#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d3m h PRO 2 N 0.00 0.12 -4.39 1.61 0.11 -1.83 -3.46 132.00 124.15 2d3m h PRO 2 Ca 0.00 -0.02 -0.25 0.00 0.11 0.00 0.00 66.00 65.84 2d3m h PRO 2 Cb 0.00 -0.02 0.11 0.00 0.11 0.00 0.00 31.00 31.20 2d3m h PRO 2 CO 0.00 0.25 -0.49 0.41 -0.21 0.00 0.00 178.00 177.96 2d3m n GLY 3 N -1.04 -0.09 0.36 -0.55 0.00 -1.26 -4.81 105.19 97.81 2d3m n GLY 3 Ca -0.02 -0.06 0.03 0.00 0.00 0.00 0.00 46.02 45.97 2d3m n GLY 3 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2d3m h MET 4 N -1.59 1.03 -0.01 1.61 2.86 -1.94 -2.68 114.93 114.21 2d3m h MET 4 Ca -0.40 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.18 2d3m h MET 4 Cb 1.24 -0.23 0.00 0.00 0.06 0.00 0.00 31.60 32.67 2d3m h MET 4 CO 0.36 0.68 -0.13 -1.13 1.06 0.00 0.00 176.91 177.75 2d3m n SER 5 N -4.47 1.61 -4.78 1.22 3.41 -1.26 -4.76 113.62 104.59 2d3m n SER 5 Ca 0.13 -1.37 -0.35 0.00 -0.26 0.00 0.00 58.87 57.01 2d3m n SER 5 Cb 0.16 0.09 -0.02 0.00 -0.26 0.00 0.00 64.21 64.18 2d3m n SER 5 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2d3m s SER 6 N -2.21 6.23 0.24 4.04 0.01 -1.01 -4.96 113.70 116.03 2d3m s SER 6 Ca 0.30 2.06 -0.05 0.00 1.31 0.00 0.00 55.95 59.58 2d3m s SER 6 Cb 0.20 -2.58 0.25 0.00 0.21 0.00 0.00 66.02 64.10 2d3m s SER 6 CO 0.41 -0.87 1.75 0.25 0.41 0.00 0.00 173.24 175.20 2d3m h LEU 7 N 1.69 0.91 -1.99 2.44 5.85 -1.93 -2.38 115.31 119.91 2d3m h LEU 7 Ca -0.49 -0.20 -0.00 0.00 0.84 0.00 0.00 57.88 58.02 2d3m h LEU 7 Cb 1.23 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 42.02 2d3m h LEU 7 CO 0.59 0.92 -0.02 0.77 -0.34 0.00 0.00 178.44 180.36 2d3m h SER 8 N 0.91 0.00 -0.29 1.25 4.64 -1.94 -2.39 113.55 115.74 2d3m h SER 8 Ca 0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 2d3m h SER 8 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 2d3m h SER 8 CO 0.01 0.02 0.00 0.59 -0.87 0.00 0.00 176.83 176.58 2d3m n ASN 9 N -3.14 2.77 -4.78 4.97 3.02 -1.10 -4.93 115.26 112.07 2d3m n ASN 9 Ca -0.01 -1.88 -0.35 0.00 -0.03 0.00 0.00 54.58 52.32 2d3m n ASN 9 Cb 0.23 -0.19 -0.00 0.00 -0.61 0.00 0.00 39.78 39.20 2d3m n ASN 9 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2d3m s SER 10 N -1.01 5.83 0.45 6.41 1.04 -0.90 -4.65 113.70 120.87 2d3m s SER 10 Ca 0.23 2.11 -0.23 0.00 0.48 0.00 0.00 55.95 58.54 2d3m s SER 10 Cb 0.13 -2.57 -0.08 0.00 0.10 0.00 0.00 66.02 63.59 2d3m s SER 10 CO 0.17 -1.14 1.14 -0.76 0.98 0.00 0.00 173.24 173.63 2d3m s LEU 11 N -3.78 4.03 0.44 2.42 1.43 -1.26 -4.74 118.68 117.23 2d3m s LEU 11 Ca 0.71 2.24 -0.23 0.00 -1.03 0.00 0.00 54.13 55.82 2d3m s LEU 11 Cb -0.22 -4.24 -0.08 0.00 0.03 0.00 0.00 46.19 41.69 2d3m s LEU 11 CO 0.26 -0.83 1.13 -2.16 0.23 0.00 0.00 176.35 174.99 2d3m s PRO 12 N -2.67 3.87 0.29 1.29 0.04 -1.26 -4.94 135.00 131.62 2d3m s PRO 12 Ca 0.62 1.70 0.07 0.00 0.04 0.00 0.00 61.00 63.44 2d3m s PRO 12 Cb -0.27 -2.44 0.43 0.00 0.04 0.00 0.00 34.50 32.26 2d3m s PRO 12 CO 0.33 -0.44 1.68 -0.07 0.04 0.00 0.00 177.00 178.53 2d3m h LEU 13 N 2.17 0.20-10.09 -3.56 3.38 -1.99 -3.43 115.31 101.98 2d3m h LEU 13 Ca -0.49 -0.09 -0.52 0.00 0.09 0.00 0.00 57.88 56.87 2d3m h LEU 13 Cb 1.24 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.92 2d3m h LEU 13 CO 0.61 0.64 -0.28 0.00 0.09 0.00 0.00 178.44 179.50 2d3m s MET 14 N -4.01 3.54 0.00 1.13 0.23 -1.26 -4.96 119.30 113.97 2d3m s MET 14 Ca -0.04 -0.26 -0.02 0.00 -1.03 0.00 0.00 55.69 54.34 2d3m s MET 14 Cb 0.13 -2.78 -0.09 0.00 -1.53 0.00 0.00 34.83 30.57 2d3m s MET 14 CO 0.77 0.33 1.57 -0.85 -2.03 