133.93 1y2m n ASP 354 Ca 0.35 0.34 0.00 0.00 -0.50 0.00 0.00 54.79 54.98 1y2m n ASP 354 Cb 0.49 -1.12 0.00 0.00 -1.14 0.00 0.00 41.12 39.34 1y2m n ASP 354 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1y2m n GLU 355 N -2.11 -0.00 -2.76 0.11 1.02 -1.26 -5.06 120.64 110.58 1y2m n GLU 355 Ca -0.02 -0.13 -0.20 0.00 -0.02 0.00 0.00 57.16 56.79 1y2m n GLU 355 Cb 0.38 -0.52 0.01 0.00 -0.02 0.00 0.00 31.44 31.29 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 -0.00 -0.51 3.78 0.62 0.00 -1.26 -4.95 105.19 102.87 1y2m n GLY 356 Ca 0.00 0.06 -0.36 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.98 3.40 -0.32 -0.61 1.01 -1.26 -5.02 121.20 115.41 1y2m s ILE 357 Ca 0.16 1.01 -0.19 0.00 0.00 0.00 0.00 60.65 61.64 1y2m s ILE 357 Cb -0.08 -3.50 -0.01 0.00 0.01 0.00 0.00 42.46 38.89 1y2m s ILE 357 CO 0.20 -0.05 0.56 -0.22 0.00 0.00 0.00 174.94 175.43 1y2m s LEU 358 N -3.03 4.22 -0.15 2.97 2.96 -1.26 -4.90 118.68 119.49 1y2m s LEU 358 Ca 0.63 0.21 0.05 0.00 -0.22 0.00 0.00 54.13 54.81 1y2m s LEU 358 Cb -0.24 -2.69 -0.13 0.00 0.50 0.00 0.00 46.19 43.63 1y2m s LEU 358 CO 0.30 -0.46 -0.07 0.54 -1.32 0.00 0.00 176.35 175.34 1y2m n ARG 359 N 5.79 1.02 -2.14 1.98 1.74 -1.26 -5.01 116.66 118.79 1y2m n ARG 359 Ca -0.03 0.05 -0.32 0.00 -0.77 0.00 0.00 57.85 56.78 1y2m n ARG 359 Cb 0.49 -1.33 -0.01 0.00 -1.02 0.00 0.00 32.46 30.59 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 -2.32 3.66 0.55 5.56 -0.21 -1.26 -5.04 119.66 120.59 1y2m s GLN 360 Ca -0.16 0.96 -0.17 0.00 0.02 0.00 0.00 55.36 56.01 1y2m s GLN 360 Cb 0.05 -2.09 -0.06 0.00 1.00 0.00 0.00 33.01 31.91 1y2m s GLN 360 CO 0.44 -0.51 1.04 -0.51 -2.12 0.00 0.00 175.29 173.63 1y2m s ASP 361 N -3.31 6.07 0.94 5.90 1.01 -1.26 -5.06 116.67 120.96 1y2m s ASP 361 Ca 0.59 1.83 -0.15 0.00 0.71 0.00 0.00 52.55 55.53 1y2m s ASP 361 Cb -0.12 -2.54 0.18 0.00 1.01 0.00 0.00 42.92 41.45 1y2m s ASP 361 CO 0.39 -0.97 1.26 -0.13 0.21 0.00 0.00 175.17 175.94 1y2m s ARG 362 N -3.78 0.82 0.33 8.23 0.52 -1.26 -4.67 118.95 119.14 1y2m s ARG 362 Ca 0.64 -0.22 0.02 0.00 -0.52 0.00 0.00 55.73 55.66 1y2m s ARG 362 Cb -0.15 -1.85 0.57 0.00 0.52 0.00 0.00 34.95 34.04 1y2m s ARG 362 CO 0.30 -2.32 1.91 1.88 0.02 0.00 0.00 175.30 177.09 1y2m h TYR 363 N -1.58 0.69 -0.88 -0.53 -1.99 -1.97 -1.07 116.97 109.65 1y2m h TYR 363 Ca -0.45 -0.04 0.21 0.00 2.00 0.00 0.00 58.73 60.45 1y2m h TYR 363 Cb 1.27 -0.21 -0.06 0.00 2.00 0.00 0.00 36.73 39.73 1y2m h TYR 363 CO -0.81 0.57 0.60 -1.35 -0.00 0.00 0.00 178.16 177.16 1y2m h PRO 364 N 0.68 0.30 0.00 4.88 0.11 -1.93 0.22 132.00 136.26 1y2m h PRO 364 Ca 0.16 -0.02 -0.25 0.00 0.11 0.00 0.00 66.00 66.00 1y2m h PRO 364 Cb 0.19 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 31.19 1y2m h PRO 364 CO -0.01 0.20 -1.50 1.28 -0.21 0.00 0.00 178.00 177.76 1y2m n LEU 365 N -4.46 1.88 0.21 2.35 4.77 -1.06 -4.13 117.00 116.56 1y2m n LEU 365 Ca 0.19 0.42 0.07 0.00 -0.03 0.00 0.00 56.01 56.66 1y2m n LEU 365 Cb 0.74 -0.90 0.44 0.00 -2.33 0.00 0.00 43.42 41.37 1y2m n LEU 365 CO 0.32 0.23 0.76 -0.09 -1.33 0.00 0.00 177.39 177.28 1y2m h ARG 366 N -1.00 0.00 -0.44 3.23 2.43 -1.04 -2.66 114.38 114.89 1y2m h ARG 366 Ca -0.38 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.79 1y2m h ARG 366 Cb 1.27 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.82 1y2m h ARG 366 CO -0.23 0.30 0.00 0.25 -1.51 0.00 0.00 179.97 178.78 1y2m n THR 367 N -3.65 1.45 -0.32 0.20 -2.24 0.05 -4.72 114.28 105.06 1y2m n THR 367 Ca -0.01 -1.22 -0.00 0.00 -2.27 0.00 0.00 64.05 60.54 1y2m n THR 367 Cb 0.42 0.26 0.13 0.00 -2.10 0.00 0.00 70.33 69.04 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 2.70 0.89 0.06 3.42 4.64 -1.56 -0.22 113.55 123.48 1y2m h SER 368 Ca 0.00 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.23 1y2m h SER 368 Cb 1.07 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.96 1y2m h SER 368 CO 0.10 0.60 -0.29 -0.65 -0.87 0.00 0.00 176.83 175.72 1y2m h PRO 369 N 1.04 0.35 0.00 4.77 0.11 -1.84 0.15 132.00 136.58 1y2m h PRO 369 Ca 0.36 -0.13 -0.09 0.00 0.11 0.00 0.00 66.00 66.25 1y2m h PRO 369 Cb 0.08 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.16 1y2m h PRO 369 CO -0.14 0.61 -0.42 1.96 -0.21 0.00 0.00 178.00 179.80 1y2m h GLN 370 N 0.31 0.00 0.10 1.05 7.50 -1.77 0.56 115.11 122.85 1y2m h GLN 370 Ca 0.04 0.00 -0.20 0.00 0.50 0.00 0.00 58.65 58.99 1y2m h GLN 370 Cb 0.67 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.20 1y2m h GLN 370 CO 0.05 0.42 -1.00 2.35 -1.50 0.00 0.00 178.83 179.15 1y2m h TRP 371 N 0.00 0.38 0.06 2.96 2.91 -0.65 -3.39 115.95 118.22 1y2m h TRP 371 Ca -0.00 -0.28 -0.26 0.00 1.13 0.00 0.00 58.89 59.48 1y2m h TRP 371 Cb 0.91 -0.02 -0.02 0.00 -0.51 0.00 0.00 29.16 29.52 1y2m h TRP 371 CO 0.00 1.39 -1.26 -0.07 -1.03 0.00 0.00 178.44 177.47 1y2m h LEU 372 N -0.49 0.21 -0.59 0.65 3.38 -1.00 -3.37 115.31 114.10 1y2m h LEU 372 Ca -0.21 -0.25 0.10 0.00 0.09 0.00 0.00 57.88 57.61 1y2m h LEU 372 Cb 1.58 -0.07 -0.11 0.00 0.09 0.00 0.00 40.66 42.14 1y2m h LEU 372 CO 0.06 1.20 -0.33 1.23 0.09 0.00 0.00 178.44 180.69 1y2m h GLY 373 N 2.35 -0.11 1.00 0.83 0.00 -1.07 -0.71 103.07 105.36 1y2m h GLY 373 Ca -0.12 0.43 0.01 0.00 0.00 0.00 0.00 47.33 47.65 1y2m h GLY 373 CO 0.15 -0.21 0.50 -2.55 0.00 0.00 0.00 176.54 174.44 1y2m h PRO 374 N -0.16 0.99 0.00 4.80 0.11 -1.77 -1.27 132.00 134.70 1y2m h PRO 374 Ca 0.23 -0.06 -0.09 0.00 0.11 0.00 0.00 66.00 66.19 1y2m h PRO 374 Cb 0.55 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 31.42 1y2m h PRO 374 CO -0.68 0.65 -0.42 1.37 -0.21 0.00 0.00 178.00 178.72 1y2m h LEU 375 N 1.02 0.00 -0.46 2.35 8.10 -1.67 -2.37 115.31 122.28 1y2m h LEU 375 Ca 0.28 0.00 -0.07 0.00 0.11 0.00 0.00 57.88 58.20 1y2m h LEU 375 Cb -0.11 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 40.09 1y2m h LEU 375 CO -0.06 0.42 0.02 0.58 -4.11 0.00 0.00 178.44 175.29 1y2m h VAL 376 N 0.00 1.26 -0.98 0.15 2.07 -0.50 -0.96 116.25 117.28 1y2m h VAL 376 Ca -0.00 -1.01 0.07 0.00 0.82 0.00 0.00 66.70 66.57 1y2m h VAL 376 Cb 0.77 1.00 -0.07 0.00 -1.52 0.00 0.00 31.29 31.47 1y2m h VAL 376 CO 0.05 0.35 0.64 -1.28 0.02 0.00 0.00 177.57 177.35 1y2m h SER 377 N 0.66 1.00 -0.62 0.57 0.87 -0.88 -0.62 113.55 114.53 1y2m h SER 377 Ca 0.13 0.01 -0.00 0.00 -1.23 0.00 0.00 61.79 60.70 1y2m h SER 377 Cb 0.47 -0.20 -0.03 0.00 -0.44 0.00 0.00 62.40 62.20 1y2m h SER 377 CO 0.02 0.63 0.38 0.44 -0.53 0.00 0.00 176.83 177.77 1y2m h ASP 378 N 1.13 0.74 -0.72 6.23 3.32 -1.01 -0.38 116.42 125.73 1y2m h ASP 378 Ca 0.43 -0.05 -0.07 0.00 0.02 0.00 0.00 57.03 57.36 1y2m h ASP 378 Cb 0.21 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.54 1y2m h ASP 378 CO -0.18 0.58 0.19 -0.07 -1.72 0.00 0.00 179.24 178.04 1y2m h LEU 379 N 0.84 1.07 -0.64 1.55 3.38 -0.45 0.52 115.31 121.59 1y2m h LEU 379 Ca 0.22 -0.22 -0.09 0.00 0.09 0.00 0.00 57.88 57.89 1y2m h LEU 379 Cb -0.03 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.41 1y2m h LEU 379 CO -0.04 1.02 0.06 0.40 0.09 0.00 0.00 178.44 179.97 1y2m h ILE 380 N 1.08 1.26 -0.33 1.22 2.04 -0.89 -1.14 117.51 120.75 1y2m h ILE 380 Ca 0.23 -1.09 -0.01 0.00 1.00 0.00 0.00 64.86 64.99 1y2m h ILE 380 Cb 0.35 0.70 -0.02 0.00 -0.74 0.00 0.00 36.82 37.12 1y2m h ILE 380 CO -0.00 0.40 0.16 -0.74 0.00 0.00 0.00 178.15 177.98 1y2m h HIS 381 N 1.01 0.47 -0.98 1.37 2.76 -0.76 -2.19 115.15 116.82 1y2m h HIS 381 Ca 0.19 -0.02 0.05 0.00 -2.20 0.00 0.00 60.37 58.39 1y2m h HIS 381 Cb 0.49 -0.15 -0.06 0.00 1.55 0.00 0.00 27.41 29.24 1y2m h HIS 381 CO 0.04 0.41 0.64 0.00 -1.30 0.00 0.00 177.93 177.71 1y2m h ALA 382 N 1.02 1.40 -0.63 5.26 0.00 -0.76 -0.97 119.26 124.58 1y2m h ALA 382 Ca 0.11 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1y2m h ALA 382 Cb 0.11 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 1y2m h ALA 382 CO -0.02 0.48 0.41 1.25 0.00 0.00 0.00 179.25 181.37 1y2m h HIS 383 N 1.19 0.80 -0.63 0.00 6.17 -0.77 0.76 115.15 122.66 1y2m h HIS 383 Ca 0.41 0.01 -0.01 0.00 0.71 0.00 0.00 60.37 61.49 1y2m h HIS 383 Cb 0.10 -0.27 -0.03 0.00 2.52 0.00 0.00 27.41 29.73 1y2m h HIS 383 CO -0.00 0.51 0.34 0.00 0.71 0.00 0.00 177.93 179.49 1y2m h ALA 384 N 1.22 0.81 -0.12 5.26 0.00 -0.62 -0.06 119.26 125.76 1y2m h ALA 384 Ca 0.23 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1y2m h ALA 384 Cb -0.09 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.45 1y2m h ALA 384 CO -0.05 0.34 -0.02 0.28 0.00 0.00 0.00 179.25 179.80 1y2m h VAL 385 N 0.86 1.28 -0.14 0.00 2.07 -0.85 -2.81 116.25 116.66 1y2m h VAL 385 Ca 0.22 -0.90 -0.09 0.00 0.82 0.00 0.00 66.70 66.75 1y2m h VAL 385 Cb 0.06 1.64 -0.01 0.00 -1.52 0.00 0.00 31.29 31.46 1y2m h VAL 385 CO -0.03 0.26 -0.31 -0.07 0.02 0.00 0.00 177.57 177.44 1y2m h LEU 386 N -0.08 0.28 -0.67 2.57 3.38 -0.80 -1.11 115.31 118.87 1y2m h LEU 386 Ca 0.03 -0.10 0.01 0.00 0.09 0.00 0.00 57.88 57.91 1y2m h LEU 386 Cb 0.41 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 1y2m h LEU 386 CO 0.01 0.58 0.45 0.74 0.09 0.00 0.00 178.44 180.31 1y2m h THR 387 N 0.24 1.17 -0.29 0.22 2.02 -0.87 0.16 112.91 115.56 1y2m h THR 387 Ca 0.03 -0.31 -0.05 0.00 0.77 0.00 0.00 66.41 66.85 1y2m h THR 387 Cb 0.67 0.18 -0.01 0.00 -1.74 0.00 0.00 68.15 67.25 1y2m h THR 387 CO 0.05 0.17 -0.00 0.40 0.37 0.00 0.00 175.52 176.50 1y2m h ILE 388 N 0.91 1.26 -0.39 3.11 2.04 -1.23 -0.61 117.51 122.60 1y2m h ILE 388 Ca 0.25 -0.94 -0.03 0.00 1.00 0.00 0.00 64.86 65.14 1y2m h ILE 388 Cb -0.10 1.30 -0.02 0.00 -0.74 0.00 0.00 36.82 37.27 1y2m h ILE 388 CO -0.06 0.30 0.12 -0.08 0.00 0.00 0.00 178.15 178.43 1y2m h GLU 389 N 0.30 0.61 0.10 2.37 4.57 -0.77 -1.46 114.58 120.30 1y2m h GLU 389 Ca 0.08 -0.13 -0.27 0.00 -1.18 0.00 0.00 59.36 57.85 1y2m h GLU 389 Cb 0.44 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.93 1y2m h GLU 389 CO 0.02 0.62 -1.30 0.00 -1.18 0.00 0.00 179.01 177.16 1y2m h ALA 390 N 0.96 0.21 0.00 2.92 0.00 -0.74 -3.38 119.26 119.23 1y2m h ALA 390 Ca 0.12 -0.97 0.00 0.00 0.00 0.00 0.00 54.91 54.06 1y2m h ALA 390 Cb 0.27 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1y2m h ALA 390 CO -0.00 1.09 -0.95 0.41 0.00 0.00 0.00 179.25 179.79 1y2m n GLY 391 N 1.54 -0.26 0.96 0.00 0.00 -0.24 -4.75 105.19 102.45 1y2m n GLY 391 Ca -0.10 -0.30 0.01 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.54 0.00 -4.36 1.61 6.02 -0.56 -3.23 117.38 115.32 1y2m n GLN 392 Ca 0.00 -1.36 -0.19 0.00 -0.01 0.00 0.00 57.00 55.44 1y2m n GLN 392 Cb 0.23 -0.18 -0.14 0.00 1.02 0.00 0.00 30.24 31.17 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 -1.36 1.41 -0.24 1.08 0.01 -1.13 -4.92 113.70 108.54 1y2m s SER 393 Ca 0.15 -0.36 -0.08 0.00 1.31 0.00 0.00 55.95 56.97 1y2m s SER 393 Cb 0.17 -0.10 -0.04 0.00 0.21 0.00 0.00 66.02 66.26 1y2m s SER 393 CO -0.07 0.05 0.10 -0.89 0.41 0.00 0.00 173.24 172.83 1y2m s THR 394 N -0.66 4.68 0.00 1.44 2.01 -1.26 -4.48 115.64 117.38 1y2m s THR 394 Ca 0.01 -0.05 0.00 0.00 0.31 0.00 0.00 61.69 61.96 1y2m s THR 394 Cb -0.06 -3.18 0.00 0.00 0.01 0.00 0.00 72.50 69.26 1y2m s THR 394 CO 0.01 0.35 0.68 0.35 -0.69 0.00 0.00 174.62 175.31 1y2m n THR 395 N 4.62 0.39 -1.45 -0.82 -2.24 -1.26 -4.83 114.28 108.69 1y2m n THR 395 Ca -0.16 -0.67 0.00 0.00 -2.27 0.00 0.00 64.05 60.95 1y2m n THR 395 Cb 0.52 0.83 0.00 0.00 -2.10 0.00 0.00 70.33 69.58 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 -0.19 0.00 -3.60 3.42 5.75 -1.23 -2.48 116.55 118.22 1y2m n ASP 396 Ca 0.00 -0.88 -0.07 0.00 -0.01 0.00 0.00 54.79 53.83 1y2m n ASP 396 Cb 0.11 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.16 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 -0.24 0.96 -1.12 2.47 -1.26 -4.57 114.94 110.18 1y2m s ASN 397 Ca 0.00 0.22 -0.10 0.00 0.42 0.00 0.00 52.86 53.40 1y2m s ASN 397 Cb 0.00 0.20 0.17 0.00 -1.45 0.00 0.00 41.25 40.17 1y2m s ASN 397 CO 0.00 -0.24 1.12 -0.81 -3.72 0.00 0.00 177.10 173.45 1y2m n PRO 398 N 0.53 -0.74 -4.42 0.43 -0.04 -1.26 -4.68 135.00 124.82 1y2m n PRO 398 Ca -0.06 -0.15 -0.30 0.00 -0.04 0.00 0.00 63.50 62.95 1y2m n PRO 398 Cb 0.58 -2.34 -0.11 0.00 -0.04 0.00 0.00 33.50 31.59 1y2m n PRO 398 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1y2m