0.00 0.00 175.02 174.82 2d3m n GLU 15 N -0.84 0.72 -2.36 3.16 0.28 -1.26 -4.87 120.64 115.47 2d3m n GLU 15 Ca -0.04 -0.33 -0.43 0.00 -0.16 0.00 0.00 57.16 56.20 2d3m n GLU 15 Cb 0.54 -1.63 -0.02 0.00 1.43 0.00 0.00 31.44 31.75 2d3m n GLU 15 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 2d3m s ASP 16 N 2.51 6.35 0.14 -1.84 2.15 -1.26 -4.93 116.67 119.79 2d3m s ASP 16 Ca 0.22 0.81 -0.19 0.00 0.43 0.00 0.00 52.55 53.83 2d3m s ASP 16 Cb 0.11 -2.54 0.02 0.00 -0.30 0.00 0.00 42.92 40.20 2d3m s ASP 16 CO 0.00 -1.43 1.70 0.58 -0.17 0.00 0.00 175.17 175.86 2d3m h VAL 17 N 6.46 0.77 -0.09 1.11 2.07 -1.99 -0.08 116.25 124.49 2d3m h VAL 17 Ca -0.27 -0.01 -0.12 0.00 0.82 0.00 0.00 66.70 67.11 2d3m h VAL 17 Cb 1.10 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 31.58 2d3m h VAL 17 CO 1.09 0.01 -0.49 -0.61 0.02 0.00 0.00 177.57 177.58 2d3m h GLN 18 N 0.04 0.22 -0.58 1.57 5.75 -1.99 -1.75 115.11 118.37 2d3m h GLN 18 Ca 0.13 -0.13 -0.10 0.00 -0.15 0.00 0.00 58.65 58.40 2d3m h GLN 18 Cb 0.18 0.01 -0.02 0.00 1.07 0.00 0.00 27.48 28.72 2d3m h GLN 18 CO -0.25 0.67 -0.05 0.78 -2.65 0.00 0.00 178.83 177.34 2d3m h GLY 19 N 1.34 1.14 0.95 2.39 0.00 -1.86 -1.10 103.07 105.93 2d3m h GLY 19 Ca 0.01 -0.87 -0.03 0.00 0.00 0.00 0.00 47.33 46.44 2d3m h GLY 19 CO 0.08 0.80 0.13 -2.22 0.00 0.00 0.00 176.54 175.33 2d3m h ILE 20 N 0.95 1.22 -0.68 2.60 2.04 -0.82 -2.30 117.51 120.52 2d3m h ILE 20 Ca 0.16 -0.73 -0.01 0.00 1.00 0.00 0.00 64.86 65.28 2d3m h ILE 20 Cb 0.61 0.88 -0.03 0.00 -0.74 0.00 0.00 36.82 37.54 2d3m h ILE 20 CO 0.04 0.26 0.40 -0.09 0.00 0.00 0.00 178.15 178.76 2d3m h ARG 21 N 0.56 0.92 -0.77 2.37 9.65 -1.02 0.23 114.38 126.33 2d3m h ARG 21 Ca 0.14 -0.09 -0.05 0.00 -1.10 0.00 0.00 59.98 58.88 2d3m h ARG 21 Cb 0.26 -0.19 -0.03 0.00 -1.39 0.00 0.00 29.97 28.62 2d3m h ARG 21 CO -0.00 0.67 0.28 -0.22 2.80 0.00 0.00 179.97 183.49 2d3m h LYS 22 N 0.92 1.18 -0.04 0.20 3.64 -1.07 -1.53 116.57 119.86 2d3m h LYS 22 Ca 0.24 -0.23 -0.23 0.00 -1.27 0.00 0.00 60.65 59.16 2d3m h LYS 22 Cb -0.01 -0.18 0.01 0.00 -0.41 0.00 0.00 32.23 31.64 2d3m h LYS 22 CO -0.04 0.97 -0.90 0.00 -2.27 0.00 0.00 179.45 177.21 2d3m h ALA 23 N 1.15 0.32 -0.23 5.00 0.00 -1.07 -3.33 119.26 121.10 2d3m h ALA 23 Ca 0.25 -0.67 -0.15 0.00 0.00 0.00 0.00 54.91 54.34 2d3m h ALA 23 Cb 0.26 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2d3m h ALA 23 CO -0.01 0.74 -0.49 0.37 0.00 0.00 0.00 179.25 179.86 2d3m h GLN 24 N 0.35 0.61 -7.17 0.00 4.15 -0.30 -3.44 115.11 109.32 2d3m h GLN 24 Ca -0.08 -0.36 -0.49 0.00 0.77 0.00 0.00 58.65 58.50 2d3m h GLN 24 Cb 1.53 0.03 0.05 0.00 0.21 0.00 0.00 27.48 29.30 2d3m h GLN 24 CO 0.17 0.97 0.38 -1.59 -1.93 0.00 0.00 178.83 176.82 2d3m s LYS 25 N -4.11 3.49 0.68 1.69 -2.85 -0.60 0.43 119.74 118.47 2d3m s LYS 25 Ca -0.08 1.22 -0.06 0.00 -1.00 0.00 0.00 55.97 56.05 2d3m s LYS 25 Cb 0.11 -2.06 0.05 0.00 -2.06 0.00 0.00 37.83 33.88 2d3m s LYS 25 CO 0.84 -0.67 0.99 0.00 0.10 0.00 0.00 175.35 176.61 2d3m s ALA 26 N -2.35 3.20 -0.20 0.59 0.00 -0.81 -4.01 121.76 118.18 2d3m s ALA 26 Ca 0.64 -0.88 -0.17 0.00 0.00 0.00 0.00 51.96 51.55 2d3m s ALA 26 Cb -0.16 -2.60 -0.12 0.00 0.00 0.00 0.00 23.12 20.24 2d3m s ALA 26 CO 0.32 -1.19 -0.04 -0.25 0.00 0.00 0.00 175.76 174.61 2d3m n ASP 27 N -2.84 1.87 -2.67 0.00 8.00 -1.26 -4.87 116.55 114.78 2d3m n ASP 27 Ca 0.07 0.46 -0.06 0.00 0.71 0.00 0.00 54.79 55.97 2d3m n ASP 27 Cb 0.60 -0.90 0.03 0.00 -0.02 0.00 0.00 41.12 40.83 2d3m n ASP 27 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2d3m n GLY 28 N 1.45 1.01 3.76 0.44 0.00 -1.26 -5.03 105.19 105.56 2d3m n GLY 28 Ca -0.28 -2.02 -0.40 0.00 0.00 0.00 0.00 46.02 43.33 2d3m n GLY 28 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2d3m s THR 29 N -0.45 3.94 0.14 2.61 2.01 -1.26 -4.63 115.64 118.01 2d3m s THR 29 Ca 0.17 1.89 -0.31 0.00 0.31 0.00 0.00 61.69 63.74 2d3m s THR 29 Cb -0.01 -4.18 -0.11 0.00 0.01 0.00 0.00 72.50 68.21 2d3m s THR 29 CO 0.11 0.40 1.83 0.00 -0.69 0.00 0.00 174.62 176.27 2d3m n ALA 30 N 1.24 2.40 -3.01 7.40 0.00 -1.26 -4.32 120.51 122.96 2d3m n ALA 30 Ca -0.01 0.33 -0.27 0.00 0.00 0.00 0.00 53.44 53.49 2d3m n ALA 30 Cb 0.47 -2.59 -0.16 0.00 0.00 0.00 0.00 19.45 17.17 2d3m n ALA 30 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2d3m s THR 31 N 2.44 1.47 -0.11 0.00 2.01 0.44 -0.15 115.64 121.74 2d3m s THR 31 Ca 0.80 -0.72 -0.30 0.00 0.31 0.00 0.00 61.69 61.79 2d3m s THR 31 Cb -0.47 -1.27 -0.02 0.00 0.01 0.00 0.00 72.50 70.74 2d3m s THR 31 CO 0.36 0.42 1.25 -0.69 -0.69 0.00 0.00 174.62 175.27 2d3m s VAL 32 N 0.15 4.24 0.00 3.82 1.01 0.59 -1.33 120.40 128.88 2d3m s VAL 32 Ca -0.07 1.53 0.00 0.00 0.00 0.00 0.00 61.98 63.45 2d3m s VAL 32 Cb -0.13 -3.99 0.00 0.00 0.00 0.00 0.00 36.38 32.26 2d3m s VAL 32 CO 0.03 -0.07 0.41 1.15 0.00 0.00 0.00 175.10 176.62 2d3m n MET 33 N 5.95 -0.79 -3.64 2.72 3.85 0.23 -0.75 117.12 124.70 2d3m n MET 33 Ca 0.13 -0.41 -0.09 0.00 -1.00 0.00 0.00 57.70 56.32 2d3m n MET 33 Cb 0.45 -0.90 -0.07 0.00 -1.05 0.00 0.00 33.22 31.65 2d3m n MET 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2d3m s ALA 34 N -0.00 -1.96 -0.05 3.17 0.00 -1.21 -4.27 121.76 117.44 2d3m s ALA 34 Ca 0.00 1.94 -0.00 0.00 0.00 0.00 0.00 51.96 53.90 2d3m s ALA 34 Cb 0.00 -1.42 0.03 0.00 0.00 0.00 0.00 23.12 21.73 2d3m s ALA 34 CO 0.00 -0.27 0.00 0.42 0.00 0.00 0.00 175.76 175.92 2d3m s ILE 35 N 0.38 0.27 0.00 0.00 1.01 -1.26 -1.36 121.20 120.23 2d3m s ILE 35 Ca 0.01 0.12 0.06 0.00 0.00 0.00 0.00 60.65 60.84 2d3m s ILE 35 Cb -0.05 -0.40 -0.02 0.00 0.01 0.00 0.00 42.46 42.01 2d3m s ILE 35 CO -0.06 0.20 -0.20 -0.83 0.00 0.00 0.00 174.94 174.06 2d3m s GLY 36 N 1.52 1.00 0.10 6.18 0.00 0.71 -4.67 107.32 112.16 2d3m s GLY 36 Ca -0.02 -0.90 0.05 0.00 0.00 0.00 0.00 44.72 43.85 2d3m s GLY 36 CO -0.03 -0.78 -0.13 -0.51 0.00 0.00 0.00 173.10 171.65 2d3m s THR 37 N -0.55 1.16 0.05 0.90 -4.23 -1.26 0.25 115.64 111.95 2d3m s THR 37 Ca 0.07 -1.53 -0.14 0.00 -1.18 0.00 0.00 61.69 58.91 2d3m s THR 37 Cb -0.08 -1.31 0.02 0.00 1.34 0.00 0.00 72.50 72.48 2d3m s THR 37 CO -0.00 -0.37 0.32 0.00 -0.54 0.00 0.00 174.62 174.03 2d3m s ALA 38 N -1.85 -0.74 0.04 3.99 0.00 -0.01 -4.67 121.76 118.52 2d3m s ALA 38 Ca 0.04 0.05 -0.11 0.00 0.00 0.00 0.00 51.96 51.94 2d3m s ALA 38 Cb -0.07 0.33 0.01 0.00 0.00 0.00 0.00 23.12 23.40 2d3m s ALA 38 CO 0.02 -0.43 0.23 -3.38 0.00 0.00 0.00 175.76 172.20 2d3m s HIS 39 N -2.57 0.01 0.77 0.00 -3.43 -1.26 -0.15 115.29 108.65 2d3m s HIS 39 Ca -0.05 -0.20 -0.11 0.00 -0.80 0.00 0.00 55.06 53.90 2d3m s HIS 39 Cb -0.01 0.01 0.05 0.00 -1.43 0.00 0.00 32.58 31.20 2d3m s HIS 39 CO -0.03 -0.45 1.08 -2.14 -2.00 0.00 0.00 174.74 171.20 2d3m s PRO 40 N -2.53 2.33 0.48 -0.38 0.02 -1.26 -4.99 135.00 128.67 2d3m s PRO 40 Ca -0.05 1.01 0.25 0.00 0.02 0.00 0.00 61.00 62.23 2d3m s PRO 40 Cb -0.01 -1.92 1.18 0.00 0.02 0.00 0.00 34.50 33.77 2d3m s PRO 40 CO -0.04 -1.55 1.95 -1.00 -0.33 0.00 0.00 177.00 176.04 2d3m h PRO 41 N -1.05 0.00 -6.62 5.54 0.13 -1.96 -3.40 132.00 124.63 2d3m h PRO 41 Ca -0.45 