s LEU 399 N -6.64 2.82 -0.21 1.53 1.43 -0.38 -4.86 118.68 112.36 1y2m s LEU 399 Ca 0.67 -0.42 -0.04 0.00 -1.03 0.00 0.00 54.13 53.31 1y2m s LEU 399 Cb -0.23 -1.65 -0.01 0.00 0.03 0.00 0.00 46.19 44.33 1y2m s LEU 399 CO 0.59 0.22 -0.03 -0.63 0.23 0.00 0.00 176.35 176.72 1y2m s ILE 400 N -1.07 3.55 -0.65 -0.59 1.09 0.11 -0.48 121.20 123.16 1y2m s ILE 400 Ca 0.18 -0.44 -0.16 0.00 -1.10 0.00 0.00 60.65 59.13 1y2m s ILE 400 Cb -0.11 -2.60 0.15 0.00 -1.06 0.00 0.00 42.46 38.84 1y2m s ILE 400 CO 0.09 0.43 0.63 -0.62 -0.10 0.00 0.00 174.94 175.37 1y2m s ASP 401 N 1.25 6.38 0.13 3.58 -1.08 0.10 -4.42 116.67 122.60 1y2m s ASP 401 Ca 0.03 -2.03 -0.13 0.00 -0.52 0.00 0.00 52.55 49.91 1y2m s ASP 401 Cb -0.14 -2.23 -0.05 0.00 -1.46 0.00 0.00 42.92 39.04 1y2m s ASP 401 CO -0.01 -0.81 1.47 0.58 0.52 0.00 0.00 175.17 176.92 1y2m h VAL 402 N 5.55 1.28 -0.63 1.11 2.07 -1.86 0.30 116.25 124.07 1y2m h VAL 402 Ca -0.16 -1.45 0.05 0.00 0.82 0.00 0.00 66.70 65.96 1y2m h VAL 402 Cb 1.08 1.39 -0.05 0.00 -1.52 0.00 0.00 31.29 32.19 1y2m h VAL 402 CO 0.96 0.48 0.35 -0.08 0.02 0.00 0.00 177.57 179.31 1y2m h GLU 403 N 0.64 0.65 -0.51 1.57 4.57 -1.95 -2.10 114.58 117.44 1y2m h GLU 403 Ca 0.07 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.21 1y2m h GLU 403 Cb 0.86 -0.15 0.00 0.00 -0.16 0.00 0.00 28.75 29.31 1y2m h GLU 403 CO 0.08 0.43 0.00 0.09 -1.18 0.00 0.00 179.01 178.42 1y2m n ASN 404 N -4.79 3.19 -3.79 1.04 3.02 -1.20 -4.98 115.26 107.74 1y2m n ASN 404 Ca 0.07 -1.97 -0.23 0.00 -0.03 0.00 0.00 54.58 52.42 1y2m n ASN 404 Cb 0.15 -0.34 0.02 0.00 -0.61 0.00 0.00 39.78 38.99 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 1.26 -4.49 -3.88 3.52 5.02 -0.02 -4.98 118.16 114.59 1y2m n LYS 405 Ca 0.20 0.56 -0.11 0.00 -2.02 0.00 0.00 58.31 56.93 1y2m n LYS 405 Cb 0.53 -5.02 -0.12 0.00 -0.02 0.00 0.00 35.03 30.39 1y2m n LYS 405 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1y2m s THR 406 N -3.72 0.04 0.10 -0.18 -4.23 -0.53 -5.02 115.64 102.10 1y2m s THR 406 Ca 0.07 -0.34 -0.01 0.00 -1.18 0.00 0.00 61.69 60.22 1y2m s THR 406 Cb -0.03 -0.22 -0.04 0.00 1.34 0.00 0.00 72.50 73.54 1y2m s THR 406 CO 0.84 -0.19 0.27 -0.44 -0.54 0.00 0.00 174.62 174.56 1y2m s SER 407 N -0.58 6.40 -0.02 3.99 0.01 -1.26 0.03 113.70 122.26 1y2m s SER 407 Ca -0.07 0.36 0.02 0.00 1.31 0.00 0.00 55.95 57.57 1y2m s SER 407 Cb -0.04 -2.00 0.01 0.00 0.21 0.00 0.00 66.02 64.20 1y2m s SER 407 CO 0.00 0.12 -0.05 -1.00 0.41 0.00 0.00 173.24 172.72 1y2m s HIS 408 N -1.58 0.64 -0.36 2.43 3.76 0.37 -4.96 115.29 115.58 1y2m s HIS 408 Ca 0.37 -0.14 -0.10 0.00 -0.15 0.00 0.00 55.06 55.03 1y2m s HIS 408 Cb -0.13 -0.51 0.02 0.00 1.11 0.00 0.00 32.58 33.08 1y2m s HIS 408 CO 0.27 -0.10 0.19 -1.01 -0.85 0.00 0.00 174.74 173.24 1y2m s HIS 409 N 0.40 3.23 0.00 1.40 3.76 -1.26 -1.25 115.29 121.57 1y2m s HIS 409 Ca -0.05 -0.87 0.00 0.00 -0.15 0.00 0.00 55.06 53.99 1y2m s HIS 409 Cb -0.09 -2.41 0.00 0.00 1.11 0.00 0.00 32.58 31.19 1y2m s HIS 409 CO -0.00 -0.60 0.00 0.41 -0.85 0.00 0.00 174.74 173.70 1y2m n GLY 410 N 4.99 5.59 1.73 -2.22 0.00 -1.26 -5.07 105.19 108.96 1y2m n GLY 410 Ca -0.12 -1.44 0.01 0.00 0.00 0.00 0.00 46.02 44.46 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 1.28 1.12 0.00 -0.02 0.00 -1.26 -4.91 105.19 101.40 1y2m n GLY 411 Ca 0.00 -0.66 0.09 0.00 0.00 0.00 0.00 46.02 45.44 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 0.04 0.00 -0.04 1.61 3.02 -1.26 -1.53 115.26 117.09 1y2m n ASN 412 Ca -0.03 -0.13 0.14 0.00 -0.03 0.00 0.00 54.58 54.53 1y2m n ASN 412 Cb 0.97 -0.20 0.60 0.00 -0.61 0.00 0.00 39.78 40.53 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 -1.20 0.00 -2.58 3.10 1.16 -1.03 -4.56 117.46 112.35 1y2m n PHE 413 Ca 0.10 0.00 -0.41 0.00 -1.87 0.00 0.00 57.45 55.26 1y2m n PHE 413 Cb 0.11 -0.30 -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 -2.70 3.24 -0.05 3.97 2.00 -0.58 -2.51 119.66 123.03 1y2m s GLN 414 Ca 0.23 -0.19 0.00 0.00 -2.00 0.00 0.00 55.36 53.40 1y2m s GLN 414 Cb 0.19 -4.15 0.05 0.00 0.80 0.00 0.00 33.01 29.90 1y2m s GLN 414 CO 0.52 -2.04 1.66 0.00 -0.50 0.00 0.00 175.29 174.92 1y2m n ALA 415 N 9.11 3.67 0.11 1.58 0.00 -1.12 -4.33 120.51 129.53 1y2m n ALA 415 Ca 0.04 -0.29 0.03 0.00 0.00 0.00 0.00 53.44 53.22 1y2m n ALA 415 Cb 0.49 -1.06 0.42 0.00 0.00 0.00 0.00 19.45 19.30 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 1.40 1.59 -0.94 0.00 0.00 -1.89 -1.17 119.26 118.25 1y2m h ALA 416 Ca 0.05 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.81 1y2m h ALA 416 Cb 1.05 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.71 1y2m h ALA 416 CO 0.12 0.30 0.57 0.00 0.00 0.00 0.00 179.25 180.25 1y2m h ALA 417 N 1.70 1.20 -0.03 0.00 0.00 -1.99 0.55 119.26 120.67 1y2m h ALA 417 Ca 0.06 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1y2m h ALA 417 Cb 0.26 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 1y2m h ALA 417 CO 0.01 0.65 -0.01 0.28 0.00 0.00 0.00 179.25 180.17 1y2m h VAL 418 N 1.29 1.31 -0.56 0.00 2.07 -1.73 -2.89 116.25 115.75 1y2m h VAL 418 Ca 0.34 -0.96 0.09 0.00 0.82 0.00 0.00 66.70 66.98 1y2m h VAL 418 Cb -0.06 1.90 -0.07 0.00 -1.52 0.00 0.00 31.29 31.53 1y2m h VAL 418 CO -0.06 0.26 0.19 0.00 0.02 0.00 0.00 177.57 177.97 1y2m h ALA 419 N 0.62 0.69 -0.57 1.67 0.00 -0.99 -2.06 119.26 118.63 1y2m h ALA 419 Ca 0.01 0.08 0.11 0.00 0.00 0.00 0.00 54.91 55.11 1y2m h ALA 419 Cb 0.42 0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.20 1y2m h ALA 419 CO 0.00 -0.22 0.09 -0.97 0.00 0.00 0.00 179.25 178.15 1y2m h ASN 420 N 0.36 -0.06 0.00 0.00 -0.73 -0.85 0.40 115.58 114.70 1y2m h ASN 420 Ca 0.28 0.11 0.00 0.00 1.87 0.00 0.00 56.30 58.56 1y2m h ASN 420 Cb 0.34 0.17 0.00 0.00 0.27 0.00 0.00 38.32 39.10 1y2m h ASN 420 CO -0.30 -0.01 0.00 0.35 -0.37 0.00 0.00 177.43 177.10 1y2m n THR 421 N -5.16 0.00 0.00 -3.57 -2.24 -0.78 -2.45 114.28 100.09 1y2m n THR 421 Ca 0.08 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.86 1y2m n THR 421 Cb 0.31 -0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.49 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 0.39 0.00 -0.12 -0.78 -0.58 0.13 -1.35 120.64 118.33 1y2m n GLU 423 Ca 0.00 0.00 -0.09 0.00 -0.42 0.00 0.00 57.16 56.65 1y2m n GLU 423 Cb 0.00 0.00 -0.01 0.00 -0.57 0.00 0.00 31.44 30.86 1y2m n GLU 423 CO 0.00 0.00 0.00 1.57 -0.48 0.00 0.00 177.13 178.22 1y2m h LYS 424 N 0.00 0.53 -0.67 3.49 2.10 -1.73 -2.50 116.57 117.78 1y2m h LYS 424 Ca 0.00 -0.07 0.02 0.00 -2.00 0.00 0.00 60.65 58.60 1y2m h LYS 424 Cb 0.00 -0.10 -0.04 0.00 -0.90 0.00 0.00 32.23 31.19 1y2m h LYS 424 CO 0.00 0.46 0.43 1.15 -2.00 0.00 0.00 179.45 179.49 1y2m h THR 425 N 0.46 1.12 -0.50 0.07 2.02 -1.47 0.04 112.91 114.64 1y2m h THR 425 Ca 0.13 -0.29 -0.09 0.00 0.77 0.00 0.00 66.41 66.93 1y2m h THR 425 Cb 0.11 0.19 -0.02 0.00 -1.74 0.00 0.00 68.15 66.69 1y2m h THR 425 CO -0.02 0.15 -0.04 -0.09 0.37 0.00 0.00 175.52 175.90 1y2m h ARG 426 N 0.85 0.87 -0.76 6.66 2.43 -1.77 0.13 114.38 122.79 1y2m h ARG 426 Ca 0.26 -0.27 -0.04 0.00 -0.81 0.00 0.00 59.98 59.12 1y2m h ARG 426 Cb -0.02 -0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 29.41 1y2m h ARG 426 CO -0.09 0.90 0.30 1.25 -1.51 0.00 0.00 179.97 180.82 1y2m h LEU 427 N 0.80 1.05 -1.04 3.80 5.85 -1.24 -2.67 115.31 121.87 1y2m h LEU 427 Ca 0.14 -0.17 -0.05 0.00 0.84 0.00 0.00 57.88 58.64 1y2m h LEU 427 Cb 0.54 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.27 1y2m h LEU 427 CO 0.03 0.94 0.15 1.23 -0.34 0.00 0.00 178.44 180.45 1y2m h GLY 428 N 1.10 0.90 1.38 3.75 0.00 -0.07 -1.50 103.07 108.64 1y2m h GLY 428 Ca 0.25 -0.51 -0.10 0.00 0.00 0.00 0.00 47.33 46.97 1y2m h GLY 428 CO -0.02 0.48 -0.17 1.41 0.00 0.00 0.00 176.54 178.23 1y2m h LEU 429 N 0.81 0.72 -0.85 3.11 3.38 -0.61 -0.00 115.31 121.88 1y2m h LEU 429 Ca 0.18 -0.23 -0.06 0.00 0.09 0.00 0.00 57.88 57.86 1y2m h LEU 429 Cb 0.28 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 1y2m h LEU 429 CO -0.00 0.90 0.18 0.00 0.09 0.00 0.00 178.44 179.61 1y2m h ALA 430 N 1.17 1.06 -0.38 1.53 0.00 -1.10 -0.08 119.26 121.46 1y2m h ALA 430 Ca 0.10 -0.23 -0.16 0.00 0.00 0.00 0.00 54.91 54.63 1y2m h ALA 430 Cb 0.65 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1y2m h ALA 430 CO 0.05 0.63 -0.38 1.96 0.00 0.00 0.00 179.25 181.51 1y2m h GLN 431 N 1.00 0.92 -0.29 0.00 1.08 -0.41 -0.28 115.11 117.13 1y2m h GLN 431 Ca 0.21 -0.49 0.00 0.00 -1.45 0.00 0.00 58.65 56.93 1y2m h GLN 431 Cb 0.32 0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 27.75 1y2m h GLN 431 CO -0.00 1.14 0.19 0.82 -0.95 0.00 0.00 178.83 180.03 1y2m h ILE 432 N 0.74 1.08 -0.46 2.54 2.04 -0.91 -2.08 117.51 120.46 1y2m h ILE 432 Ca 0.06 -0.15 -0.01 0.00 1.00 0.00 0.00 64.86 65.76 1y2m h ILE 432 Cb 0.97 0.66 -0.02 0.00 -0.74 0.00 0.00 36.82 37.69 1y2m h ILE 432 CO 0.09 0.08 0.26 1.23 0.00 0.00 0.00 178.15 179.81 1y2m h GLY 433 N 0.39 0.69 0.83 5.37 0.00 -0.80 -0.95 103.07 108.59 1y2m h GLY 433 Ca 0.11 -0.30 0.04 0.00 0.00 0.00 0.00 47.33 47.17 1y2m h GLY 433 CO -0.02 0.29 0.50 1.70 0.00 0.00 0.00 176.54 179.01 1y2m h LYS 434 N 0.61 0.94 0.61 4.80 1.63 -0.96 1.00 116.57 125.19 1y2m h LYS 434 Ca 0.16 -0.06 -0.03 0.00 -0.85 0.00 0.00 60.65 59.88 1y2m h LYS 434 Cb 0.03 -0.21 0.01 0.00 -0.60 0.00 0.00 32.23 31.46 1y2m h LYS 434 CO -0.03 0.62 -0.29 1.25 -3.45 0.00 0.00 179.45 177.55 1y2m h LEU 435 N 0.96 -0.69 -0.97 5.20 5.85 -0.59 -1.24 115.31 123.83 1y2m h LEU 435 Ca 0.33 0.02 -0.08 0.00 0.84 0.00 0.00 57.88 58.98 1y2m h LEU 435 Cb 0.06 0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 1y2m h LEU 435 CO -0.13 -0.48 -0.14 0.78 -0.34 0.00 0.00 178.44 178.13 1y2m h ASN 436 N -0.83 0.58 -0.49 1.25 4.21 -1.05 -1.46 115.58 117.79 1y2m h ASN 436 Ca -0.08 -0.16 0.01 0.00 1.21 0.00 0.00 56.30 57.27 1y2m h ASN 436 Cb 0.63 -0.15 -0.03 0.00 -1.12 0.00 0.00 38.32 37.65 1y2m h ASN 436 CO 0.14 0.74 0.31 0.15 -1.29 0.00 0.00 177.43 177.48 1y2m h PHE 437 N 0.54 0.58 -0.59 1.19 3.57 -0.68 0.21 116.94 121.76 1y2m h PHE 437 Ca 0.09 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.56 1y2m h PHE 437 Cb 0.55 -0.19 -0.03 0.00 2.79 0.00 0.00 35.95 39.07 1y2m h PHE 437 CO 0.02 0.35 0.18 1.79 -2.23 0.00 0.00 178.31 178.42 1y2m h THR 438 N 0.63 1.23 -0.18 4.41 1.35 -0.64 0.18 112.91 119.88 1y2m h THR 438 Ca 0.19 -0.79 -0.03 0.00 -0.55 0.00 0.00 66.41 65.23 1y2m h THR 438 Cb -0.04 0.58 -0.01 0.00 -1.73 0.00 0.00 68.15 66.96 1y2m h THR 438 CO -0.06 0.30 0.01 1.56 -0.25 0.00 0.00 175.52 177.08 1y2m h GLN 439 N 0.87 0.32 -0.18 4.72 4.20 -0.98 -2.27 115.11 121.79 1y2m h GLN 439 Ca 0.19 -0.10 -0.01 0.00 0.06 0.00 0.00 58.65 58.80 1y2m h GLN 439 Cb 0.26 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.00 1y2m h GLN 439 CO -0.01 0.51 0.07 1.25 -0.67 0.00 0.00 178.83 179.98 1y2m h LEU 440 N 0.08 0.25 -0.86 1.46 5.85 -0.53 -2.99 115.31 118.58 1y2m h LEU 440 Ca 0.05 -0.17 -0.11 0.00 0.84 0.00 0.00 57.88 58.49 1y2m h LEU 440 Cb 0.36 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 1y2m h LEU 440 CO 0.01 0.35 -0.51 0.00 -0.34 0.00 0.00 178.44 177.96 1y2m h THR 441 N 0.13 1.20 0.00 1.05 1.03 -0.66 -0.63 112.91 115.03 1y2m h THR 441 Ca 0.06 -1.83 0.00 0.00 -0.01 0.00 0.00 66.41 64.63 1y2m h THR 441 Cb 0.19 2.03 0.00 0.00 -1.07 0.00 0.00 68.15 69.30 1y2m h THR 441 CO -0.00 0.50 0.00 1.21 -0.01 0.00 0.00 175.52 177.21 1y2m n GLU 442 N -3.70 0.08 0.00 0.00 2.13 -0.86 -2.08 120.64 116.21 1y2m n GLU 442 Ca -0.01 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.81 1y2m n GLU 442 Cb 0.56 -1.23 0.00 0.00 0.27 0.00 0.00 31.44 31.04 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 0.69 0.00 -4.50 4.31 4.77 -0.24 -4.10 117.00 117.92 1y2m n LEU 444 Ca 0.00 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.56 1y2m n LEU 444 Cb 0.03 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.03 1y2m n LEU 444 CO 0.00 0.00 0.08 0.21 -1.33 0.00 0.00 177.39 176.35 1y2m s ASN 445 N 0.00 6.18 0.57 -1.43 3.84 -0.88 -4.40 114.94 118.82 1y2m s ASN 445 Ca 0.00 -0.57 0.26 0.00 0.21 0.00 0.00 52.86 52.76 1y2m s ASN 445 Cb 0.00 -2.21 1.59 0.00 -0.55 0.00 0.00 41.25 40.08 1y2m s ASN 445 CO 0.00 -0.50 