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.12 2d3m h PRO 41 Cb 1.23 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.30 2d3m h PRO 41 CO 0.54 0.18 0.99 -1.01 -0.23 0.00 0.00 178.00 178.48 2d3m s HIS 42 N -3.93 2.62 -0.13 1.56 3.76 -1.12 -4.94 115.29 113.11 2d3m s HIS 42 Ca -0.01 0.65 -0.27 0.00 -0.15 0.00 0.00 55.06 55.27 2d3m s HIS 42 Cb 0.12 -4.41 -0.01 0.00 1.11 0.00 0.00 32.58 29.38 2d3m s HIS 42 CO 0.61 -1.58 0.92 0.42 -0.85 0.00 0.00 174.74 174.26 2d3m s ILE 43 N 4.95 4.83 -0.44 0.60 1.01 -1.26 -1.40 121.20 129.49 2d3m s ILE 43 Ca 0.52 1.84 0.04 0.00 0.00 0.00 0.00 60.65 63.05 2d3m s ILE 43 Cb -0.09 -4.23 0.12 0.00 0.01 0.00 0.00 42.46 38.27 2d3m s ILE 43 CO 0.31 0.02 0.17 -0.36 0.00 0.00 0.00 174.94 175.08 2d3m s PHE 44 N 2.03 3.46 0.34 3.97 2.99 0.25 -5.00 117.98 126.02 2d3m s PHE 44 Ca 0.43 -3.07 -0.29 0.00 0.00 0.00 0.00 56.93 54.01 2d3m s PHE 44 Cb -0.17 -2.89 -0.10 0.00 0.00 0.00 0.00 43.02 39.85 2d3m s PHE 44 CO 0.15 -0.84 1.33 -1.25 -0.00 0.00 0.00 175.22 174.61 2d3m s PRO 45 N 0.28 4.33 0.41 0.24 0.04 -1.26 -2.01 135.00 137.03 2d3m s PRO 45 Ca 0.14 2.26 0.17 0.00 0.04 0.00 0.00 61.00 63.61 2d3m s PRO 45 Cb -0.23 -3.06 0.90 0.00 0.04 0.00 0.00 34.50 32.15 2d3m s PRO 45 CO -0.04 -0.23 1.88 0.37 0.04 0.00 0.00 177.00 179.03 2d3m h GLN 46 N 3.35 0.00 0.00 4.56 5.75 -1.11 -2.65 115.11 125.01 2d3m h GLN 46 Ca -0.49 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.01 2d3m h GLN 46 Cb 1.23 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.78 2d3m h GLN 46 CO 0.65 0.30 0.00 0.38 -2.65 0.00 0.00 178.83 177.51 2d3m h ASP 47 N 0.00 0.00 -0.07 -0.69 2.03 -1.88 -2.52 116.42 113.30 2d3m h ASP 47 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 2d3m h ASP 47 Cb 0.59 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.09 2d3m h ASP 47 CO 0.04 0.00 0.00 0.35 -1.03 0.00 0.00 179.24 178.60 2d3m n THR 48 N -2.96 0.59 -0.32 1.15 -2.24 -1.16 -4.75 114.28 104.58 2d3m n THR 48 Ca -0.00 -0.79 -0.04 0.00 -2.27 0.00 0.00 64.05 60.95 2d3m n THR 48 Cb 0.24 0.74 0.08 0.00 -2.10 0.00 0.00 70.33 69.28 2d3m n THR 48 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 2d3m h TYR 49 N 0.67 1.17 -0.85 4.78 3.20 -1.08 -1.02 116.97 123.83 2d3m h TYR 49 Ca 0.00 -0.02 0.02 0.00 3.14 0.00 0.00 58.73 61.87 2d3m h TYR 49 Cb 0.40 -0.38 -0.04 0.00 1.54 0.00 0.00 36.73 38.25 2d3m h TYR 49 CO 0.04 0.80 0.56 0.00 -1.64 0.00 0.00 178.16 177.92 2d3m h ALA 50 N 1.27 1.42 -0.04 1.82 0.00 -1.86 0.15 119.26 122.03 2d3m h ALA 50 Ca 0.31 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 2d3m h ALA 50 Cb -0.00 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.46 2d3m h ALA 50 CO -0.05 0.52 -0.05 -0.44 0.00 0.00 0.00 179.25 179.22 2d3m h ASP 51 N 1.12 0.12 -0.23 0.00 3.45 -1.79 -2.51 116.42 116.57 2d3m h ASP 51 Ca 0.32 -0.52 -0.02 0.00 0.43 0.00 0.00 57.03 57.24 2d3m h ASP 51 Cb -0.07 -0.03 -0.01 0.00 -0.56 0.00 0.00 39.33 38.65 2d3m h ASP 51 CO -0.08 0.61 0.06 0.58 -1.57 0.00 0.00 179.24 178.85 2d3m h VAL 52 N -0.38 1.20 -0.24 -1.35 2.07 -0.92 -2.37 116.25 114.27 2d3m h VAL 52 Ca 0.00 -0.65 -0.03 0.00 0.82 0.00 0.00 66.70 66.85 2d3m h VAL 52 Cb 0.59 1.19 -0.01 0.00 -1.52 0.00 0.00 31.29 31.54 2d3m h VAL 52 CO 0.01 0.21 0.03 0.22 0.02 0.00 0.00 177.57 178.06 2d3m h TYR 53 N 0.20 0.43 0.00 1.57 3.20 -0.80 -0.56 116.97 121.01 2d3m h TYR 53 Ca 0.07 -0.06 -0.08 0.00 3.14 0.00 0.00 58.73 61.80 2d3m h TYR 53 Cb 0.26 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.40 2d3m h TYR 53 CO 0.01 0.53 -0.36 0.74 -1.64 0.00 0.00 178.16 177.43 2d3m h PHE 54 N 0.20 0.00 0.13 -3.82 -1.00 -1.48 -1.87 116.94 109.10 2d3m h PHE 54 Ca 0.07 0.00 -0.23 0.00 2.81 0.00 0.00 57.97 60.62 2d3m h PHE 54 Cb 0.34 0.00 0.02 0.00 3.61 0.00 0.00 35.95 39.92 2d3m h PHE 54 CO 0.02 0.36 -0.97 -0.09 -1.61 0.00 0.00 178.31 176.02 2d3m h ARG 55 N 0.00 0.44 0.00 1.51 2.43 -1.35 0.70 114.38 118.11 2d3m h ARG 55 Ca -0.00 -0.64 -0.04 0.00 -0.81 0.00 0.00 59.98 58.49 2d3m h ARG 55 Cb 0.74 0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 30.51 2d3m h ARG 55 CO 0.05 1.28 -0.19 0.00 -1.51 0.00 0.00 179.97 179.60 2d3m h ALA 56 N 0.19 1.10 -0.45 2.80 0.00 -1.01 -3.11 119.26 118.77 2d3m h ALA 56 Ca -0.16 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.58 2d3m h ALA 56 Cb 1.72 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.48 2d3m h ALA 56 CO 0.19 0.23 0.00 0.25 0.00 0.00 0.00 179.25 179.92 2d3m n THR 57 N -3.46 1.78 -3.87 0.00 -2.24 -0.71 -4.86 114.28 100.94 2d3m n THR 57 Ca -0.01 -1.35 -0.27 0.00 -2.27 0.00 0.00 64.05 60.15 2d3m n THR 57 Cb 0.36 0.10 0.02 0.00 -2.10 0.00 0.00 70.33 68.71 2d3m n THR 57 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2d3m n ASN 58 N 0.47 -3.16 0.00 3.42 5.15 -1.15 -4.79 115.26 115.20 2d3m n ASN 58 Ca 0.21 -0.82 0.00 0.00 -0.60 0.00 0.00 54.58 53.36 2d3m n ASN 58 Cb 0.78 -3.81 0.00 0.00 -0.53 0.00 0.00 39.78 36.22 2d3m n ASN 58 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 2d3m n SER 59 N -2.91 1.27 0.00 1.20 7.64 0.20 -4.76 113.62 116.27 2d3m n SER 59 Ca -0.10 -1.58 0.03 0.00 1.01 0.00 0.00 58.87 58.24 2d3m n SER 59 Cb 0.59 0.00 0.15 0.00 -1.01 0.00 0.00 64.21 63.94 2d3m n SER 59 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 2d3m n GLU 60 N -0.29 0.02 0.18 1.43 2.13 -0.96 -1.50 120.64 121.65 2d3m n GLU 60 Ca 0.00 0.34 0.06 0.00 0.66 0.00 0.00 57.16 58.23 2d3m n GLU 60 Cb 0.28 -1.50 0.15 0.00 0.27 0.00 0.00 31.44 30.64 2d3m n GLU 60 CO 0.00 0.00 0.00 1.12 -0.41 0.00 0.00 177.13 177.84 2d3m h HIS 61 N 0.00 0.00 -1.39 4.31 2.07 -1.89 -3.37 115.15 114.88 2d3m h HIS 61 Ca 0.00 0.00 -0.72 0.00 -2.85 0.00 0.00 60.37 56.80 2d3m h HIS 61 Cb 0.11 0.00 -0.12 0.00 2.57 0.00 0.00 27.41 29.96 2d3m h HIS 61 CO 0.00 0.33 1.92 1.63 -3.07 0.00 0.00 177.93 178.73 2d3m n LYS 62 N -3.22 3.28 -0.09 5.12 5.02 -0.56 -4.83 118.16 122.88 2d3m n LYS 62 Ca 0.02 -3.49 -0.06 0.00 -2.02 0.00 0.00 58.31 52.76 2d3m n LYS 62 Cb 0.63 -3.23 0.01 0.00 -0.02 0.00 0.00 35.03 32.42 2d3m n LYS 62 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2d3m h VAL 63 N 4.85 0.85 0.00 -0.18 2.07 -1.84 -1.96 116.25 120.04 2d3m h VAL 63 Ca 0.40 -0.07 -0.07 0.00 0.82 0.00 0.00 66.70 67.78 2d3m h VAL 63 Cb 0.82 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 2d3m h VAL 63 CO 1.43 0.03 -0.35 -0.33 0.02 0.00 0.00 177.57 178.37 2d3m h GLU 64 N 0.19 0.00 0.01 1.57 4.39 -1.96 -2.13 114.58 116.65 2d3m h GLU 64 Ca 0.15 0.00 -0.20 0.00 0.34 0.00 0.00 59.36 59.65 2d3m h GLU 64 Cb 0.16 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.79 2d3m h GLU 64 CO -0.20 0.35 -0.95 1.25 -1.16 0.00 0.00 179.01 178.30 2d3m h LEU 65 N 0.00 0.08 -0.29 1.33 5.85 -1.93 -2.88 115.31 117.47 2d3m h LEU 65 Ca -0.00 -0.07 -0.18 0.00 0.84 0.00 0.00 57.88 58.46 2d3m h LEU 65 Cb 0.68 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.69 2d3m h LEU 65 CO 0.05 0.98 -0.53 0.50 -0.34 0.00 0.00 178.44 179.10 2d3m h LYS 66 N 0.02 0.87 -0.07 1.25 3.64 -1.01 -0.86 116.57 120.40 2d3m h LYS 66 Ca -0.03 -0.55 -0.08 0.00 -1.27 0.00 0.00 60.65 58.73 2d3m h LYS 66 Cb 1.66 