2.15 0.00 -2.79 0.00 0.00 177.10 175.95 1y2m h ALA 446 N 8.65 1.84 0.00 1.71 0.00 -1.89 -2.06 119.26 127.51 1y2m h ALA 446 Ca -0.27 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1y2m h ALA 446 Cb 1.12 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1y2m h ALA 446 CO 0.76 -0.18 0.00 0.41 0.00 0.00 0.00 179.25 180.24 1y2m n GLY 447 N -1.44 1.08 2.40 0.00 0.00 -1.26 -4.63 105.19 101.35 1y2m n GLY 447 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.84 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 0.15 -5.17 -3.83 1.61 0.23 -0.78 -5.03 115.26 102.44 1y2m n ASN 449 Ca 0.00 0.15 -0.28 0.00 -0.53 0.00 0.00 54.58 53.91 1y2m n ASN 449 Cb 0.18 -4.24 0.04 0.00 -2.08 0.00 0.00 39.78 33.68 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 -2.63 -6.10 -0.65 -3.83 5.12 -1.26 -2.57 116.66 104.75 1y2m n ARG 450 Ca -0.20 0.66 0.00 0.00 -1.93 0.00 0.00 57.85 56.38 1y2m n ARG 450 Cb 0.63 -5.57 0.00 0.00 -1.16 0.00 0.00 32.46 26.36 1y2m n ARG 450 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1y2m n GLY 451 N -1.76 0.67 3.76 -0.13 0.00 -1.26 -4.98 105.19 101.50 1y2m n GLY 451 Ca 0.01 -0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 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 3.99 0.44 0.99 1.43 -1.06 -4.86 118.68 119.61 1y2m s LEU 452 Ca 0.00 2.60 -0.23 0.00 -1.03 0.00 0.00 54.13 55.46 1y2m s LEU 452 Cb 0.00 -4.17 -0.10 0.00 0.03 0.00 0.00 46.19 41.95 1y2m s LEU 452 CO 0.00 -1.19 0.95 -2.65 0.23 0.00 0.00 176.35 173.69 1y2m n PRO 453 N -0.58 1.21 -1.72 1.29 -0.02 -1.26 -4.86 135.00 129.06 1y2m n PRO 453 Ca 0.08 0.44 -0.43 0.00 -2.02 0.00 0.00 63.50 61.57 1y2m n PRO 453 Cb 0.46 -2.00 -0.02 0.00 -0.02 0.00 0.00 33.50 31.92 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 0.44 3.53 -0.87 2.55 3.41 -0.73 -1.16 113.62 120.79 1y2m n SER 454 Ca 0.10 1.14 -0.11 0.00 -0.26 0.00 0.00 58.87 59.74 1y2m n SER 454 Cb 0.40 -1.54 -0.05 0.00 -0.26 0.00 0.00 64.21 62.76 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 -1.29 -1.95 -4.75 0.00 4.77 -0.31 -0.61 117.00 112.85 1y2m n LEU 456 Ca -0.11 -0.19 -0.41 0.00 -0.03 0.00 0.00 56.01 55.26 1y2m n LEU 456 Cb 0.59 -2.55 -0.03 0.00 -2.33 0.00 0.00 43.42 39.10 1y2m n LEU 456 CO 0.17 0.09 0.98 0.00 -1.33 0.00 0.00 177.39 177.30 1y2m s ALA 457 N -2.98 3.52 -0.09 -1.18 0.00 -0.57 -4.79 121.76 115.67 1y2m s ALA 457 Ca 0.24 1.15 0.15 0.00 0.00 0.00 0.00 51.96 53.49 1y2m s ALA 457 Cb -0.12 -3.48 0.11 0.00 0.00 0.00 0.00 23.12 19.64 1y2m s ALA 457 CO 0.30 -0.55 1.46 0.00 0.00 0.00 0.00 175.76 176.97 1y2m h ALA 458 N 4.74 0.68 -3.35 0.00 0.00 -1.77 -3.44 119.26 116.11 1y2m h ALA 458 Ca -0.46 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 53.96 1y2m h ALA 458 Cb 1.22 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1y2m h ALA 458 CO 0.74 0.67 0.00 0.39 0.00 0.00 0.00 179.25 181.05 1y2m n GLU 459 N -3.27 2.11 -1.68 0.00 -0.58 -1.26 -5.06 120.64 110.90 1y2m n GLU 459 Ca 0.02 0.00 -0.45 0.00 -0.42 0.00 0.00 57.16 56.30 1y2m n GLU 459 Cb 0.73 0.00 -0.04 0.00 -0.57 0.00 0.00 31.44 31.56 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 -0.79 3.62 0.20 1.62 8.00 -1.26 -4.85 116.55 123.09 1y2m n ASP 460 Ca 0.00 1.00 0.15 0.00 0.71 0.00 0.00 54.79 56.65 1y2m n ASP 460 Cb 0.00 -1.46 0.62 0.00 -0.02 0.00 0.00 41.12 40.27 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 8.18 0.00 -0.12 -0.24 0.11 -1.83 -2.98 132.00 135.11 1y2m h PRO 461 Ca -0.47 0.00 0.04 0.00 0.11 0.00 0.00 66.00 65.68 1y2m h PRO 461 Cb 1.25 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 0.15 0.66 -0.21 0.00 0.00 178.00 179.53 1y2m h SER 462 N 0.00 0.00 0.00 -2.05 4.64 -1.88 -2.70 113.55 111.56 1y2m h SER 462 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 1y2m h SER 462 Cb 0.36 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.40 1y2m h SER 462 CO 0.00 0.00 -0.35 0.18 -0.87 0.00 0.00 176.83 175.79 1y2m n LEU 463 N -3.77 1.91 -3.55 5.97 4.77 -1.13 -4.98 117.00 116.21 1y2m n LEU 463 Ca 0.00 -2.86 -0.08 0.00 -0.03 0.00 0.00 56.01 53.04 1y2m n LEU 463 Cb 0.25 -0.34 -0.09 0.00 -2.33 0.00 0.00 43.42 40.92 1y2m n LEU 463 CO 0.27 0.82 0.01 -0.55 -1.33 0.00 0.00 177.39 176.60 1y2m s SER 464 N -2.57 -0.16 -0.24 -1.43 0.15 -1.02 -4.58 113.70 103.85 1y2m s SER 464 Ca 0.29 0.78 0.10 0.00 0.70 0.00 0.00 55.95 57.81 1y2m s SER 464 Cb 0.27 1.32 0.45 0.00 -1.71 0.00 0.00 66.02 66.35 1y2m s SER 464 CO -0.03 -0.25 1.29 -1.22 1.20 0.00 0.00 173.24 174.23 1y2m n TYR 465 N 5.39 0.56 0.00 3.44 4.01 -1.26 -4.57 117.16 124.73 1y2m n TYR 465 Ca -0.07 -1.61 0.00 0.00 -0.16 0.00 0.00 57.90 56.06 1y2m n TYR 465 Cb 0.50 -0.34 0.00 0.00 -0.31 0.00 0.00 39.34 39.19 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 -1.09 0.00 0.59 -0.72 -0.00 -1.26 -0.67 115.22 112.08 1y2m n HIS 466 Ca 0.26 0.00 0.06 0.00 0.46 0.00 0.00 57.72 58.49 1y2m n HIS 466 Cb 0.81 0.00 0.18 0.00 -0.12 0.00 0.00 29.99 30.86 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 2.28 1.00 -0.58 0.00 3.64 -1.11 -0.92 116.57 120.88 1y2m h LYS 468 Ca 0.00 -0.10 -0.06 0.00 -1.27 0.00 0.00 60.65 59.22 1y2m h LYS 468 Cb 0.68 -0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 32.27 1y2m h LYS 468 CO 0.05 0.72 0.12 0.78 -2.27 0.00 0.00 179.45 178.86 1y2m h GLY 469 N 1.00 0.98 1.81 5.01 0.00 -1.77 -2.66 103.07 107.44 1y2m h GLY 469 Ca 0.26 -0.60 -0.10 0.00 0.00 0.00 0.00 47.33 46.89 1y2m h GLY 469 CO -0.05 0.56 -0.41 1.41 0.00 0.00 0.00 176.54 178.05 1y2m h LEU 470 N 0.87 0.22 -0.37 3.11 3.38 -1.74 0.76 115.31 121.55 1y2m h LEU 470 Ca 0.19 -0.09 0.02 0.00 0.09 0.00 0.00 57.88 58.08 1y2m h LEU 470 Cb 0.34 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 1y2m h LEU 470 CO 0.00 0.61 0.21 -0.78 0.09 0.00 0.00 178.44 178.58 1y2m h ASP 471 N 0.18 0.34 -0.13 -0.43 3.58 -0.86 0.39 116.42 119.49 1y2m h ASP 471 Ca 0.02 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.47 1y2m h ASP 471 Cb 0.80 -0.07 -0.01 0.00 1.72 0.00 0.00 39.33 41.78 1y2m h ASP 471 CO 0.06 0.25 0.07 0.40 -2.88 0.00 0.00 179.24 177.14 1y2m h ILE 472 N 0.43 1.11 -0.83 2.25 2.04 -1.18 -2.43 117.51 118.90 1y2m h ILE 472 Ca 0.15 -0.32 0.05 0.00 1.00 0.00 0.00 64.86 65.74 1y2m h ILE 472 Cb 0.01 1.08 -0.06 0.00 -0.74 0.00 0.00 36.82 37.12 1y2m h ILE 472 CO -0.07 0.10 0.52 0.00 0.00 0.00 0.00 178.15 178.70 1y2m h ALA 473 N 0.95 1.13 -0.95 1.87 0.00 -0.62 -1.19 119.26 120.44 1y2m h ALA 473 Ca 0.05 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1y2m h ALA 473 Cb 0.10 -0.24 -0.05 0.00 0.00 0.00 0.00 17.79 17.61 1y2m h ALA 473 CO -0.01 0.28 0.58 0.00 0.00 0.00 0.00 179.25 180.11 1y2m h ALA 474 N 1.38 1.21 -0.30 0.00 0.00 -0.74 0.63 119.26 121.45 1y2m h ALA 474 Ca 0.36 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1y2m h ALA 474 Cb 0.13 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 1y2m h ALA 474 CO -0.16 0.65 0.20 0.00 0.00 0.00 0.00 179.25 179.94 1y2m h ALA 475 N 1.32 0.38 -0.55 0.00 0.00 -0.86 -1.69 119.26 117.87 1y2m h ALA 475 Ca 0.34 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.24 1y2m h ALA 475 Cb -0.08 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 1y2m h ALA 475 CO -0.07 -0.16 0.36 0.00 0.00 0.00 0.00 179.25 179.38 1y2m h ALA 476 N 1.11 0.70 -0.51 0.00 0.00 -0.43 0.24 119.26 120.37 1y2m h ALA 476 Ca 0.11 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 1y2m h ALA 476 Cb -0.04 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1y2m h ALA 476 CO -0.03 0.11 0.25 1.88 0.00 0.00 0.00 179.25 181.47 1y2m h TYR 477 N 0.72 0.72 -0.37 0.00 0.05 -0.76 -1.85 116.97 115.50 1y2m h TYR 477 Ca 0.21 -0.03 -0.01 0.00 0.05 0.00 0.00 58.73 58.94 1y2m h TYR 477 Cb -0.06 -0.23 -0.02 0.00 1.01 0.00 0.00 36.73 37.44 1y2m h TYR 477 CO -0.04 0.56 0.17 1.15 -1.05 0.00 0.00 178.16 178.95 1y2m h THR 478 N 0.68 1.17 -0.35 -2.88 2.02 -0.78 -1.20 112.91 111.57 1y2m h THR 478 Ca 0.18 -0.49 0.05 0.00 0.77 0.00 0.00 66.41 66.92 1y2m h THR 478 Cb 0.10 0.82 -0.05 0.00 -1.74 0.00 0.00 68.15 67.28 1y2m h THR 478 CO -0.02 0.18 0.08 0.28 0.37 0.00 0.00 175.52 176.40 1y2m h SER 479 N 0.45 0.03 -0.68 4.18 0.02 -0.82 -1.99 113.55 114.74 1y2m h SER 479 Ca 0.13 0.06 0.07 0.00 -0.84 0.00 0.00 61.79 61.20 1y2m h SER 479 Cb 0.13 0.07 -0.06 0.00 0.14 0.00 0.00 62.40 62.68 1y2m h SER 479 CO -0.02 0.05 0.36 -0.08 -1.14 0.00 0.00 176.83 176.00 1y2m h GLU 480 N 0.20 0.62 -0.95 3.45 4.81 -1.04 -2.13 114.58 119.53 1y2m h GLU 480 Ca 0.16 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.37 1y2m h GLU 480 Cb 0.18 -0.14 -0.05 0.00 0.63 0.00 0.00 28.75 29.37 1y2m h GLU 480 CO -0.21 0.41 0.63 -0.07 -0.73 0.00 0.00 179.01 179.04 1y2m h LEU 481 N 0.64 1.08 -0.19 1.64 3.38 -0.80 -1.55 115.31 119.51 1y2m h LEU 481 Ca 0.32 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.26 1y2m h LEU 481 Cb 0.27 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1y2m h LEU 481 CO -0.22 0.77 0.11 1.23 0.09 0.00 0.00 178.44 180.41 1y2m h GLY 482 N 1.27 0.28 1.03 0.83 0.00 -0.71 -2.30 103.07 103.47 1y2m h GLY 482 Ca 0.35 -0.12 -0.07 0.00 0.00 0.00 0.00 47.33 47.49 1y2m h GLY 482 CO -0.08 0.12 0.11 0.84 0.00 0.00 0.00 176.54 177.53 1y2m h HIS 483 N 0.21 1.04 -0.43 5.60 -0.00 -1.34 -2.59 115.15 117.63 1y2m h HIS 483 Ca 0.07 -0.14 0.05 0.00 -0.00 0.00 0.00 60.37 60.35 1y2m h HIS 483 Cb 0.06 -0.29 -0.02 0.00 -0.00 0.00 0.00 27.41 27.15 1y2m h HIS 483 CO -0.04 0.89 0.29 -0.07 -0.00 0.00 0.00 177.93 179.00 1y2m h LEU 484 N 0.89 0.32 0.00 0.26 3.38 -1.07 -3.02 115.31 116.06 1y2m h LEU 484 Ca 0.18 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1y2m h LEU 484 Cb 0.40 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1y2m h LEU 484 CO 0.01 0.21 0.00 0.00 0.09 0.00 0.00 178.44 178.75 1y2m n ALA 485 N -2.52 2.07 -1.76 1.53 0.00 -0.88 -4.78 120.51 114.17 1y2m n ALA 485 Ca 0.05 -0.09 -0.38 0.00 0.00 0.00 0.00 53.44 53.02 1y2m n ALA 485 Cb 0.23 -1.34 0.02 0.00 0.00 0.00 0.00 19.45 18.37 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 -2.61 5.59 0.37 0.00 0.01 -1.14 -4.52 114.94 112.64 1y2m s ASN 486 Ca 0.19 2.59 -0.27 0.00 -0.71 0.00 0.00 52.86 54.65 1y2m s ASN 486 Cb 0.14 -2.62 -0.09 0.00 0.41 0.00 0.00 41.25 39.08 1y2m s ASN 486 CO 0.32 -1.34 1.30 -2.16 -1.51 0.00 0.00 177.10 173.71 1y2m s PRO 487 N -2.84 4.16 0.04 -0.60 0.04 -1.26 -4.94 135.00 129.60 1y2m s PRO 487 Ca 0.69 2.17 0.05 0.00 0.04 0.00 0.00 61.00 63.94 1y2m s PRO 487 Cb -0.36 -2.90 -0.24 0.00 0.04 0.00 0.00 34.50 31.04 1y2m s PRO 487 CO 0.43 -0.34 1.00 0.28 0.04 0.00 0.00 177.00 178.41 1y2m h VAL 488 N 2.73 1.33 0.00 -0.36 2.07 -1.93 -3.39 116.25 116.70 1y2m h VAL 488 Ca -0.49 -3.05 0.00 0.00 0.82 0.00 0.00 66.70 63.98 1y2m h VAL 488 Cb 1.24 2.73 0.00 0.00 -1.52 0.00 0.00 31.29 33.73 1y2m h VAL 488 CO 0.64 0.81 0.00 0.35 0.02 0.00 0.00 177.57 179.39 1y2m n THR 489 N -3.32 0.97 1.32 2.57 -2.24 -1.26 -1.34 114.28 110.98 1y2m n THR 489 Ca -0.09 0.25 0.06 0.00 -2.27 0.00 0.00 64.05 62.00 1y2m n THR 489 Cb 1.00 -1.04 0.24 0.00 -2.10 0.00 0.00 70.33 68.43 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 -1.67 0.25 -1.33 4.28 -2.24 -1.26 -4.10 114.28 108.22 1y2m n THR 490 Ca 0.03 -0.29 -0.01 0.00 -2.27 0.00 0.00 64.05 61.51 1y2m n THR 490 Cb 0.18 0.16 0.21 0.00 -2.10 0.00 0.00 70.33 68.79 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 0.12 1.00 -1.94 4.78 8.25 -0.45 -5.02 115.22 121.96 1y2m n HIS 491 Ca 0.11 -1.40 -0.42 0.00 -0.26 0.00 0.00 57.72 55.75 1y2m n HIS 491 Cb 0.22 -0.43 -0.03 0.00 1.12 0.00 0.00 29.99 30.87 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 -3.13 2.62 0.16 1.59 1.01 -1.26 -5.02 120.40 116.38 1y2m s VAL 492 Ca 0.43 0.46 0.06 0.00 0.00 0.00 0.00 61.98 62.93 1y2m s VAL 492 Cb 0.39 -3.29 -0.04 0.00 0.00 0.00 0.00 36.38 33.43 1y2m s VAL 492 CO 0.02 0.04 0.07 -1.10 0.00 0.00 0.00 175.10 174.13 1y2m s GLN 493 N 0.88 2.68 -1.15 2.72 -1.52 -1.26 -5.04 119.66 116.97 1y2m s GLN 493 Ca 0.68 -0.96 -0.18 0.00 -1.95 0.00 0.00 55.36 52.94 1y2m s GLN 493 Cb -0.43 -2.52 -0.05 0.00 -0.22 0.00 0.00 33.01 29.79 1y2m s GLN 493 CO 0.33 0.48 2.03 -0.35 -0.25 0.00 0.00 175.29 177.53 1y2m n PRO 494 N -0.20 2.25 -2.47 2.91 -0.04 -1.26 -4.72 135.00 131.48 1y2m n PRO 