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 33.53 2d3m h LYS 66 CO 0.13 1.18 -0.31 0.87 -2.27 0.00 0.00 179.45 179.06 2d3m h LYS 67 N 0.65 0.14 0.03 1.90 6.56 -1.44 0.70 116.57 125.10 2d3m h LYS 67 Ca 0.01 -0.05 -0.26 0.00 -1.06 0.00 0.00 60.65 59.30 2d3m h LYS 67 Cb 1.14 -0.01 0.01 0.00 -0.57 0.00 0.00 32.23 32.81 2d3m h LYS 67 CO 0.12 0.44 -1.05 -0.22 -2.06 0.00 0.00 179.45 176.68 2d3m h LYS 68 N 0.12 0.55 -0.01 3.15 3.64 -1.38 -3.11 116.57 119.54 2d3m h LYS 68 Ca 0.02 -0.62 -0.19 0.00 -1.27 0.00 0.00 60.65 58.59 2d3m h LYS 68 Cb 0.61 0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 32.60 2d3m h LYS 68 CO 0.04 1.24 -0.83 0.35 -2.27 0.00 0.00 179.45 177.99 2d3m h PHE 69 N 0.29 0.26 -0.08 1.91 3.57 -0.81 -2.84 116.94 119.24 2d3m h PHE 69 Ca -0.12 -0.13 -0.08 0.00 3.53 0.00 0.00 57.97 61.17 2d3m h PHE 69 Cb 1.70 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 40.40 2d3m h PHE 69 CO 0.08 0.92 -0.31 0.22 -2.23 0.00 0.00 178.31 177.00 2d3m h ASP 70 N 0.10 0.15 -0.23 0.41 -0.00 -0.92 -1.40 116.42 114.53 2d3m h ASP 70 Ca -0.03 -0.05 -0.20 0.00 -0.00 0.00 0.00 57.03 56.75 2d3m h ASP 70 Cb 1.44 -0.04 0.01 0.00 -0.00 0.00 0.00 39.33 40.73 2d3m h ASP 70 CO 0.12 0.46 -0.64 -0.74 -0.00 0.00 0.00 179.24 178.44 2d3m h HIS 71 N 0.13 1.08 -0.60 0.28 2.76 -1.47 -2.71 115.15 114.62 2d3m h HIS 71 Ca 0.02 -0.43 -0.07 0.00 -2.20 0.00 0.00 60.37 57.69 2d3m h HIS 71 Cb 0.62 -0.19 -0.02 0.00 1.55 0.00 0.00 27.41 29.37 2d3m h HIS 71 CO 0.01 1.26 0.10 0.82 -1.30 0.00 0.00 177.93 178.81 2d3m h ILE 72 N 0.60 1.26 -0.09 6.26 2.04 -1.24 -2.68 117.51 123.65 2d3m h ILE 72 Ca -0.02 -1.00 -0.06 0.00 1.00 0.00 0.00 64.86 64.79 2d3m h ILE 72 Cb 1.26 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 38.07 2d3m h ILE 72 CO 0.14 0.37 -0.22 0.00 0.00 0.00 0.00 178.15 178.44 2d3m h LYS 74 N 0.14 0.00 -0.01 0.00 1.57 -1.25 -3.21 116.57 113.81 2d3m h LYS 74 Ca 0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 2d3m h LYS 74 Cb 0.47 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.78 2d3m h LYS 74 CO 0.03 0.59 -0.32 1.63 -0.57 0.00 0.00 179.45 180.81 2d3m n LYS 75 N -3.52 0.84 0.21 3.15 4.76 -0.93 -4.29 118.16 118.39 2d3m n LYS 75 Ca -0.00 -0.54 0.09 0.00 -2.87 0.00 0.00 58.31 54.99 2d3m n LYS 75 Cb 0.66 -1.49 0.41 0.00 -1.84 0.00 0.00 35.03 32.78 2d3m n LYS 75 CO 0.00 0.00 0.00 1.79 -1.37 0.00 0.00 177.40 177.82 2d3m h THR 76 N 1.31 0.58 -4.75 -0.18 1.35 -1.44 -3.45 112.91 106.33 2d3m h THR 76 Ca 0.00 -1.23 -0.40 0.00 -0.55 0.00 0.00 66.41 64.24 2d3m h THR 76 Cb 0.55 1.83 0.08 0.00 -1.73 0.00 0.00 68.15 68.88 2d3m h THR 76 CO 0.00 0.24 -0.62 0.23 -0.25 0.00 0.00 175.52 175.13 2d3m n MET 77 N -3.38 -5.66 -4.70 4.72 2.81 -1.26 -4.26 117.12 105.39 2d3m n MET 77 Ca 0.00 0.87 -0.33 0.00 -1.81 0.00 0.00 57.70 56.43 2d3m n MET 77 Cb 0.46 -5.74 -0.13 0.00 -0.71 0.00 0.00 33.22 27.09 2d3m n MET 77 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 2d3m s ILE 78 N -3.21 3.30 -0.22 2.02 1.01 -1.26 -3.57 121.20 119.27 2d3m s ILE 78 Ca 0.37 -0.59 -0.02 0.00 0.00 0.00 0.00 60.65 60.41 2d3m s ILE 78 Cb -0.17 -2.38 -0.19 0.00 0.01 0.00 0.00 42.46 39.73 2d3m s ILE 78 CO 0.46 0.54 -0.06 0.61 0.00 0.00 0.00 174.94 176.49 2d3m n GLY 79 N 3.15 -0.43 3.37 6.18 0.00 0.17 -4.63 105.19 113.00 2d3m n GLY 79 Ca -0.18 -0.19 -0.12 0.00 0.00 0.00 0.00 46.02 45.53 2d3m n GLY 79 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2d3m s LYS 80 N -2.53 1.10 0.05 1.61 -2.85 -0.83 -0.59 119.74 115.70 2d3m s LYS 80 Ca -0.32 -0.44 0.00 0.00 -1.00 0.00 0.00 