494 Ca -0.09 -2.37 -0.36 0.00 -0.04 0.00 0.00 63.50 60.64 1y2m n PRO 494 Cb 0.55 -3.21 -0.03 0.00 -0.04 0.00 0.00 33.50 30.77 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 4.72 2.97 0.00 0.55 0.00 -1.18 -3.22 121.76 125.60 1y2m s ALA 495 Ca 0.54 0.73 0.00 0.00 0.00 0.00 0.00 51.96 53.22 1y2m s ALA 495 Cb 0.12 -3.29 0.00 0.00 0.00 0.00 0.00 23.12 19.94 1y2m s ALA 495 CO 0.03 -0.36 0.00 -1.91 0.00 0.00 0.00 175.76 173.52 1y2m n GLU 496 N -0.50 0.00 0.00 0.00 2.13 -1.26 -1.24 120.64 119.77 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 0.50 -3.81 0.00 0.00 0.27 0.00 0.00 31.44 28.40 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 0.97 0.00 -0.16 4.31 0.00 -1.20 -4.07 120.51 120.36 1y2m n ALA 498 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 1y2m n ALA 498 Cb 0.00 0.00 0.21 0.00 0.00 0.00 0.00 19.45 19.66 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 0.00 0.80 -1.51 0.00 -1.24 -1.86 -2.75 115.58 109.02 1y2m h ASN 499 Ca 0.00 -0.10 -0.71 0.00 0.71 0.00 0.00 56.30 56.20 1y2m h ASN 499 Cb 0.00 -0.21 -0.30 0.00 0.73 0.00 0.00 38.32 38.54 1y2m h ASN 499 CO 0.00 0.72 0.71 0.00 -1.29 0.00 0.00 177.43 177.57 1y2m n GLN 500 N -4.32 2.85 0.26 6.67 6.02 -0.38 -4.76 117.38 123.72 1y2m n GLN 500 Ca 0.05 -3.57 0.12 0.00 -0.01 0.00 0.00 57.00 53.59 1y2m n GLN 500 Cb 0.17 -2.28 0.69 0.00 1.02 0.00 0.00 30.24 29.84 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 2.55 1.30 -3.50 -1.58 0.00 -1.62 -3.12 119.26 113.29 1y2m h ALA 501 Ca 0.55 -0.12 -0.66 0.00 0.00 0.00 0.00 54.91 54.67 1y2m h ALA 501 Cb 0.49 -0.02 -0.25 0.00 0.00 0.00 0.00 17.79 18.01 1y2m h ALA 501 CO 1.40 0.17 -0.75 0.14 0.00 0.00 0.00 179.25 180.21 1y2m s VAL 502 N -4.20 3.20 -0.09 0.00 -7.23 -1.26 -4.51 120.40 106.31 1y2m s VAL 502 Ca -0.03 -0.63 -0.13 0.00 -1.81 0.00 0.00 61.98 59.38 1y2m s VAL 502 Cb 0.13 -2.33 0.03 0.00 0.56 0.00 0.00 36.38 34.77 1y2m s VAL 502 CO 0.60 0.54 0.34 0.54 -0.31 0.00 0.00 175.10 176.81 1y2m s ASN 503 N 0.02 -0.31 0.19 4.85 2.20 -1.26 -4.98 114.94 115.66 1y2m s ASN 503 Ca -0.03 0.50 0.11 0.00 -0.94 0.00 0.00 52.86 52.49 1y2m s ASN 503 Cb -0.14 0.58 -0.08 0.00 -2.00 0.00 0.00 41.25 39.61 1y2m s ASN 503 CO 0.04 -0.24 1.35 0.77 -2.94 0.00 0.00 177.10 176.08 1y2m h SER 504 N 4.95 0.00 -2.64 3.54 4.64 -1.61 -3.46 113.55 118.96 1y2m h SER 504 Ca -0.28 0.00 -0.40 0.00 -0.47 0.00 0.00 61.79 60.65 1y2m h SER 504 Cb 1.18 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.22 1y2m h SER 504 CO 0.32 0.76 -0.48 0.18 -0.87 0.00 0.00 176.83 176.75 1y2m n LEU 505 N -3.28 -1.75 -0.27 5.97 4.77 -0.07 -4.79 117.00 117.57 1y2m n LEU 505 Ca 0.01 0.12 -0.04 0.00 -0.03 0.00 0.00 56.01 56.07 1y2m n LEU 505 Cb 0.84 -2.82 0.08 0.00 -2.33 0.00 0.00 43.42 39.18 1y2m n LEU 505 CO 0.44 -0.40 1.18 0.00 -1.33 0.00 0.00 177.39 177.28 1y2m h ALA 506 N 0.80 0.97 -0.48 -1.18 0.00 -1.82 -1.36 119.26 116.19 1y2m h ALA 506 Ca -0.46 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.31 1y2m h ALA 506 Cb 1.34 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 1y2m h ALA 506 CO 0.56 0.34 -0.09 1.25 0.00 0.00 0.00 179.25 181.31 1y2m h LEU 507 N 0.99 0.91 -0.53 0.00 5.85 -1.90 0.99 115.31 121.62 1y2m h LEU 507 Ca 0.29 -0.35 -0.00 0.00 0.84 0.00 0.00 57.88 58.66 1y2m h LEU 507 Cb -0.06 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 40.69 1y2m h LEU 507 CO -0.08 1.04 0.33 0.40 -0.34 0.00 0.00 178.44 179.79 1y2m h ILE 508 N 0.75 1.15 -0.25 4.05 2.04 -1.79 0.33 117.51 123.80 1y2m h ILE 508 Ca 0.12 -0.33 0.01 0.00 1.00 0.00 0.00 64.86 65.67 1y2m h ILE 508 Cb 0.63 0.42 -0.02 0.00 -0.74 0.00 0.00 36.82 37.12 1y2m h ILE 508 CO 0.04 0.15 0.14 -1.28 0.00 0.00 0.00 178.15 177.21 1y2m h SER 509 N 0.71 0.23 -0.82 1.72 0.87 -0.98 -1.69 113.55 113.58 1y2m h SER 509 Ca 0.19 0.00 0.08 0.00 -1.23 0.00 0.00 61.79 60.84 1y2m h SER 509 Cb -0.03 -0.04 -0.07 0.00 -0.44 0.00 0.00 62.40 61.82 1y2m h SER 509 CO -0.04 0.17 0.48 0.00 -0.53 0.00 0.00 176.83 176.91 1y2m h ALA 510 N 1.12 1.16 -0.71 6.23 0.00 -0.44 -0.18 119.26 126.44 1y2m h ALA 510 Ca 0.10 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.04 1y2m h ALA 510 Cb 0.00 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.59 1y2m h ALA 510 CO -0.05 0.15 0.46 0.00 0.00 0.00 0.00 179.25 179.81 1y2m h ARG 511 N 0.84 0.91 -0.67 0.00 3.08 -0.54 -0.18 114.38 117.82 1y2m h ARG 511 Ca 0.38 -0.05 -0.06 0.00 0.07 0.00 0.00 59.98 60.32 1y2m h ARG 511 Cb 0.29 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 30.11 1y2m h ARG 511 CO -0.22 0.60 0.18 0.00 -1.07 0.00 0.00 179.97 179.46 1y2m h ARG 512 N 0.94 1.06 -0.25 0.04 2.47 -0.60 -1.69 114.38 116.33 1y2m h ARG 512 Ca 0.26 -0.25 -0.11 0.00 -1.26 0.00 0.00 59.98 58.63 1y2m h ARG 512 Cb -0.08 -0.14 -0.01 0.00 -1.65 0.00 0.00 29.97 28.08 1y2m h ARG 512 CO -0.07 0.94 -0.30 1.15 0.56 0.00 0.00 179.97 182.25 1y2m h THR 513 N 0.99 1.28 -0.61 2.04 2.02 -0.74 -0.30 112.91 117.58 1y2m h THR 513 Ca 0.21 -1.38 -0.01 0.00 0.77 0.00 0.00 66.41 66.00 1y2m h THR 513 Cb 0.35 1.41 -0.03 0.00 -1.74 0.00 0.00 68.15 68.14 1y2m h THR 513 CO -0.00 0.44 0.34 0.74 0.37 0.00 0.00 175.52 177.41 1y2m h THR 514 N 0.45 1.19 -0.75 3.16 2.02 -0.68 0.24 112.91 118.54 1y2m h THR 514 Ca 0.06 -0.48 -0.04 0.00 0.77 0.00 0.00 66.41 66.72 1y2m h THR 514 Cb 0.75 0.40 -0.03 0.00 -1.74 0.00 0.00 68.15 67.53 1y2m h THR 514 CO 0.06 0.21 0.32 -0.08 0.37 0.00 0.00 175.52 176.40 1y2m h GLU 515 N 0.83 1.11 -0.89 6.66 4.81 -0.76 -2.11 114.58 124.23 1y2m h GLU 515 Ca 0.22 -0.19 0.01 0.00 -0.13 0.00 0.00 59.36 59.26 1y2m h GLU 515 Cb 0.03 -0.19 -0.04 0.00 0.63 0.00 0.00 28.75 29.18 1y2m h GLU 515 CO -0.04 0.89 0.58 0.77 -0.73 0.00 0.00 179.01 180.49 1y2m h SER 516 N 1.07 1.02 -0.59 1.04 0.02 -0.61 0.67 113.55 116.18 1y2m h SER 516 Ca 0.25 -0.03 0.02 0.00 -0.84 0.00 0.00 61.79 61.20 1y2m h SER 516 Cb 0.18 -0.26 -0.04 0.00 0.14 0.00 0.00 62.40 62.43 1y2m h SER 516 CO -0.02 0.75 0.36 0.78 -1.14 0.00 0.00 176.83 177.55 1y2m h ASN 517 N 1.20 0.59 -0.19 3.07 2.35 -0.61 0.95 115.58 122.95 1y2m h ASN 517 Ca 0.32 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 56.06 1y2m h ASN 517 Cb -0.13 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.11 1y2m h ASN 517 CO -0.07 0.42 0.07 -0.78 -1.65 0.00 0.00 177.43 175.42 1y2m h ASP 518 N 0.72 0.27 -0.55 5.81 3.58 -0.65 -0.37 116.42 125.22 1y2m h ASP 518 Ca 0.24 -0.18 -0.04 0.00 0.42 0.00 0.00 57.03 57.47 1y2m h ASP 518 Cb 0.01 -0.07 -0.02 0.00 1.72 0.00 0.00 39.33 40.97 1y2m h ASP 518 CO -0.10 0.37 0.20 0.58 -2.88 0.00 0.00 179.24 177.42 1y2m h VAL 519 N 0.15 1.23 -0.18 2.25 2.07 -0.64 -1.77 116.25 119.36 1y2m h VAL 519 Ca 0.06 -0.73 -0.06 0.00 0.82 0.00 0.00 66.70 66.79 1y2m h VAL 519 Cb 0.19 0.67 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 1y2m h VAL 519 CO -0.00 0.28 -0.15 0.25 0.02 0.00 0.00 177.57 177.97 1y2m h LEU 520 N 0.76 0.28 -0.83 2.57 5.85 -0.72 -1.29 115.31 121.92 1y2m h LEU 520 Ca 0.18 -0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.84 1y2m h LEU 520 Cb 0.23 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.15 1y2m h LEU 520 CO -0.01 0.45 0.54 0.28 -0.34 0.00 0.00 178.44 179.36 1y2m h SER 521 N 0.27 0.96 -0.64 1.25 0.02 -0.56 0.31 113.55 115.16 1y2m h SER 521 Ca 0.05 -0.03 -0.04 0.00 -0.84 0.00 0.00 61.79 60.93 1y2m h SER 521 Cb 0.43 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.70 1y2m h SER 521 CO 0.03 0.71 0.24 -0.07 -1.14 0.00 0.00 176.83 176.59 1y2m h LEU 522 N 1.13 0.90 -0.18 5.07 3.38 -0.47 -0.45 115.31 124.68 1y2m h LEU 522 Ca 0.30 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 1y2m h LEU 522 Cb -0.11 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.40 1y2m h LEU 522 CO -0.06 0.84 -0.01 0.25 0.09 0.00 0.00 178.44 179.55 1y2m h LEU 523 N 0.90 0.33 -1.03 1.67 5.85 -0.69 -2.01 115.31 120.33 1y2m h LEU 523 Ca 0.21 -0.32 -0.10 0.00 0.84 0.00 0.00 57.88 58.51 1y2m h LEU 523 Cb 0.24 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 1y2m h LEU 523 CO -0.01 0.57 -0.38 -0.07 -0.34 0.00 0.00 178.44 178.20 1y2m h LEU 524 N 0.07 0.20 -0.55 2.25 3.38 -0.36 0.02 115.31 120.33 1y2m h LEU 524 Ca 0.05 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 1y2m h LEU 524 Cb 0.41 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 1y2m h LEU 524 CO 0.01 0.57 0.26 0.00 0.09 0.00 0.00 178.44 179.38 1y2m h ALA 525 N 1.44 0.71 -0.24 1.53 0.00 -1.00 0.30 119.26 121.99 1y2m h ALA 525 Ca 0.02 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1y2m h ALA 525 Cb 0.76 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1y2m h ALA 525 CO 0.06 0.27 0.14 1.15 0.00 0.00 0.00 179.25 180.87 1y2m h THR 526 N 0.74 1.11 -0.55 0.00 2.02 -0.98 0.33 112.91 115.58 1y2m h THR 526 Ca 0.19 -0.29 -0.02 0.00 0.77 0.00 0.00 66.41 67.06 1y2m h THR 526 Cb 0.12 0.86 -0.03 0.00 -1.74 0.00 0.00 68.15 67.36 1y2m h THR 526 CO -0.02 0.11 0.28 -0.74 0.37 0.00 0.00 175.52 175.51 1y2m h HIS 527 N 0.29 0.78 -0.37 3.16 6.17 -0.80 -1.57 115.15 122.81 1y2m h HIS 527 Ca 0.09 -0.03 -0.03 0.00 0.71 0.00 0.00 60.37 61.10 1y2m h HIS 527 Cb 0.05 -0.24 -0.02 0.00 2.52 0.00 0.00 27.41 29.72 1y2m h HIS 527 CO -0.04 0.60 0.11 1.25 0.71 0.00 0.00 177.93 180.56 1y2m h LEU 528 N 0.74 0.55 -0.39 0.26 5.85 -0.70 0.12 115.31 121.75 1y2m h LEU 528 Ca 0.19 -0.21 0.08 0.00 0.84 0.00 0.00 57.88 58.78 1y2m h LEU 528 Cb 0.10 -0.15 -0.08 0.00 0.37 0.00 0.00 40.66 40.90 1y2m h LEU 528 CO -0.03 0.62 -0.15 0.22 -0.34 0.00 0.00 178.44 178.77 1y2m h TYR 529 N 0.46 -0.36 -0.44 1.25 3.20 -0.64 -2.30 116.97 118.15 1y2m h TYR 529 Ca 0.12 0.04 -0.09 0.00 3.14 0.00 0.00 58.73 61.94 1y2m h TYR 529 Cb 0.27 0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.74 1y2m h TYR 529 CO 0.01 -0.23 -0.06 0.00 -1.64 0.00 0.00 178.16 176.24 1y2m h VAL 531 N 0.66 1.22 -0.38 0.00 3.04 -0.53 -0.41 116.25 119.84 1y2m h VAL 531 Ca 0.12 -0.97 -0.13 0.00 -1.01 0.00 0.00 66.70 64.71 1y2m h VAL 531 Cb 0.58 1.20 -0.01 0.00 -2.01 0.00 0.00 31.29 31.06 1y2m h VAL 531 CO 0.03 0.31 -0.27 -0.07 -1.01 0.00 0.00 177.57 176.56 1y2m h LEU 532 N 0.36 0.90 -0.31 3.16 3.38 -1.34 0.60 115.31 122.06 1y2m h LEU 532 Ca 0.07 -0.44 0.03 0.00 0.09 0.00 0.00 57.88 57.63 1y2m h LEU 532 Cb 0.47 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 1y2m h LEU 532 CO 0.03 1.14 0.14 -0.61 0.09 0.00 0.00 178.44 179.23 1y2m h GLN 533 N 0.66 0.28 -0.95 1.13 5.75 -1.21 -1.66 115.11 119.11 1y2m h GLN 533 Ca 0.07 -0.02 0.03 0.00 -0.15 0.00 0.00 58.65 58.59 1y2m h GLN 533 Cb 0.84 -0.06 -0.05 0.00 1.07 0.00 0.00 27.48 29.28 1y2m h GLN 533 CO 0.07 0.19 0.63 0.00 -2.65 0.00 0.00 178.83 177.07 1y2m h ALA 534 N 1.17 1.37 -0.54 3.38 0.00 -0.84 -0.89 119.26 122.92 1y2m h ALA 534 Ca 0.13 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 1y2m h ALA 534 Cb 0.07 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 1y2m h ALA 534 CO -0.11 0.54 0.10 0.82 0.00 0.00 0.00 179.25 180.61 1y2m h ILE 535 N 1.22 1.25 -0.72 0.00 2.04 -0.50 0.15 117.51 120.95 1y2m h ILE 535 Ca 0.37 -0.93 -0.06 0.00 1.00 0.00 0.00 64.86 65.25 1y2m h ILE 535 Cb -0.02 0.81 -0.03 0.00 -0.74 0.00 0.00 36.82 36.84 1y2m h ILE 535 CO -0.11 0.34 0.22 0.44 0.00 0.00 0.00 178.15 179.04 1y2m h ASP 536 N 0.77 1.05 -0.22 1.72 3.32 -0.61 -0.49 116.42 121.96 1y2m h ASP 536 Ca 0.17 -0.21 -0.13 0.00 0.02 0.00 0.00 57.03 56.88 1y2m h ASP 536 Cb 0.38 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 1y2m h ASP 536 CO 0.01 0.98 -0.31 -0.07 -1.72 0.00 0.00 179.24 178.13 1y2m h LEU 537 N 1.06 0.76 -0.85 1.55 3.38 -0.79 -1.31 115.31 119.11 1y2m h LEU 537 Ca 0.23 -0.31 -0.08 0.00 0.09 0.00 0.00 57.88 57.82 1y2m h LEU 537 Cb 0.31 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1y2m h LEU 537 CO -0.01 1.01 -0.00 -0.09 0.09 0.00 0.00 178.44 179.44 1y2m h ARG 538 N 0.62 0.85 -0.73 1.13 9.65 -0.36 -1.12 114.38 124.42 1y2m h ARG 538 Ca 0.07 -0.24 -0.05 0.00 -1.10 0.00 0.00 59.98 58.66 1y2m h ARG 538 Cb 0.83 -0.09 -0.03 0.00 -1.39 0.00 0.00 29.97 29.29 1y2m h ARG 538 CO 0.07 0.85 0.25 0.00 2.80 0.00 0.00 179.97 183.94 1y2m h ALA 539 N 1.20 0.95 -0.74 2.80 0.00 -0.77 -0.17 119.26 122.54 1y2m h ALA 539 Ca 0.15 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1y2m