55.97 54.21 2d3m s LYS 80 Cb 0.09 0.50 -0.03 0.00 -2.06 0.00 0.00 37.83 36.32 2d3m s LYS 80 CO 0.64 -0.43 -0.04 1.03 0.10 0.00 0.00 175.35 176.65 2d3m s ARG 81 N -3.17 0.58 -0.06 1.78 0.52 -0.85 -3.15 118.95 114.61 2d3m s ARG 81 Ca -0.01 -1.06 0.03 0.00 -0.52 0.00 0.00 55.73 54.17 2d3m s ARG 81 Cb 0.00 0.06 -0.02 0.00 0.52 0.00 0.00 34.95 35.51 2d3m s ARG 81 CO -0.07 -0.06 -0.15 0.71 0.02 0.00 0.00 175.30 175.74 2d3m s TYR 82 N -3.07 2.69 0.08 -0.53 1.51 -1.26 -0.58 117.35 116.19 2d3m s TYR 82 Ca 0.01 -0.22 0.02 0.00 -1.01 0.00 0.00 57.07 55.87 2d3m s TYR 82 Cb 0.02 -1.64 -0.04 0.00 -0.11 0.00 0.00 41.96 40.19 2d3m s TYR 82 CO -0.06 0.14 -0.08 -0.06 -1.11 0.00 0.00 175.55 174.38 2d3m s PHE 83 N -0.62 0.85 -2.05 2.71 0.08 -0.49 -1.16 117.98 117.30 2d3m s PHE 83 Ca 0.09 -0.75 0.10 0.00 0.12 0.00 0.00 56.93 56.50 2d3m s PHE 83 Cb -0.11 -0.49 0.44 0.00 -0.57 0.00 0.00 43.02 42.29 2d3m s PHE 83 CO 0.01 -0.11 1.31 0.27 -0.10 0.00 0.00 175.22 176.60 2d3m n ASN 84 N 0.52 0.83 -4.16 1.36 6.94 -1.26 -2.80 115.26 116.69 2d3m n ASN 84 Ca -0.16 -1.84 -0.14 0.00 -0.02 0.00 0.00 54.58 52.42 2d3m n ASN 84 Cb 0.58 -0.09 -0.11 0.00 -2.36 0.00 0.00 39.78 37.81 2d3m n ASN 84 CO 0.00 0.00 0.00 -0.72 -1.03 0.00 0.00 177.26 175.51 2d3m s TYR 85 N -1.83 1.02 0.22 -2.53 1.13 -1.26 -4.99 117.35 109.11 2d3m s TYR 85 Ca 0.18 -0.63 0.00 0.00 -1.41 0.00 0.00 57.07 55.21 2d3m s TYR 85 Cb 0.09 -0.56 -0.00 0.00 -1.10 0.00 0.00 41.96 40.39 2d3m s TYR 85 CO 0.13 -0.01 0.02 -0.40 -2.51 0.00 0.00 175.55 172.78 2d3m n ASP 86 N 0.71 2.30 0.14 -0.18 3.85 -1.26 -4.79 116.55 117.32 2d3m n ASP 86 Ca -0.17 -2.02 0.02 0.00 -0.71 0.00 0.00 54.79 51.91 2d3m n ASP 86 Cb 0.57 0.23 0.39 0.00 -1.35 0.00 0.00 41.12 40.96 2d3m n ASP 86 CO 0.00 0.00 0.00 -0.33 -1.01 0.00 0.00 177.20 175.86 2d3m h GLU 87 N 0.00 0.18 -0.40 0.11 5.08 -2.00 -2.77 114.58 114.78 2d3m h GLU 87 Ca -0.18 -0.05 -0.13 0.00 -1.00 0.00 0.00 59.36 58.00 2d3m h GLU 87 Cb 0.58 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 2d3m h GLU 87 CO 0.30 0.37 -0.27 1.49 -1.00 0.00 0.00 179.01 179.91 2d3m h GLU 88 N 0.17 0.84 -0.47 2.33 4.81 -2.01 -2.94 114.58 117.32 2d3m h GLU 88 Ca 0.03 -0.37 -0.10 0.00 -0.13 0.00 0.00 59.36 58.79 2d3m h GLU 88 Cb 0.44 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.78 2d3m h GLU 88 CO 0.03 1.01 -0.11 0.35 -0.73 0.00 0.00 179.01 179.56 2d3m h PHE 89 N 0.72 1.01 0.00 0.92 3.57 -1.90 -3.05 116.94 118.21 2d3m h PHE 89 Ca 0.09 -0.22 -0.03 0.00 3.53 0.00 0.00 57.97 61.35 2d3m h PHE 89 Cb 0.81 -0.25 -0.00 0.00 2.79 0.00 0.00 35.95 39.30 2d3m h PHE 89 CO 0.05 0.99 -0.13 -0.07 -2.23 0.00 0.00 178.31 176.92 2d3m h LEU 90 N 0.74 0.00 -1.45 0.59 3.38 -1.38 -2.68 115.31 114.50 2d3m h LEU 90 Ca 0.12 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.07 2d3m h LEU 90 Cb 0.66 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 2d3m h LEU 90 CO 0.05 0.13 -0.10 0.11 0.09 0.00 0.00 178.44 178.71 2d3m h LYS 91 N 0.00 0.00 0.00 1.13 1.57 -1.40 -2.15 116.57 115.72 2d3m h LYS 91 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2d3m h LYS 91 Cb 0.39 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.70 2d3m h LYS 91 CO 0.02 0.10 0.00 1.63 -0.57 0.00 0.00 179.45 180.63 2d3m n LYS 92 N -3.28 0.21 -3.52 3.15 5.02 -1.01 -4.28 118.16 114.45 2d3m n LYS 92 Ca -0.00 0.20 -0.27 0.00 -2.02 0.00 0.00 58.31 56.22 2d3m n LYS 92 Cb 0.33 -1.76 -0.10 0.00 -0.02 0.00 0.00 35.03 33.49 2d3m n LYS 92 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2d3m n TYR 93 N -2.13 1.45 0.34 