h ALA 539 Cb 0.48 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 1y2m h ALA 539 CO 0.02 0.62 0.37 0.82 0.00 0.00 0.00 179.25 181.07 1y2m h ILE 540 N 1.07 1.24 -0.64 0.00 2.04 -0.98 -0.04 117.51 120.20 1y2m h ILE 540 Ca 0.24 -0.65 0.04 0.00 1.00 0.00 0.00 64.86 65.49 1y2m h ILE 540 Cb 0.28 0.31 -0.04 0.00 -0.74 0.00 0.00 36.82 36.62 1y2m h ILE 540 CO -0.01 0.27 0.39 -0.08 0.00 0.00 0.00 178.15 178.72 1y2m h GLU 541 N 1.03 0.73 -0.33 2.37 4.81 -0.77 -0.04 114.58 122.38 1y2m h GLU 541 Ca 0.25 -0.04 -0.13 0.00 -0.13 0.00 0.00 59.36 59.31 1y2m h GLU 541 Cb 0.10 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 1y2m h GLU 541 CO -0.03 0.48 -0.34 0.74 -0.73 0.00 0.00 179.01 179.12 1y2m h PHE 542 N 0.75 0.86 -0.48 0.92 -1.00 -0.32 -1.02 116.94 116.65 1y2m h PHE 542 Ca 0.27 -0.23 -0.05 0.00 2.81 0.00 0.00 57.97 60.76 1y2m h PHE 542 Cb 0.06 -0.19 -0.02 0.00 3.61 0.00 0.00 35.95 39.41 1y2m h PHE 542 CO -0.06 0.97 0.09 0.93 -1.61 0.00 0.00 178.31 178.64 1y2m h GLU 543 N 0.61 0.78 -0.28 1.51 4.39 -0.58 -2.04 114.58 118.98 1y2m h GLU 543 Ca 0.06 -0.20 0.05 0.00 0.34 0.00 0.00 59.36 59.62 1y2m h GLU 543 Cb 0.87 -0.10 -0.05 0.00 -0.10 0.00 0.00 28.75 29.38 1y2m h GLU 543 CO 0.08 0.78 -0.05 0.35 -1.16 0.00 0.00 179.01 179.00 1y2m h PHE 544 N 0.65 -0.11 -0.71 4.33 3.57 -0.73 -2.59 116.94 121.36 1y2m h PHE 544 Ca 0.15 0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.72 1y2m h PHE 544 Cb 0.36 0.09 -0.04 0.00 2.79 0.00 0.00 35.95 39.15 1y2m h PHE 544 CO 0.02 -0.10 0.47 0.87 -2.23 0.00 0.00 178.31 177.34 1y2m h LYS 545 N 0.02 0.76 -0.95 1.11 1.57 -0.77 0.29 116.57 118.61 1y2m h LYS 545 Ca 0.13 -0.05 0.10 0.00 -1.87 0.00 0.00 60.65 58.97 1y2m h LYS 545 Cb 0.20 -0.17 -0.08 0.00 0.08 0.00 0.00 32.23 32.26 1y2m h LYS 545 CO -0.27 0.51 0.59 0.87 -0.57 0.00 0.00 179.45 180.58 1y2m h LYS 546 N 0.79 0.95 0.01 3.15 1.57 -0.97 -1.86 116.57 120.21 1y2m h LYS 546 Ca 0.30 -0.06 -0.30 0.00 -1.87 0.00 0.00 60.65 58.72 1y2m h LYS 546 Cb 0.17 -0.21 -0.05 0.00 0.08 0.00 0.00 32.23 32.22 1y2m h LYS 546 CO -0.09 0.63 -1.72 1.04 -0.57 0.00 0.00 179.45 178.74 1y2m n GLN 547 N -4.63 0.64 0.08 3.15 6.02 -0.69 -4.44 117.38 117.52 1y2m n GLN 547 Ca 0.16 0.30 -0.09 0.00 -0.01 0.00 0.00 57.00 57.36 1y2m n GLN 547 Cb 0.29 -1.79 -0.03 0.00 1.02 0.00 0.00 30.24 29.72 1y2m n GLN 547 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.06 176.40 1y2m h PHE 548 N 0.00 0.31 -0.14 1.08 3.57 -0.06 -2.88 116.94 118.83 1y2m h PHE 548 Ca -0.29 -0.18 0.05 0.00 3.53 0.00 0.00 57.97 61.08 1y2m h PHE 548 Cb 2.01 -0.03 -0.06 0.00 2.79 0.00 0.00 35.95 40.66 1y2m h PHE 548 CO 0.01 1.02 -0.28 0.78 -2.23 0.00 0.00 178.31 177.60 1y2m h GLY 549 N 1.87 -0.35 2.00 2.40 0.00 -1.56 -0.12 103.07 107.30 1y2m h GLY 549 Ca -0.05 0.35 -0.03 0.00 0.00 0.00 0.00 47.33 47.60 1y2m h GLY 549 CO 0.14 -0.21 -0.14 -2.55 0.00 0.00 0.00 176.54 173.78 1y2m h PRO 550 N -0.35 0.00 -0.56 4.80 0.11 -1.79 -2.81 132.00 131.39 1y2m h PRO 550 Ca 0.10 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 66.10 1y2m h PRO 550 Cb 0.51 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.60 1y2m h PRO 550 CO -0.34 0.14 -0.08 0.00 -0.21 0.00 0.00 178.00 177.52 1y2m h ALA 551 N 1.86 0.77 -0.33 -0.75 0.00 -1.01 -0.98 119.26 118.81 1y2m h ALA 551 Ca -0.00 -0.34 0.02 0.00 0.00 0.00 0.00 54.91 54.59 1y2m h ALA 551 Cb 0.26 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1y2m h ALA 551 CO 0.02 0.66 0.17 0.82 0.00 0.00 0.00 179.25 180.92 1y2m h ILE 552 N 0.93 0.99 -0.38 0.00 2.04 -0.83 -0.33 117.51 119.93 1y2m h ILE 552 Ca 0.15 -0.12 -0.03 0.00 1.00 0.00 0.00 64.86 65.86 1y2m h ILE 552 Cb 0.65 0.61 -0.02 0.00 -0.74 0.00 0.00 36.82 37.32 1y2m h ILE 552 CO 0.04 0.06 0.10 0.58 0.00 0.00 0.00 178.15 178.94 1y2m h VAL 553 N 0.34 1.22 -0.50 1.67 2.07 -1.33 -1.33 116.25 118.39 1y2m h VAL 553 Ca 0.14 -0.74 -0.09 0.00 0.82 0.00 0.00 66.70 66.83 1y2m h VAL 553 Cb 0.05 0.99 -0.02 0.00 -1.52 0.00 0.00 31.29 30.79 1y2m h VAL 553 CO -0.10 0.26 -0.04 0.28 0.02 0.00 0.00 177.57 177.99 1y2m h SER 554 N 0.46 0.85 -0.09 0.57 0.02 -0.78 -0.70 113.55 113.88 1y2m h SER 554 Ca 0.12 -0.24 -0.16 0.00 -0.84 0.00 0.00 61.79 60.68 1y2m h SER 554 Cb 0.29 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.59 1y2m h SER 554 CO -0.00 0.94 -0.50 -0.07 -1.14 0.00 0.00 176.83 176.06 1y2m h LEU 555 N 0.80 0.72 -0.54 5.07 4.07 -0.90 -0.07 115.31 124.46 1y2m h LEU 555 Ca 0.14 -0.36 0.00 0.00 0.08 0.00 0.00 57.88 57.74 1y2m h LEU 555 Cb 0.54 -0.20 -0.03 0.00 1.08 0.00 0.00 40.66 42.04 1y2m h LEU 555 CO 0.03 1.09 0.35 0.40 -1.08 0.00 0.00 178.44 179.23 1y2m h ILE 556 N 0.52 1.15 -0.47 1.22 2.04 -0.91 -1.02 117.51 120.04 1y2m h ILE 556 Ca 0.02 -0.30 -0.07 0.00 1.00 0.00 0.00 64.86 65.51 1y2m h ILE 556 Cb 1.05 0.38 -0.02 0.00 -0.74 0.00 0.00 36.82 37.49 1y2m h ILE 556 CO 0.10 0.15 0.01 0.44 0.00 0.00 0.00 178.15 178.85 1y2m h ASP 557 N 0.73 0.80 -0.31 1.72 3.32 -0.97 0.11 116.42 121.83 1y2m h ASP 557 Ca 0.20 -0.30 -0.04 0.00 0.02 0.00 0.00 57.03 56.91 1y2m h ASP 557 Cb -0.05 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.27 1y2m h ASP 557 CO -0.04 0.90 0.05 -0.61 -1.72 0.00 0.00 179.24 177.82 1y2m h GLN 558 N 0.67 0.51 0.12 3.56 4.15 -0.79 -0.95 115.11 122.37 1y2m h GLN 558 Ca 0.13 -0.14 -0.32 0.00 0.77 0.00 0.00 58.65 59.09 1y2m h GLN 558 Cb 0.49 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 28.11 1y2m h GLN 558 CO 0.02 0.61 -1.67 0.45 -1.93 0.00 0.00 178.83 176.31 1y2m h HIS 559 N 0.33 0.47 -0.00 3.99 3.86 -1.19 -3.41 115.15 119.20 1y2m h HIS 559 Ca 0.09 -0.34 0.00 0.00 -1.16 0.00 0.00 60.37 58.96 1y2m h HIS 559 Cb 0.35 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 28.80 1y2m h HIS 559 CO 0.02 1.47 -0.25 1.19 0.86 0.00 0.00 177.93 181.23 1y2m n PHE 560 N -3.44 0.00 -0.11 2.45 3.72 0.37 -4.79 117.46 115.65 1y2m n PHE 560 Ca -0.21 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.14 1y2m n PHE 560 Cb 1.05 0.00 0.01 0.00 -0.94 0.00 0.00 39.48 39.60 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 1.54 0.19 0.92 1.37 0.00 -0.99 -2.33 103.07 103.76 1y2m h GLY 561 Ca 0.00 0.19 0.02 0.00 0.00 0.00 0.00 47.33 47.54 1y2m h GLY 561 CO 0.00 -0.18 0.40 0.23 0.00 0.00 0.00 176.54 176.99 1y2m h SER 562 N -0.07 0.67 0.00 0.19 0.87 -1.87 -2.19 113.55 111.15 1y2m h SER 562 Ca 0.19 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.75 1y2m h SER 562 Cb 0.36 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 62.17 1y2m h SER 562 CO -0.44 0.47 0.00 0.00 -0.53 0.00 0.00 176.83 176.33 1y2m n ALA 563 N -2.29 1.94 -0.88 6.23 0.00 -0.88 -4.94 120.51 119.69 1y2m n ALA 563 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 1y2m n ALA 563 Cb 0.06 -1.16 0.00 0.00 0.00 0.00 0.00 19.45 18.35 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 1.07 -3.35 -0.91 0.00 -2.24 -0.83 -4.77 114.28 103.26 1y2m n THR 565 Ca 0.00 1.31 0.00 0.00 -2.27 0.00 0.00 64.05 63.09 1y2m n THR 565 Cb 0.16 -1.92 0.00 0.00 -2.10 0.00 0.00 70.33 66.48 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 -0.66 1.04 3.92 3.38 0.00 -1.26 -5.00 105.19 106.61 1y2m n GLY 566 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.98 4.98 -0.46 1.61 1.04 -1.26 -5.02 113.70 111.60 1y2m s SER 567 Ca 0.00 -0.88 0.03 0.00 0.48 0.00 0.00 55.95 55.58 1y2m s SER 567 Cb 0.00 -0.15 0.47 0.00 0.10 0.00 0.00 66.02 66.44 1y2m s SER 567 CO 0.00 -0.90 1.62 -3.20 0.98 0.00 0.00 173.24 171.74 1y2m n ASN 568 N -1.75 5.73 0.04 7.02 5.15 -1.26 -4.73 115.26 125.46 1y2m n ASN 568 Ca 0.04 -3.77 0.10 0.00 -0.60 0.00 0.00 54.58 50.36 1y2m n ASN 568 Cb 0.62 -0.67 -0.09 0.00 -0.53 0.00 0.00 39.78 39.11 1y2m n ASN 568 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1y2m n LEU 569 N -0.88 0.44 0.04 1.20 4.77 -1.26 -4.53 117.00 116.79 1y2m n LEU 569 Ca 0.51 0.17 -0.13 0.00 -0.03 0.00 0.00 56.01 56.54 1y2m n LEU 569 Cb 0.88 -0.01 -0.09 0.00 -2.33 0.00 0.00 43.42 41.88 1y2m n LEU 569 CO 0.55 -0.06 0.68 -0.09 -1.33 0.00 0.00 177.39 177.14 1y2m h ARG 570 N 0.00 -0.10 -0.49 3.23 2.43 -1.99 0.06 114.38 117.52 1y2m h ARG 570 Ca -0.03 0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.21 1y2m h ARG 570 Cb 1.08 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 30.60 1y2m h ARG 570 CO 0.00 0.21 0.20 -0.44 -1.51 0.00 0.00 179.97 178.44 1y2m h ASP 571 N -0.43 0.24 -0.39 -3.80 5.19 -1.97 -0.76 116.42 114.50 1y2m h ASP 571 Ca -0.01 0.05 0.04 0.00 -0.62 0.00 0.00 57.03 56.49 1y2m h ASP 571 Cb 0.37 0.01 -0.04 0.00 0.18 0.00 0.00 39.33 39.85 1y2m h ASP 571 CO 0.02 0.17 0.16 -0.08 -3.12 0.00 0.00 179.24 176.39 1y2m h GLU 572 N 0.40 0.33 -0.32 3.56 4.81 -1.76 -1.39 114.58 120.21 1y2m h GLU 572 Ca 0.23 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.41 1y2m h GLU 572 Cb 0.21 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.50 1y2m h GLU 572 CO -0.21 0.22 0.07 1.25 -0.73 0.00 0.00 179.01 179.61 1y2m h LEU 573 N 0.34 0.50 -0.15 1.64 5.85 -0.51 -0.79 115.31 122.19 1y2m h LEU 573 Ca 0.18 -0.24 0.02 0.00 0.84 0.00 0.00 57.88 58.67 1y2m h LEU 573 Cb 0.13 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 1y2m h LEU 573 CO -0.16 0.62 0.04 0.58 -0.34 0.00 0.00 178.44 179.18 1y2m h VAL 574 N 0.36 0.95 -0.10 1.05 2.07 -1.01 0.46 116.25 120.03 1y2m h VAL 574 Ca 0.10 -0.04 0.02 0.00 0.82 0.00 0.00 66.70 67.60 1y2m h VAL 574 Cb 0.32 0.83 -0.02 0.00 -1.52 0.00 0.00 31.29 30.90 1y2m h VAL 574 CO 0.00 0.02 -0.02 -0.08 0.02 0.00 0.00 177.57 177.51 1y2m h GLU 575 N 0.12 -0.00 -0.19 1.57 4.81 -1.10 -1.05 114.58 118.73 1y2m h GLU 575 Ca 0.07 0.00 -0.18 0.00 -0.13 0.00 0.00 59.36 59.12 1y2m h GLU 575 Cb 0.05 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.42 1y2m h GLU 575 CO -0.08 -0.00 -0.61 0.87 -0.73 0.00 0.00 179.01 178.47 1y2m h LYS 576 N -0.00 0.65 -0.55 1.92 1.57 -0.93 -0.97 116.57 118.25 1y2m h LYS 576 Ca 0.05 -0.44 -0.08 0.00 -1.87 0.00 0.00 60.65 58.31 1y2m h LYS 576 Cb 0.07 0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.43 1y2m h LYS 576 CO -0.10 1.06 0.05 0.28 -0.57 0.00 0.00 179.45 180.16 1y2m h VAL 577 N 0.48 1.26 -0.37 0.50 2.07 -0.84 -1.59 116.25 117.76 1y2m h VAL 577 Ca -0.00 -1.04 0.03 0.00 0.82 0.00 0.00 66.70 66.50 1y2m h VAL 577 Cb 1.18 0.85 -0.03 0.00 -1.52 0.00 0.00 31.29 31.78 1y2m h VAL 577 CO 0.12 0.37 0.19 0.78 0.02 0.00 0.00 177.57 179.05 1y2m h ASN 578 N 0.82 0.28 -0.72 0.57 2.35 -0.97 -1.08 115.58 116.84 1y2m h ASN 578 Ca 0.16 0.02 0.02 0.00 -0.55 0.00 0.00 56.30 55.95 1y2m h ASN 578 Cb 0.47 -0.04 -0.04 0.00 0.05 0.00 0.00 38.32 38.76 1y2m h ASN 578 CO 0.02 0.21 0.46 0.11 -1.65 0.00 0.00 177.43 176.57 1y2m h LYS 579 N 0.39 0.87 -0.24 0.81 1.57 -1.05 -0.67 116.57 118.25 1y2m h LYS 579 Ca 0.16 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.85 1y2m h LYS 579 Cb 0.06 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.16 1y2m h LYS 579 CO -0.11 0.58 0.04 1.15 -0.57 0.00 0.00 179.45 180.54 1y2m h THR 580 N 0.90 1.23 0.15 -0.16 2.02 -1.04 -1.32 112.91 114.69 1y2m h THR 580 Ca 0.28 -0.78 -0.01 0.00 0.77 0.00 0.00 66.41 66.68 1y2m h THR 580 Cb -0.01 1.27 0.00 0.00 -1.74 0.00 0.00 68.15 67.67 1y2m h THR 580 CO -0.10 0.25 -0.07 -0.07 0.37 0.00 0.00 175.52 175.90 1y2m h LEU 581 N 0.21 -0.17 -0.61 2.58 3.38 -1.02 -1.54 115.31 118.14 1y2m h LEU 581 Ca 0.07 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.05 1y2m h LEU 581 Cb 0.33 0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 1y2m h LEU 581 CO 0.01 -0.10 0.39 0.00 0.09 0.00 0.00 178.44 178.83 1y2m h ALA 582 N 0.64 0.79 -0.76 1.53 0.00 -1.04 -0.27 119.26 120.15 1y2m h ALA 582 Ca -0.02 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 1y2m h ALA 582 Cb 0.17 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 1y2m h ALA 582 CO 0.03 0.17 0.27 0.87 0.00 0.00 0.00 179.25 180.60 1y2m h LYS 583 N 0.79 1.16 -0.03 0.00 1.79 -1.16 -3.04 116.57 116.08 1y2m h LYS 583 Ca 0.23 -0.23 -0.08 0.00 -2.18 0.00 0.00 60.65 58.39 1y2m h LYS 583 Cb -0.05 -0.18 0.00 0.00 -1.58 0.00 0.00 32.23 30.43 1y2m h LYS 583 CO -0.07 0.97 -0.30 -0.09 -1.08 0.00 0.00 179.45 178.88 1y2m h ARG 584 N 1.12 0.26 -0.19 3.15 9.65 -0.74 -3.25 114.38 124.38 1y2m h ARG 584 Ca 0.25 -0.24 0.02 0.00 -1.10 0.00 0.00 59.98 58.91 1y2m h ARG 584 Cb 0.26 0.06 -0.01 0.00 -1.39 0.00 0.00 29.97 28.89 1y2m h ARG 584 CO -0.01 0.91 0.13 -0.07 2.80 0.00 0.00 179.97 183.73 1y2m h LEU 585 N -0.31 0.16 -2.21 3.80 3.38 -1.10 -0.08 115.31 118.95 1y2m h LEU 585 Ca -0.03 -0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.95 1y2m h LEU 585 Cb 0.99 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.70 1y2m h LEU 585 CO 0.06 0.11 0.03 -0.08 0.09 0.00 0.00 178.44 178.65 1y2m h GLU 586 N 0.19 0.00 0.00 1.13 4.81 -1.56 -2.64 114.58 116.50 1y2m h GLU 586 Ca 0.08 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.31 1y2m h GLU 586 Cb 0.08 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.46 1y2m h GLU 586 CO -0.01 0.00 -1.22 1.04 -0.73 0.00 0.00 179.01 178.09 1y2m n GLN 587 N -4.20 0.35 -1.12 1.92 6.02 -0.06 -4.00 117.38 116.28 1y2m n GLN 587 Ca -0.02 -0.03 -0.13 0.00 -0.01 0.00 0.00 57.00 56.81 1y2m n GLN 587 Cb 0.12 -1.58 0.15 0.00 1.02 0.00 0.00 30.24 29.95 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 -2.02 2.70 0.89 5.09 -2.24 -0.99 -4.63 114.28 113.08 1y2m n THR 588 Ca 0.01 -3.04 0.09 0.00 -2.27 0.00 0.00 64.05 58.84 1y2m n THR 588 Cb 0.46 -0.58 0.48 0.00 -2.10 0.00 0.00 70.33 68.58 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 -1.03 0.00 -0.33 3.42 6.94 -1.24 -1.93 115.26 121.10 1y2m n ASN 589 Ca 0.40 0.05 0.11 0.00 -0.02 0.00 0.00 54.58 55.12 1y2m n ASN 589 Cb 1.00 -0.30 0.10 0.00 -2.36 0.00 0.00 39.78 38.22 1y2m n ASN 589 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 1y2m n SER 590 N -1.30 1.51 -4.81 0.53 7.64 -1.26 -1.77 113.62 114.16 1y2m n SER 590 Ca 0.09 -1.19 -0.33 0.00 1.01 0.00 0.00 58.87 58.44 1y2m n SER 590 Cb 0.16 0.44 -0.06 0.00 -1.01 0.00 0.00 64.21 63.74 1y2m n SER 590 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1y2m s TYR 591 N -2.59 3.22 0.69 1.43 1.51 -0.81 -4.74 117.35 116.06 1y2m s TYR 591 Ca 0.18 1.59 -0.15 0.00 -1.01 0.00 0.00 57.07 57.69 1y2m s TYR 591 Cb 0.18 -2.91 0.02 0.00 -0.11 0.00 0.00 41.96 39.14 1y2m s TYR 591 CO 0.61 -0.34 1.15 -0.51 -1.11 0.00 0.00 175.55 175.35 1y2m s ASP 592 N -2.16 4.69 0.14 2.29 1.11 -1.26 -4.68 116.67 116.80 1y2m s ASP 592 Ca 0.63 2.16 -0.20 0.00 0.18 0.00 0.00 52.55 55.32 1y2m s ASP 592 Cb -0.11 -2.57 0.00 0.00 1.07 0.00 0.00 42.92 41.31 1y2m s ASP 592 CO 0.16 -1.92 1.69 0.25 1.18 0.00 0.00 175.17 176.53 1y2m h LEU 593 N -0.12 -0.31 0.59 1.23 5.85 -1.96 -0.95 115.31 119.64 1y2m h LEU 593 Ca -0.47 0.08 -0.03 0.00 0.84 0.00 0.00 57.88 58.30 1y2m h LEU 593 Cb 1.27 0.18 0.01 0.00 0.37 0.00 0.00 40.66 42.48 1y2m h LEU 593 CO 0.52 -0.12 -0.28 0.58 -0.34 0.00 0.00 178.44 178.80 1y2m h VAL 594 N -0.05 0.36 0.00 1.05 2.07 -1.99 -2.51 116.25 115.18 1y2m h VAL 594 Ca 0.12 -0.21 -0.02 0.00 0.82 0.00 0.00 66.70 67.41 1y2m h VAL 594 Cb 0.23 0.43 -0.00 0.00 -1.52 0.00 0.00 31.29 30.43 1y2m h VAL 594 CO -0.26 0.03 -0.08 1.55 0.02 0.00 0.00 177.57 178.82 1y2m h PRO 595 N -0.94 0.00 -0.33 1.57 0.13 -1.94 -2.61 132.00 127.88 1y2m h PRO 595 Ca -0.08 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 65.07 1y2m h PRO 595 Cb 0.66 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.76 1y2m h PRO 595 CO 0.13 0.08 0.18 -0.09 -0.23 0.00 0.00 178.00 178.08 1y2m h ARG 596 N 0.00 0.36 -0.02 0.86 2.43 -0.93 -0.79 114.38 116.28 1y2m h ARG 596 Ca -0.00 -0.02 -0.21 0.00 -0.81 0.00 0.00 59.98 58.94 1y2m h ARG 596 Cb 0.15 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.62 1y2m h ARG 596 CO 0.01 0.24 -0.87 -1.49 -1.51 0.00 0.00 179.97 176.35 1y2m h TRP 597 N 0.37 0.54 -0.46 2.20 4.06 -1.15 -1.28 115.95 120.21 1y2m h TRP 597 Ca 0.13 -0.28 -0.07 0.00 2.06 0.00 0.00 58.89 60.74 1y2m h TRP 597 Cb 0.02 -0.07 -0.02 0.00 -1.00 0.00 0.00 29.16 28.10 1y2m h TRP 597 CO -0.09 1.07 0.00 0.45 -3.56 0.00 0.00 178.44 176.32 1y2m h HIS 598 N 0.22 0.81 0.05 0.49 3.86 -1.38 -1.89 115.15 117.31 1y2m h HIS 598 Ca -0.06 -0.11 -0.00 0.00 -1.16 0.00 0.00 60.37 59.04 1y2m h HIS 598 Cb 1.48 -0.22 0.00 0.00 1.06 0.00 0.00 27.41 29.73 1y2m h HIS 598 CO 0.05 0.75 -0.03 0.22 0.86 0.00 0.00 177.93 179.78 1y2m h ASP 599 N 0.71 -0.06 -0.32 2.45 3.58 -0.92 -0.76 116.42 121.09 1y2m h ASP 599 Ca 0.14 -0.03 -0.00 0.00 0.42 0.00 0.00 57.03 57.56 1y2m h ASP 599 Cb 0.43 0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.48 1y2m h ASP 599 CO 0.02 -0.01 0.19 0.00 -2.88 0.00 0.00 179.24 176.55 1y2m h ALA 600 N 0.84 0.41 0.00 -0.78 0.00 -1.07 -1.99 119.26 116.68 1y2m h ALA 600 Ca -0.01 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1y2m h ALA 600 Cb 0.08 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1y2m h ALA 600 CO 0.01 -0.07 0.00 0.74 0.00 0.00 0.00 179.25 179.93 1y2m h PHE 601 N 0.41 0.00 -0.38 0.00 0.04 -1.36 -0.75 116.94 114.90 1y2m h PHE 601 Ca 0.12 0.00 -0.08 0.00 2.80 0.00 0.00 57.97 60.81 1y2m h PHE 601 Cb 0.03 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.17 1y2m h PHE 601 CO -0.04 0.00 -0.06 1.03 -0.60 0.00 0.00 178.31 178.65 1y2m h SER 602 N 0.00 0.72 -0.28 2.17 0.87 -0.72 0.17 113.55 116.47 1y2m h SER 602 Ca 0.00 -0.34 -0.02 0.00 -1.23 0.00 0.00 61.79 60.19 1y2m h SER 602 Cb 0.73 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.48 1y2m h SER 602 CO 0.00 0.89 0.09 0.15 -0.53 0.00 0.00 176.83 177.43 1y2m h PHE 603 N 0.53 0.45 -0.32 2.24 3.04 -1.00 -2.68 116.94 119.20 1y2m h PHE 603 Ca 0.10 -0.05 0.00 0.00 3.98 0.00 0.00 57.97 62.01 1y2m h PHE 603 Cb 0.56 -0.13 -0.02 0.00 2.56 0.00 0.00 35.95 38.92 1y2m h PHE 603 CO 0.05 0.48 0.21 0.00 -2.02 0.00 0.00 178.31 177.02 1y2m h ALA 604 N 0.92 1.76 -0.41 2.41 0.00 -0.91 -1.14 119.26 121.89 1y2m h ALA 604 Ca 0.09 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.00 1y2m h ALA 604 Cb 0.24 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1y2m h ALA 604 CO -0.00 0.22 0.27 0.00 0.00 0.00 0.00 179.25 179.74 1y2m h ALA 605 N 1.79 1.81 -0.71 0.00 0.00 -0.31 -0.49 119.26 121.34 1y2m h ALA 605 Ca 0.12 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1y2m h ALA 605 Cb -0.04 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 1y2m h ALA 605 CO -0.02 0.14 0.39 0.78 0.00 0.00 0.00 179.25 180.53 1y2m h GLY 606 N 0.46 1.07 1.03 0.00 0.00 -1.10 -1.13 103.07 103.39 1y2m h GLY 606 Ca 0.16 -0.49 -0.02 0.00 0.00 0.00 0.00 47.33 46.98 1y2m h GLY 606 CO -0.04 0.47 0.44 -0.84 0.00 0.00 0.00 176.54 176.57 1y2m h THR 607 N 0.98 1.26 -0.42 4.70 2.02 -1.09 -2.51 112.91 117.86 1y2m h THR 607 Ca 0.25 -0.68 -0.01 0.00 0.77 0.00 0.00 66.41 66.73 1y2m h THR 607 Cb 0.04 0.12 -0.02 0.00 -1.74 0.00 0.00 68.15 66.56 1y2m h THR 607 CO -0.04 0.30 0.21 0.58 0.37 0.00 0.00 175.52 176.94 1y2m h VAL 608 N 1.22 1.17 -0.73 3.16 2.07 -0.80 0.16 116.25 122.50 1y2m h VAL 608 Ca 0.30 -0.45 0.14 0.00 0.82 0.00 0.00 66.70 67.50 1y2m h VAL 608 Cb 0.08 0.70 -0.09 0.00 -1.52 0.00 0.00 31.29 30.46 1y2m h VAL 608 CO -0.04 0.18 0.27 0.58 0.02 0.00 0.00 177.57 178.57 1y2m h VAL 609 N 0.53 0.65 0.15 2.57 2.07 -0.95 0.18 116.25 121.46 1y2m h VAL 609 Ca 0.14 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.52 1y2m h VAL 609 Cb 0.09 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 30.07 1y2m h VAL 609 CO -0.02 0.07 -0.07 -0.08 0.02 0.00 0.00 177.57 177.49 1y2m h GLU 610 N 0.41 -0.20 -0.28 1.57 4.81 -1.01 -2.59 114.58 117.28 1y2m h GLU 610 Ca 0.40 0.01 -0.11 0.00 -0.13 0.00 0.00 59.36 59.53 1y2m h GLU 610 Cb 0.60 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.01 1y2m h GLU 610 CO -0.41 0.24 -0.27 0.28 -0.73 0.00 0.00 179.01 178.12 1y2m h VAL 611 N -0.76 1.27 -0.70 0.32 2.07 -0.72 -2.74 116.25 115.00 1y2m h VAL 611 Ca -0.02 -1.33 -0.28 0.00 0.82 0.00 0.00 66.70 65.89 1y2m h VAL 611 Cb 0.53 1.35 -0.17 0.00 -1.52 0.00 0.00 31.29 31.48 1y2m h VAL 611 CO 0.03 0.43 0.29 0.18 0.02 0.00 0.00 177.57 178.53 1y2m n LEU 612 N -4.10 5.72 0.28 2.57 4.77 0.60 -4.63 117.00 122.20 1y2m n LEU 612 Ca -0.00 -3.42 0.13 0.00 -0.03 0.00 0.00 56.01 52.68 1y2m n LEU 612 Cb 0.43 -0.73 0.83 0.00 -2.33 0.00 0.00 43.42 41.61 1y2m n LEU 612 CO 0.43 0.95 1.11 0.77 -1.33 0.00 0.00 177.39 179.32 1y2m h SER 613 N 1.79 0.00 0.93 -1.43 4.64 -1.13 -1.25 113.55 117.10 1y2m h SER 613 Ca 0.34 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.66 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 0.73 0.00 -0.05 -1.54 -0.87 0.00 0.00 176.83 175.10 1y2m n SER 614 N -4.06 0.06 -4.83 4.97 3.41 -1.26 -4.93 113.62 106.98 1y2m n SER 614 Ca -0.03 0.39 -0.25 0.00 -0.26 0.00 0.00 58.87 58.73 1y2m n SER 614 Cb 0.10 -0.41 0.08 0.00 -0.26 0.00 0.00 64.21 63.72 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 -2.98 2.32 -2.22 6.66 -4.23 -0.47 -4.99 115.64 109.72 1y2m s THR 615 Ca 0.14 -0.41 0.19 0.00 -1.18 0.00 0.00 61.69 60.44 1y2m s THR 615 Cb 0.19 -2.91 0.43 0.00 1.34 0.00 0.00 72.50 71.54 1y2m s THR 615 CO 0.54 0.00 1.48 -1.54 -0.54 0.00 0.00 174.62 174.57 1y2m n SER 616 N -2.83 1.80 -4.75 3.99 3.41 -1.26 -4.97 113.62 109.01 1y2m n SER 616 Ca 0.10 -1.78 -0.41 0.00 -0.26 0.00 0.00 58.87 56.51 1y2m n SER 616 Cb 0.60 -0.14 -0.02 0.00 -0.26 0.00 0.00 64.21 64.39 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 -1.44 4.36 0.74 1.04 1.43 -1.26 -5.00 118.68 118.54 1y2m s LEU 617 Ca 0.31 2.85 -0.11 0.00 -1.03 0.00 0.00 54.13 56.15 1y2m s LEU 617 Cb 0.17 -3.63 0.03 0.00 0.03 0.00 0.00 46.19 42.79 1y2m s LEU 617 CO 0.24 -0.83 1.07 -0.94 0.23 0.00 0.00 176.35 176.13 1y2m s SER 618 N 0.41 5.02 0.33 2.29 1.04 -1.26 -4.96 113.70 116.57 1y2m s SER 618 Ca 0.61 1.50 0.04 0.00 0.48 0.00 0.00 55.95 58.58 1y2m s SER 618 Cb -0.46 -2.32 0.58 0.00 0.10 0.00 0.00 66.02 63.92 1y2m s SER 618 CO 0.47 -1.66 1.87 -0.07 0.98 0.00 0.00 173.24 174.83 1y2m h LEU 619 N -0.87 0.52 -0.53 2.42 3.38 -1.99 -2.18 115.31 116.06 1y2m h LEU 619 Ca -0.45 -0.10 0.01 0.00 0.09 0.00 0.00 57.88 57.43 1y2m h LEU 619 Cb 1.23 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.82 1y2m h LEU 619 CO 0.58 0.59 0.35 0.00 0.09 0.00 0.00 178.44 180.04 1y2m h ALA 620 N 1.48 0.67 -0.43 1.53 0.00 -1.98 0.21 119.26 120.75 1y2m h ALA 620 Ca 0.12 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.00 1y2m h ALA 620 Cb 0.33 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1y2m h ALA 620 CO 0.01 0.10 0.28 0.00 0.00 0.00 0.00 179.25 179.64 1y2m h ALA 621 N 1.20 0.54 -0.33 0.00 0.00 -1.83 0.96 119.26 119.80 1y2m h ALA 621 Ca 0.20 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 1y2m h ALA 621 Cb -0.07 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1y2m h ALA 621 CO -0.05 -0.01 -0.08 0.28 0.00 0.00 0.00 179.25 179.39 1y2m h VAL 622 N 0.57 1.28 -0.95 0.00 2.07 -1.06 -1.80 116.25 116.36 1y2m h VAL 622 Ca 0.16 -1.12 0.04 0.00 0.82 0.00 0.00 66.70 66.59 1y2m h VAL 622 Cb -0.06 1.34 -0.06 0.00 -1.52 0.00 0.00 31.29 31.00 1y2m h VAL 622 CO -0.04 0.36 0.62 -1.13 0.02 0.00 0.00 177.57 177.41 1y2m h ASN 623 N 0.41 1.03 -0.69 0.57 -1.24 -0.41 -1.04 115.58 114.20 1y2m h ASN 623 Ca 0.08 -0.01 -0.06 0.00 0.71 0.00 0.00 56.30 57.02 1y2m h ASN 623 Cb 0.57 -0.23 -0.03 0.00 0.73 0.00 0.00 38.32 39.36 1y2m h ASN 623 CO 0.03 0.70 0.19 0.00 -1.29 0.00 0.00 177.43 177.06 1y2m h ALA 624 N 1.45 0.90 -0.17 1.57 0.00 -0.60 -0.73 119.26 121.69 1y2m h ALA 624 Ca 0.38 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1y2m h ALA 624 Cb 0.03 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1y2m h ALA 624 CO -0.12 0.61 0.11 2.35 0.00 0.00 0.00 179.25 182.20 1y2m h TRP 625 N 1.02 0.22 -0.58 0.00 7.01 -0.98 -0.85 115.95 121.79 1y2m h TRP 625 Ca 0.22 0.00 0.07 0.00 2.11 0.00 0.00 58.89 61.30 1y2m h TRP 625 Cb 0.34 -0.07 -0.06 0.00 -2.10 0.00 0.00 29.16 27.27 1y2m h TRP 625 CO 0.03 0.16 0.26 -0.22 -2.79 0.00 0.00 178.44 175.87 1y2m h LYS 626 N 0.22 0.46 -0.15 2.65 3.11 -0.66 0.27 116.57 122.47 1y2m h LYS 626 Ca 0.06 -0.03 -0.03 0.00 -2.81 0.00 0.00 60.65 57.85 1y2m h LYS 626 Cb -0.00 -0.10 -0.01 0.00 -1.00 0.00 0.00 32.23 31.12 1y2m h LYS 626 CO -0.01 0.30 -0.01 0.28 -2.81 0.00 0.00 179.45 177.20 1y2m h VAL 627 N 0.47 1.26 -0.59 2.00 2.07 -1.00 -1.51 116.25 118.96 1y2m h VAL 627 Ca 0.28 -0.88 0.01 0.00 0.82 0.00 0.00 66.70 66.93 1y2m h VAL 627 Cb 0.28 1.55 -0.03 0.00 -1.52 0.00 0.00 31.29 31.57 1y2m h VAL 627 CO -0.24 0.26 0.38 0.00 0.02 0.00 0.00 177.57 177.99 1y2m h ALA 628 N 0.75 0.75 -0.43 1.67 0.00 -0.72 -0.83 119.26 120.45 1y2m h ALA 628 Ca 0.04 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 1y2m h ALA 628 Cb 0.40 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1y2m h ALA 628 CO 0.01 0.15 -0.20 0.00 0.00 0.00 0.00 179.25 179.21 1y2m h ALA 629 N 1.23 0.60 -0.43 0.00 0.00 -0.39 0.74 119.26 121.00 1y2m h ALA 629 Ca 0.22 -0.38 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 1y2m h ALA 629 Cb -0.06 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1y2m h ALA 629 CO -0.06 0.57 0.26 0.00 0.00 0.00 0.00 179.25 180.02 1y2m h ALA 630 N 0.83 0.55 -0.84 0.00 0.00 -1.11 -1.28 119.26 117.42 1y2m h ALA 630 Ca 0.10 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1y2m h ALA 630 Cb 0.77 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.35 1y2m h ALA 630 CO 0.06 0.04 0.38 0.93 0.00 0.00 0.00 179.25 180.67 1y2m h GLU 631 N 0.57 1.22 -0.54 0.00 5.08 -0.94 -0.72 114.58 119.26 1y2m h GLU 631 Ca 0.16 -0.19 0.06 0.00 -1.00 0.00 0.00 59.36 58.38 1y2m h GLU 631 Cb -0.00 -0.21 -0.05 0.00 0.50 0.00 0.00 28.75 28.98 1y2m h GLU 631 CO -0.03 0.95 0.26 1.03 -1.00 0.00 0.00 179.01 180.22 1y2m h SER 632 N 1.20 0.35 -0.34 1.42 0.87 -0.66 -0.44 113.55 115.95 1y2m h SER 632 Ca 0.29 0.04 -0.16 0.00 -1.23 0.00 0.00 61.79 60.72 1y2m h SER 632 Cb 0.15 -0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.08 1y2m h SER 632 CO -0.03 0.24 -0.41 0.00 -0.53 0.00 0.00 176.83 176.09 1y2m h ALA 633 N 1.31 0.59 0.12 6.23 0.00 -0.88 0.59 119.26 127.22 1y2m h ALA 633 Ca 0.25 -0.46 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1y2m h ALA 633 Cb 0.19 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1y2m h ALA 633 CO -0.19 0.68 -0.06 0.82 0.00 0.00 0.00 179.25 180.50 1y2m h ILE 634 N 0.73 0.92 -0.74 0.00 2.04 -0.92 0.32 117.51 119.86 1y2m h ILE 634 Ca 0.05 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.77 1y2m h ILE 634 Cb 1.00 1.01 -0.04 0.00 -0.74 0.00 0.00 36.82 38.06 1y2m h ILE 634 CO 0.10 0.04 0.47 0.28 0.00 0.00 0.00 178.15 179.03 1y2m h SER 635 N -0.23 0.87 -0.62 1.72 0.02 -0.99 -1.82 113.55 112.51 1y2m h SER 635 Ca -0.02 -0.05 -0.09 0.00 -0.84 0.00 0.00 61.79 60.79 1y2m h SER 635 Cb 0.18 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.48 1y2m h SER 635 CO 0.03 0.66 0.03 0.25 -1.14 0.00 0.00 176.83 176.66 1y2m h LEU 636 N 1.01 1.05 -0.44 5.07 5.85 -0.75 -0.88 115.31 126.22 1y2m h LEU 636 Ca 0.27 -0.29 0.02 0.00 0.84 0.00 0.00 57.88 58.72 1y2m h LEU 636 Cb -0.07 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 40.65 1y2m h LEU 636 CO -0.05 1.09 0.26 0.74 -0.34 0.00 0.00 178.44 180.13 1y2m h THR 637 N 0.98 1.04 -0.85 1.05 2.02 -0.69 -0.19 112.91 116.27 1y2m h THR 637 Ca 0.18 -0.18 -0.01 0.00 0.77 0.00 0.00 66.41 67.18 1y2m h THR 637 Cb 0.53 0.47 -0.04 0.00 -1.74 0.00 0.00 68.15 67.38 1y2m h THR 637 CO 0.03 0.09 0.51 0.03 0.37 0.00 0.00 175.52 176.55 1y2m h ARG 638 N 0.52 1.15 -0.02 6.66 3.08 -1.05 -1.61 114.38 123.11 1y2m h ARG 638 Ca 0.18 -0.10 -0.00 0.00 0.07 0.00 0.00 59.98 60.12 1y2m h ARG 638 Cb 0.02 -0.24 -0.00 0.00 0.08 0.00 0.00 29.97 29.83 1y2m h ARG 638 CO -0.09 0.81 0.01 0.37 -1.07 0.00 0.00 179.97 179.99 1y2m h GLN 639 N 1.17 0.02 -0.65 0.04 4.15 -0.66 -1.48 115.11 117.70 1y2m h GLN 639 Ca 0.30 -0.00 -0.07 0.00 0.77 0.00 0.00 58.65 59.65 1y2m h GLN 639 Cb -0.04 -0.00 -0.03 0.00 0.21 0.00 0.00 27.48 27.62 1y2m h GLN 639 CO -0.06 0.19 0.13 0.28 -1.93 0.00 0.00 178.83 177.44 1y2m h VAL 640 N -0.15 1.26 -0.25 2.39 2.07 -0.81 0.16 116.25 120.93 1y2m h VAL 640 Ca 0.01 -0.98 -0.00 0.00 0.82 0.00 0.00 66.70 66.54 1y2m h VAL 640 Cb 0.17 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 30.55 1y2m h VAL 640 CO -0.00 0.37 0.14 0.03 0.02 0.00 0.00 177.57 178.13 1y2m h ARG 641 N 0.99 0.34 -0.71 1.57 3.08 -1.23 -1.88 114.38 116.54 1y2m h ARG 641 Ca 0.20 -0.04 0.04 0.00 0.07 0.00 0.00 59.98 60.25 1y2m h ARG 641 Cb 0.40 -0.07 -0.05 0.00 0.08 0.00 0.00 29.97 30.33 1y2m h ARG 641 CO 0.01 0.30 0.43 0.93 -1.07 0.00 0.00 179.97 180.57 1y2m h GLU 642 N 0.29 0.81 -0.85 0.04 4.39 -0.52 -0.97 114.58 117.76 1y2m h GLU 642 Ca 0.09 -0.05 -0.00 0.00 0.34 0.00 0.00 59.36 59.73 1y2m h GLU 642 Cb 0.05 -0.18 -0.04 0.00 -0.10 0.00 0.00 28.75 28.48 1y2m h GLU 642 CO -0.01 0.54 0.52 1.15 -1.16 0.00 0.00 179.01 180.04 1y2m h THR 643 N 0.84 1.24 0.09 1.13 2.02 -0.77 -1.58 112.91 115.87 1y2m h THR 643 Ca 0.29 -0.51 -0.00 0.00 0.77 0.00 0.00 66.41 66.96 1y2m h THR 643 Cb 0.06 0.03 0.00 0.00 -1.74 0.00 0.00 68.15 66.50 1y2m h THR 643 CO -0.13 0.25 -0.04 0.15 0.37 0.00 0.00 175.52 176.11 1y2m h PHE 644 N 1.18 -0.12 0.00 3.16 3.57 -0.64 -3.27 116.94 120.82 1y2m h PHE 644 Ca 0.31 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.80 1y2m h PHE 644 Cb -0.05 0.04 0.00 0.00 2.79 0.00 0.00 35.95 38.73 1y2m h PHE 644 CO 0.00 0.09 0.00 -1.49 -2.23 0.00 0.00 178.31 174.68 1y2m h TRP 645 N -0.31 0.00 -0.48 0.41 4.06 -0.94 -3.21 115.95 115.48 1y2m h TRP 645 Ca -0.01 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.94 1y2m h TRP 645 Cb 0.26 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.42 1y2m h TRP 645 CO -0.01 0.00 0.00 -1.13 -3.56 0.00 0.00 178.44 173.74 1y2m n SER 646 N -2.68 3.17 -4.32 -3.49 3.41 -0.62 -4.87 113.62 104.23 1y2m n SER 646 Ca 0.03 -1.96 -0.19 0.00 -0.26 0.00 0.00 58.87 56.49 1y2m n SER 646 Cb 0.36 -0.32 -0.10 0.00 -0.26 0.00 0.00 64.21 63.89 1y2m n SER 646 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1y2m s ALA 647 N -1.37 1.88 0.75 7.33 0.00 -1.22 -5.07 121.76 124.07 1y2m s ALA 647 Ca 0.39 -1.55 -0.11 0.00 0.00 0.00 0.00 51.96 50.70 1y2m s ALA 647 Cb 0.22 -0.10 0.04 0.00 0.00 0.00 0.00 23.12 23.28 1y2m s ALA 647 CO 0.29 0.10 1.08 0.00 0.00 0.00 0.00 175.76 177.24 1y2m s ALA 648 N -2.64 2.37 0.20 0.00 0.00 -1.26 -4.92 121.76 115.51 1y2m s ALA 648 Ca 0.18 0.24 0.36 0.00 0.00 0.00 0.00 51.96 52.74 1y2m s ALA 648 Cb -0.02 -3.25 1.64 0.00 0.00 0.00 0.00 23.12 21.48 1y2m s ALA 648 CO 0.06 -1.61 2.06 0.66 0.00 0.00 0.00 175.76 176.93 1y2m h SER 649 N -0.96 0.00 0.46 0.00 4.64 -1.95 0.33 113.55 116.07 1y2m h SER 649 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 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 0.53 0.00 0.00 0.71 -0.87 0.00 0.00 176.83 177.20 1y2m h THR 650 N 0.00 0.00 -0.33 2.95 1.35 -1.96 -1.59 112.91 113.32 1y2m h THR 650 Ca 0.00 -0.19 0.00 0.00 -0.55 0.00 0.00 66.41 65.67 1y2m h THR 650 Cb 0.33 0.97 0.00 0.00 -1.73 0.00 0.00 68.15 67.72 1y2m h THR 650 CO 0.00 0.00 0.00 -1.20 -0.25 0.00 0.00 175.52 174.07 1y2m n SER 651 N -2.61 3.98 -4.74 5.36 7.64 0.10 -5.05 113.62 118.30 1y2m n SER 651 Ca -0.00 -2.80 -0.42 0.00 1.01 0.00 0.00 58.87 56.66 1y2m n SER 651 Cb 0.16 -0.51 -0.01 0.00 -1.01 0.00 0.00 64.21 62.85 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 -0.11 3.44 0.06 6.43 2.88 -0.60 -4.83 113.62 120.88 1y2m n SER 652 Ca 0.21 1.21 0.08 0.00 -1.33 0.00 0.00 58.87 59.03 1y2m n SER 652 Cb 0.85 -1.57 0.34 0.00 -0.75 0.00 0.00 64.21 63.08 1y2m n SER 652 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1y2m n PRO 653 N 0.75 0.07 -0.06 -1.46 -0.04 -1.26 -1.63 135.00 131.37 1y2m n PRO 653 Ca 0.04 0.39 0.11 0.00 -0.04 0.00 0.00 63.50 63.99 1y2m n PRO 653 Cb 0.37 -1.66 0.50 0.00 -0.04 0.00 0.00 33.50 32.67 1y2m n PRO 653 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1y2m h ALA 654 N 2.29 1.98 0.00 0.55 0.00 -1.88 -1.45 119.26 120.75 1y2m h ALA 654 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1y2m h ALA 654 Cb 0.21 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 1y2m h ALA 654 CO 0.00 -0.09 -0.05 -0.07 0.00 0.00 0.00 179.25 179.04 1y2m h LEU 655 N 0.41 0.00 -0.98 0.00 3.38 -1.67 -0.08 115.31 116.37 1y2m h LEU 655 Ca 0.25 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.22 1y2m h LEU 655 Cb 0.44 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.19 1y2m h LEU 655 CO -0.07 0.05 -0.01 0.28 0.09 0.00 0.00 178.44 178.79 1y2m h SER 656 N 0.00 0.00 0.00 -0.43 0.02 -1.43 -3.38 113.55 108.32 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 0.32 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.86 1y2m h SER 656 CO 0.01 0.01 -0.89 -1.22 -1.14 0.00 0.00 176.83 173.60 1y2m n TYR 657 N -3.10 0.00 -1.73 3.45 4.01 -0.63 -4.86 117.16 114.30 1y2m n TYR 657 Ca 0.02 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.36 1y2m n TYR 657 Cb 0.38 0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.45 1y2m n TYR 657 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1y2m n LEU 658 N -1.77 5.11 -4.56 7.72 4.77 -0.14 -0.19 117.00 127.94 1y2m n LEU 658 Ca 0.00 1.02 -0.38 0.00 -0.03 0.00 0.00 56.01 56.63 1y2m n LEU 658 Cb 0.39 -1.56 0.05 0.00 -2.33 0.00 0.00 43.42 39.97 1y2m n LEU 658 CO 0.00 -0.56 0.37 -0.24 -1.33 0.00 0.00 177.39 175.63 1y2m n SER 659 N -0.62 0.09 0.25 -1.43 2.88 -1.26 -4.69 113.62 108.85 1y2m n SER 659 Ca 0.09 0.76 0.08 0.00 -1.33 0.00 0.00 58.87 58.47 1y2m n SER 659 Cb 0.43 -1.32 0.62 0.00 -0.75 0.00 0.00 64.21 63.20 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 0.30 0.00 0.21 -1.46 0.13 -1.82 -0.92 132.00 128.43 1y2m h PRO 660 Ca -0.47 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.33 1y2m h PRO 660 Cb 1.38 0.00 0.04 0.00 0.13 0.00 0.00 31.00 32.54 1y2m h PRO 660 CO 0.49 0.07 -1.40 0.00 -0.23 0.00 0.00 178.00 176.93 1y2m h ARG 661 N 0.00 0.58 0.00 0.86 3.08 -1.86 -3.30 114.38 113.74 1y2m h ARG 661 Ca -0.00 -0.90 -0.10 0.00 0.07 0.00 0.00 59.98 59.05 1y2m h ARG 661 Cb 0.14 0.32 -0.01 0.00 0.08 0.00 0.00 29.97 30.50 1y2m h ARG 661 CO 0.01 1.43 -0.45 1.79 -1.07 0.00 0.00 179.97 181.67 1y2m h THR 662 N 0.20 1.13 -0.88 2.04 1.35 -1.69 -2.63 112.91 112.42 1y2m h THR 662 Ca -0.23 -1.67 0.19 0.00 -0.55 0.00 0.00 66.41 64.15 1y2m h THR 662 Cb 2.08 1.95 -0.06 0.00 -1.73 0.00 0.00 68.15 70.39 1y2m h THR 662 CO 0.26 0.45 0.58 1.56 -0.25 0.00 0.00 175.52 178.12 1y2m h GLN 663 N 0.00 0.41 -0.68 4.72 4.20 -1.25 -1.57 115.11 120.95 1y2m h GLN 663 Ca -0.00 -0.02 0.03 0.00 0.06 0.00 0.00 58.65 58.71 1y2m h GLN 663 Cb 0.92 -0.09 -0.04 0.00 0.30 0.00 0.00 27.48 28.56 1y2m h GLN 663 CO 0.06 0.27 0.42 0.82 -0.67 0.00 0.00 178.83 179.73 1y2m h ILE 664 N 0.42 1.10 -0.09 2.54 2.04 -1.55 -0.66 117.51 121.30 1y2m h ILE 664 Ca 0.45 -0.29 -0.21 0.00 1.00 0.00 0.00 64.86 65.82 1y2m h ILE 664 Cb 1.10 0.19 0.00 0.00 -0.74 0.00 0.00 36.82 37.38 1y2m h ILE 664 CO -0.17 0.15 -0.80 0.25 0.00 0.00 0.00 178.15 177.59 1y2m h LEU 665 N 0.84 0.71 -0.10 1.44 5.85 -1.44 -1.35 115.31 121.26 1y2m h LEU 665 Ca 0.27 -0.48 0.03 0.00 0.84 0.00 0.00 57.88 58.54 1y2m h LEU 665 Cb 0.00 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 40.79 1y2m h LEU 665 CO -0.10 1.26 -0.09 0.22 -0.34 0.00 0.00 178.44 179.39 1y2m h TYR 666 N 0.39 -0.23 -0.68 1.25 3.20 -1.11 -2.05 116.97 117.75 1y2m h TYR 666 Ca -0.05 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.77 1y2m h TYR 666 Cb 1.41 0.12 -0.03 0.00 1.54 0.00 0.00 36.73 39.76 1y2m h TYR 666 CO 0.07 -0.14 0.19 0.00 -1.64 0.00 0.00 178.16 176.64 1y2m h ALA 667 N 0.96 1.06 -0.29 1.82 0.00 -1.10 0.10 119.26 121.80 1y2m h ALA 667 Ca 0.07 -0.22 0.04 0.00 0.00 0.00 0.00 54.91 54.79 1y2m h ALA 667 Cb 0.21 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 1y2m h ALA 667 CO -0.17 0.63 0.07 0.35 0.00 0.00 0.00 179.25 180.14 1y2m h PHE 668 N 1.01 0.13 -0.04 0.00 3.57 -0.84 0.16 116.94 120.93 1y2m h PHE 668 Ca 0.22 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.69 1y2m h PHE 668 Cb 0.31 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.04 1y2m h PHE 668 CO 0.02 0.04 -0.17 0.28 -2.23 0.00 0.00 178.31 176.26 1y2m h VAL 669 N 0.19 1.47 -0.39 1.41 2.07 -1.19 -1.19 116.25 118.62 1y2m h VAL 669 Ca 0.13 -1.64 -0.16 0.00 0.82 0.00 0.00 66.70 65.86 1y2m h VAL 669 Cb 0.12 2.44 -0.01 0.00 -1.52 0.00 0.00 31.29 32.33 1y2m h VAL 669 CO -0.16 0.45 -0.37 0.03 0.02 0.00 0.00 177.57 177.55 1y2m h ARG 670 N -0.39 0.93 0.00 1.57 2.47 -0.91 -1.37 114.38 116.69 1y2m h ARG 670 Ca -0.01 -0.48 0.00 0.00 -1.26 0.00 0.00 59.98 58.23 1y2m h ARG 670 Cb 0.82 0.01 0.00 0.00 -1.65 0.00 0.00 29.97 29.15 1y2m h ARG 670 CO 0.04 1.13 -0.81 0.39 0.56 0.00 0.00 179.97 181.28 1y2m n GLU 671 N -4.06 0.44 -0.16 0.04 -0.58 0.55 -3.64 120.64 113.23 1y2m n GLU 671 Ca -0.02 0.21 -0.10 0.00 -0.42 0.00 0.00 57.16 56.83 1y2m n GLU 671 Cb 0.54 -1.32 -0.00 0.00 -0.57 0.00 0.00 31.44 30.08 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 -0.85 0.82 0.00 3.49 5.08 -1.21 -2.86 114.58 119.04 1y2m h GLU 672 Ca 0.00 -0.28 0.00 0.00 -1.00 0.00 0.00 59.36 58.08 1y2m h GLU 672 Cb 0.81 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.99 1y2m h GLU 672 CO 0.00 0.89 -0.45 1.28 -1.00 0.00 0.00 179.01 179.73 1y2m n LEU 673 N -4.35 0.72 -0.35 1.33 4.77 -0.52 -4.96 117.00 113.65 1y2m n LEU 673 Ca 0.00 0.32 -0.05 0.00 -0.03 0.00 0.00 56.01 56.25 1y2m n LEU 673 Cb 0.32 -0.22 -0.02 0.00 -2.33 0.00 0.00 43.42 41.17 1y2m n LEU 673 CO 0.42 -0.08 -0.04 0.61 -1.33 0.00 0.00 177.39 176.96 1y2m n GLY 674 N 1.34 0.72 3.57 -0.72 0.00 -0.86 -4.97 105.19 104.26 1y2m n GLY 674 Ca 0.04 -0.51 -0.43 0.00 0.00 0.00 0.00 46.02 45.12 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 -2.07 4.57 0.36 1.61 1.01 -0.57 -4.97 120.40 120.34 1y2m s VAL 675 Ca 0.00 0.73 0.04 0.00 0.00 0.00 0.00 61.98 62.75 1y2m s VAL 675 Cb 0.00 -4.36 -0.01 0.00 0.00 0.00 0.00 36.38 32.01 1y2m s VAL 675 CO 0.00 -0.71 0.53 -0.54 0.00 0.00 0.00 175.10 174.38 1y2m s LYS 676 N 3.51 3.17 0.61 2.72 -0.14 -1.26 -3.89 119.74 124.46 1y2m s LYS 676 Ca 0.34 -0.75 -0.18 0.00 -1.36 0.00 0.00 55.97 54.03 1y2m s LYS 676 Cb -0.11 -2.73 -0.05 0.00 -1.68 0.00 0.00 37.83 33.26 1y2m s LYS 676 CO 0.23 0.01 0.91 0.00 -0.76 0.00 0.00 175.35 175.74 1y2m n ALA 677 N -1.77 -0.00 -3.33 5.17 0.00 -1.26 -4.99 120.51 114.33 1y2m n ALA 677 Ca -0.01 -0.01 -0.35 0.00 0.00 0.00 0.00 53.44 53.07 1y2m n ALA 677 Cb 0.58 -2.08 -0.14 0.00 0.00 0.00 0.00 19.45 17.81 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 -2.74 3.45 0.04 0.00 3.52 -1.26 -5.02 118.95 116.94 1y2m s ARG 678 Ca 0.76 -0.60 -0.03 0.00 -0.13 0.00 0.00 55.73 55.73 1y2m s ARG 678 Cb -0.41 -2.98 -0.28 0.00 -1.56 0.00 0.00 34.95 29.73 1y2m s ARG 678 CO 0.47 -0.08 0.99 -0.09 -0.81 0.00 0.00 175.30 175.78 1y2m h ARG 679 N 7.74 0.24 0.00 5.12 2.43 -1.98 -3.39 114.38 124.54 1y2m h ARG 679 Ca -0.38 -0.41 0.00 0.00 -0.81 0.00 0.00 59.98 58.38 1y2m h ARG 679 Cb 1.17 0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.88 1y2m h ARG 679 CO 0.60 1.14 0.00 0.41 -1.51 0.00 0.00 179.97 180.61 1y2m n GLY 680 N 1.59 3.92 0.34 2.80 0.00 -1.26 -4.04 105.19 108.54 1y2m n GLY 680 Ca -0.12 -1.04 -0.01 0.00 0.00 0.00 0.00 46.02 44.85 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 0.97 -0.13 1.61 3.32 -1.91 -0.99 116.42 119.28 1y2m h ASP 681 Ca 0.00 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 56.99 1y2m h ASP 681 Cb 0.00 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 39.33 1y2m h ASP 681 CO 0.00 0.67 -0.14 0.58 -1.72 0.00 0.00 179.24 178.63 1y2m h VAL 682 N 1.13 1.35 -0.58 -1.35 2.07 -1.81 -0.85 116.25 116.21 1y2m h VAL 682 Ca 0.35 -1.31 0.11 0.00 0.82 0.00 0.00 66.70 66.67 1y2m h VAL 682 Cb -0.00 1.92 -0.08 0.00 -1.52 0.00 0.00 31.29 31.61 1y2m h VAL 682 CO -0.12 0.38 0.12 0.15 0.02 0.00 0.00 177.57 178.12 1y2m h PHE 683 N -0.06 0.18 0.00 1.57 3.57 -1.83 -2.30 116.94 118.07 1y2m h PHE 683 Ca 0.02 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.55 1y2m h PHE 683 Cb 0.67 0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.42 1y2m h PHE 683 CO 0.09 -0.03 0.00 1.28 -2.23 0.00 0.00 178.31 177.41 1y2m n LEU 684 N -5.13 0.69 -2.43 0.59 4.77 -0.40 -4.92 117.00 110.18 1y2m n LEU 684 Ca 0.08 0.59 -0.21 0.00 -0.03 0.00 0.00 56.01 56.45 1y2m n LEU 684 Cb 0.31 -0.41 -0.01 0.00 -2.33 0.00 0.00 43.42 40.98 1y2m n LEU 684 CO 0.17 -0.28 -0.26 0.61 -1.33 0.00 0.00 177.39 176.31 1y2m n GLY 685 N 0.91 -0.50 3.06 -0.72 0.00 -0.38 -4.99 105.19 102.57 1y2m n GLY 685 Ca 0.05 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.94 1y2m n GLY 685 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1y2m s LYS 686 N -5.08 0.21 -0.78 1.61 2.20 -0.85 -5.04 119.74 112.01 1y2m s LYS 686 Ca 0.02 0.37 -0.20 0.00 -0.36 0.00 0.00 55.97 55.79 1y2m s LYS 686 Cb -0.01 0.01 0.11 0.00 -1.51 0.00 0.00 37.83 36.43 1y2m s LYS 686 CO 0.02 -0.08 1.00 -0.65 -0.36 0.00 0.00 175.35 175.28 1y2m s GLN 687 N 0.58 3.34 0.77 4.03 -0.21 -1.26 -4.28 119.66 122.62 1y2m s GLN 687 Ca -0.04 -1.36 -0.11 0.00 0.02 0.00 0.00 55.36 53.87 1y2m s GLN 687 Cb -0.05 -4.56 0.05 0.00 1.00 0.00 0.00 33.01 29.45 1y2m s GLN 687 CO -0.03 -1.75 1.09 -1.21 -2.12 0.00 0.00 175.29 171.26 1y2m s GLU 688 N 3.18 2.30 0.09 2.91 2.02 -1.26 -4.93 118.70 123.01 1y2m s GLU 688 Ca 0.26 0.69 -0.34 0.00 0.02 0.00 0.00 54.97 55.61 1y2m s GLU 688 Cb -0.12 -1.94 -0.18 0.00 0.10 0.00 0.00 34.13 31.99 1y2m s GLU 688 CO 0.00 -1.48 0.79 0.28 0.02 0.00 0.00 175.26 174.87 1y2m n VAL 689 N -3.35 0.93 -1.50 2.63 0.31 -1.26 -4.79 118.33 111.29 1y2m n VAL 689 Ca 0.07 -0.23 -0.32 0.00 -0.01 0.00 0.00 64.34 63.85 1y2m n VAL 689 Cb 0.56 0.00 0.07 0.00 -0.91 0.00 0.00 33.84 33.56 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 -0.46 3.29 0.21 2.52 -4.23 -1.26 -4.91 115.64 110.80 1y2m s THR 690 Ca 0.76 0.50 -0.10 0.00 -1.18 0.00 0.00 61.69 61.67 1y2m s THR 690 Cb -1.08 -3.01 0.19 0.00 1.34 0.00 0.00 72.50 69.94 1y2m s THR 690 CO 0.55 -0.46 1.67 0.40 -0.54 0.00 0.00 174.62 176.24 1y2m h ILE 691 N -0.56 0.52 -0.83 2.99 2.04 -1.99 -2.43 117.51 117.26 1y2m h ILE 691 Ca -0.45 -0.05 -0.03 0.00 1.00 0.00 0.00 64.86 65.33 1y2m h ILE 691 Cb 1.24 0.36 -0.04 0.00 -0.74 0.00 0.00 36.82 37.64 1y2m h ILE 691 CO 0.53 0.03 0.41 1.23 0.00 0.00 0.00 178.15 180.34 1y2m h GLY 692 N 0.15 1.27 0.47 5.37 0.00 -1.99 0.40 103.07 108.75 1y2m h GLY 692 Ca 0.32 -0.62 0.11 0.00 0.00 0.00 0.00 47.33 47.15 1y2m h GLY 692 CO -0.50 0.59 0.55 1.76 0.00 0.00 0.00 176.54 178.93 1y2m h SER 693 N 1.17 0.79 -0.03 0.19 0.02 -1.81 0.12 113.55 114.00 1y2m h SER 693 Ca 0.29 0.05 -0.20 0.00 -0.84 0.00 0.00 61.79 61.08 1y2m h SER 693 Cb 0.10 -0.10 0.01 0.00 0.14 0.00 0.00 62.40 62.55 1y2m h SER 693 CO -0.04 0.43 -0.78 0.78 -1.14 0.00 0.00 176.83 176.08 1y2m h ASN 694 N 0.88 0.74 -0.98 3.07 2.35 -0.91 -2.76 115.58 117.98 1y2m h ASN 694 Ca 0.45 -0.72 0.05 0.00 -0.55 0.00 0.00 56.30 55.53 1y2m h ASN 694 Cb 0.45 -0.22 -0.06 0.00 0.05 0.00 0.00 38.32 38.53 1y2m h ASN 694 CO -0.26 1.36 0.64 0.58 -1.65 0.00 0.00 177.43 178.09 1y2m h VAL 695 N 0.19 1.12 -0.87 2.81 2.07 -0.78 -2.35 116.25 118.45 1y2m h VAL 695 Ca -0.09 -0.41 -0.01 0.00 0.82 0.00 0.00 66.70 67.02 1y2m h VAL 695 Cb 1.45 -0.16 -0.04 0.00 -1.52 0.00 0.00 31.29 31.02 1y2m h VAL 695 CO 0.16 0.22 0.50 0.28 0.02 0.00 0.00 177.57 178.75 1y2m h SER 696 N 1.18 1.05 -0.88 0.57 0.02 -0.66 -0.21 113.55 114.62 1y2m h SER 696 Ca 0.41 -0.07 0.05 0.00 -0.84 0.00 0.00 61.79 61.33 1y2m h SER 696 Cb 0.10 -0.27 -0.06 0.00 0.14 0.00 0.00 62.40 62.31 1y2m h SER 696 CO -0.14 0.82 0.56 0.11 -1.14 0.00 0.00 176.83 177.04 1y2m h LYS 697 N 1.20 1.03 -0.00 3.45 1.57 -1.13 0.21 116.57 122.91 1y2m h LYS 697 Ca 0.31 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 59.03 1y2m h LYS 697 Cb -0.02 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 32.05 1y2m h LYS 697 CO -0.06 0.68 -0.00 0.82 -0.57 0.00 0.00 179.45 180.33 1y2m h ILE 698 N 1.07 1.33 -0.63 1.86 2.04 -1.13 -2.45 117.51 119.60 1y2m h ILE 698 Ca 0.36 -0.96 0.13 0.00 1.00 0.00 0.00 64.86 65.39 1y2m h ILE 698 Cb 0.07 1.98 -0.10 0.00 -0.74 0.00 0.00 36.82 38.03 1y2m h ILE 698 CO -0.14 0.25 0.08 0.22 0.00 0.00 0.00 178.15 178.56 1y2m h TYR 699 N -0.40 0.11 -0.64 1.37 3.20 -0.93 -1.45 116.97 118.23 1y2m h TYR 699 Ca 0.00 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.91 1y2m h TYR 699 Cb 0.41 0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.70 1y2m h TYR 699 CO 0.07 -0.10 0.41 0.93 -1.64 0.00 0.00 178.16 177.83 1y2m h GLU 700 N 0.20 0.85 0.00 1.82 5.08 -0.86 0.15 114.58 121.81 1y2m h GLU 700 Ca 0.34 -0.06 -0.09 0.00 -1.00 0.00 0.00 59.36 58.55 1y2m h GLU 700 Cb 0.54 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 1y2m h GLU 700 CO -0.48 0.57 -0.45 0.00 -1.00 0.00 0.00 179.01 177.65 1y2m h ALA 701 N 1.58 1.03 0.05 3.43 0.00 -0.83 -1.08 119.26 123.44 1y2m h ALA 701 Ca 0.23 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 1y2m h ALA 701 Cb -0.08 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.64 1y2m h ALA 701 CO -0.05 0.56 -0.02 0.82 0.00 0.00 0.00 179.25 180.56 1y2m h ILE 702 N 0.00 1.32 -0.53 0.00 2.04 -0.30 -1.32 117.51 118.71 1y2m h ILE 702 Ca -0.00 -1.44 -0.01 0.00 1.00 0.00 0.00 64.86 64.40 1y2m h ILE 702 Cb 0.93 2.23 -0.03 0.00 -0.74 0.00 0.00 36.82 39.21 1y2m h ILE 702 CO 0.06 0.35 0.27 0.11 0.00 0.00 0.00 178.15 178.94 1y2m h LYS 703 N -0.73 0.74 0.00 2.37 1.79 -0.90 -2.14 116.57 117.70 1y2m h LYS 703 Ca -0.01 -0.08 0.00 0.00 -2.18 0.00 0.00 60.65 58.38 1y2m h LYS 703 Cb 0.62 -0.15 0.00 0.00 -1.58 0.00 0.00 32.23 31.12 1y2m h LYS 703 CO 0.01 0.56 0.00 0.66 -1.08 0.00 0.00 179.45 179.60 1y2m h SER 704 N 0.74 0.00 0.00 0.86 4.64 -1.33 -3.47 113.55 114.99 1y2m h SER 704 Ca 0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 1y2m h SER 704 Cb 0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 1y2m h SER 704 CO -0.03 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.54 1y2m n GLY 705 N 1.01 0.84 0.36 -0.77 0.00 -0.81 -4.91 105.19 100.91 1y2m n GLY 705 Ca 0.05 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.15 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 3.09 0.70 0.00 1.61 2.43 -1.61 -0.00 114.38 120.60 1y2m h ARG 706 Ca 0.00 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1y2m h ARG 706 Cb 0.00 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.39 1y2m h ARG 706 CO 0.00 0.47 0.00 0.97 -1.51 0.00 0.00 179.97 179.90 1y2m h ILE 707 N 0.72 0.00 -0.17 1.20 2.10 -1.58 -3.36 117.51 116.43 1y2m h ILE 707 Ca 0.35 -0.30 -0.00 0.00 1.08 0.00 0.00 64.86 65.99 1y2m h ILE 707 Cb 0.39 1.15 -0.01 0.00 -1.09 0.00 0.00 36.82 37.27 1y2m h ILE 707 CO -0.13 0.00 0.10 0.78 -1.08 0.00 0.00 178.15 177.82 1y2m h ASN 708 N 0.00 0.21 0.56 2.19 2.35 -1.27 -0.98 115.58 118.64 1y2m h ASN 708 Ca 0.00 -0.07 -0.02 0.00 -0.55 0.00 0.00 56.30 55.66 1y2m h ASN 708 Cb 0.34 -0.05 -0.00 0.00 0.05 0.00 0.00 38.32 38.65 1y2m h ASN 708 CO 0.00 0.22 -0.11 0.78 -1.65 0.00 0.00 177.43 176.67 1y2m h ASN 709 N 0.19 0.00 -0.13 5.81 2.35 -1.75 -1.14 115.58 120.90 1y2m h ASN 709 Ca 0.06 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.76 1y2m h ASN 709 Cb 0.05 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.42 1y2m h ASN 709 CO -0.01 0.11 -0.13 0.58 -1.65 0.00 0.00 177.43 176.33 1y2m h VAL 710 N 0.00 1.35 -0.63 2.81 2.07 -1.43 -0.73 116.25 119.69 1y2m h VAL 710 Ca -0.00 -1.29 0.02 0.00 0.82 0.00 0.00 66.70 66.24 1y2m h VAL 710 Cb 0.42 1.90 -0.04 0.00 -1.52 0.00 0.00 31.29 32.05 1y2m h VAL 710 CO 0.01 0.38 0.40 -0.07 0.02 0.00 0.00 177.57 178.32 1y2m h LEU 711 N -0.05 0.68 -0.44 2.57 3.38 -0.78 -2.70 115.31 117.98 1y2m h LEU 711 Ca 0.02 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1y2m h LEU 711 Cb 0.66 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 1y2m h LEU 711 CO 0.03 0.48 0.21 0.25 0.09 0.00 0.00 178.44 179.50 1y2m h LEU 712 N 0.81 0.57 -1.85 1.67 5.85 -1.14 -2.50 115.31 118.72 1y2m h LEU 712 Ca 0.24 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.84 1y2m h LEU 712 Cb -0.03 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 40.85 1y2m h LEU 712 CO -0.08 0.54 0.00 0.29 -0.34 0.00 0.00 178.44 178.85 1y2m n LYS 713 N -4.66 0.00 0.00 1.25 5.02 -0.29 -1.99 118.16 117.49 1y2m n LYS 713 Ca 0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.30 1y2m n LYS 713 Cb 0.11 -1.26 0.00 0.00 -0.02 0.00 0.00 35.03 33.86 1y2m n LYS 713 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1y2m n LEU 715 N 0.81 0.00 0.00 -0.35 4.77 -0.94 -5.09 117.00 116.19 1y2m n LEU 715 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1y2m n LEU 715 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1y2m n LEU 715 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.06