2.13 4.01 -0.81 -4.95 117.16 117.21 2d3m n TYR 93 Ca 0.05 -3.85 0.12 0.00 -0.16 0.00 0.00 57.90 54.06 2d3m n TYR 93 Cb 0.40 -0.30 0.51 0.00 -0.31 0.00 0.00 39.34 39.64 2d3m n TYR 93 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 2d3m n PRO 94 N 1.87 0.19 0.08 -0.72 -0.04 -1.26 -2.35 135.00 132.77 2d3m n PRO 94 Ca 0.25 0.47 -0.10 0.00 -0.04 0.00 0.00 63.50 64.09 2d3m n PRO 94 Cb 0.43 -1.89 -0.07 0.00 -0.04 0.00 0.00 33.50 31.93 2d3m n PRO 94 CO 0.00 0.00 0.00 -2.95 -0.04 0.00 0.00 175.50 172.51 2d3m h ASN 95 N 0.00 0.21 0.14 3.54 -1.07 -1.91 -2.90 115.58 113.59 2d3m h ASN 95 Ca 0.00 -0.20 -0.23 0.00 0.07 0.00 0.00 56.30 55.94 2d3m h ASN 95 Cb 0.29 -0.07 0.01 0.00 -2.07 0.00 0.00 38.32 36.48 2d3m h ASN 95 CO 0.00 1.08 -0.91 0.40 0.07 0.00 0.00 177.43 178.07 2d3m h ILE 96 N 0.06 1.34 -0.00 6.14 2.04 -1.79 -3.20 117.51 122.10 2d3m h ILE 96 Ca -0.05 -2.26 0.00 0.00 1.00 0.00 0.00 64.86 63.55 2d3m h ILE 96 Cb 1.70 2.28 0.00 0.00 -0.74 0.00 0.00 36.82 40.05 2d3m h ILE 96 CO 0.15 0.69 -0.00 0.35 0.00 0.00 0.00 178.15 179.33 2d3m n THR 97 N -3.82 0.00 -2.44 -0.27 -2.24 -1.16 -3.97 114.28 100.37 2d3m n THR 97 Ca -0.08 -0.04 -0.20 0.00 -2.27 0.00 0.00 64.05 61.47 2d3m n THR 97 Cb 0.81 -0.34 0.11 0.00 -2.10 0.00 0.00 70.33 68.81 2d3m n THR 97 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2d3m n SER 98 N -0.84 0.98 -0.06 3.42 3.41 -1.10 -3.69 113.62 115.74 2d3m n SER 98 Ca 0.23 -1.87 -0.04 0.00 -0.26 0.00 0.00 58.87 56.93 2d3m n SER 98 Cb 0.15 -0.57 -0.02 0.00 -0.26 0.00 0.00 64.21 63.52 2d3m n SER 98 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 2d3m h TYR 99 N -0.70 0.00 0.00 7.33 5.03 -1.85 -0.63 116.97 126.14 2d3m h TYR 99 Ca -0.28 0.00 -0.05 0.00 2.58 0.00 0.00 58.73 60.97 2d3m h TYR 99 Cb 1.00 0.00 -0.12 0.00 1.55 0.00 0.00 36.73 39.16 2d3m h TYR 99 CO 0.00 0.06 -0.62 -0.40 -1.32 0.00 0.00 178.16 175.88 2d3m n ASP 100 N -4.66 1.48 -4.82 -2.11 5.75 -1.26 -4.69 116.55 106.24 2d3m n ASP 100 Ca -0.06 -3.20 -0.33 0.00 -0.01 0.00 0.00 54.79 51.19 2d3m n ASP 100 Cb 0.20 -0.44 -0.06 0.00 -1.03 0.00 0.00 41.12 39.78 2d3m n ASP 100 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 2d3m s GLU 101 N -2.12 4.15 -0.05 0.11 2.02 -1.26 -4.90 118.70 116.64 2d3m s GLU 101 Ca 0.35 1.13 -0.35 0.00 0.02 0.00 0.00 54.97 56.12 2d3m s GLU 101 Cb 0.35 -2.17 -0.13 0.00 0.10 0.00 0.00 34.13 32.29 2d3m s GLU 101 CO -0.09 -0.10 1.80 -2.30 0.02 0.00 0.00 175.26 174.59 2d3m n PRO 102 N -0.78 2.08 0.00 0.39 -0.02 -1.26 -4.61 135.00 130.79 2d3m n PRO 102 Ca 0.07 0.76 0.00 0.00 -2.02 0.00 0.00 63.50 62.31 2d3m n PRO 102 Cb 0.54 -2.57 0.00 0.00 -0.02 0.00 0.00 33.50 31.44 2d3m n PRO 102 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2d3m n SER 103 N 5.86 0.00 -0.23 2.55 3.41 -0.28 -4.83 113.62 120.09 2d3m n SER 103 Ca 0.22 -0.56 -0.01 0.00 -0.26 0.00 0.00 58.87 58.26 2d3m n SER 103 Cb 0.28 0.00 0.10 0.00 -0.26 0.00 0.00 64.21 64.33 2d3m n SER 103 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2d3m h LEU 104 N 0.00 0.52 -0.58 1.04 5.85 -1.46 -2.08 115.31 118.61 2d3m h LEU 104 Ca 0.00 0.04 0.07 0.00 0.84 0.00 0.00 57.88 58.83 2d3m h LEU 104 Cb 0.28 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.18 2d3m h LEU 104 CO 0.00 0.33 0.25 0.78 -0.34 0.00 0.00 178.44 179.46 2d3m h ASN 105 N 0.65 0.31 -0.31 1.25 4.21 -1.92 0.23 115.58 120.01 2d3m h ASN 105 Ca 0.30 0.05 -0.13 0.00 1.21 0.00 0.00 56.30 57.74 2d3m h ASN 105 Cb 0.21 0.01 -0.01 0.00 -1.12 0.00 0.00 38.32 37.41 2d3m h ASN 105 CO -0.20 0.20 -0.28 0.44 -1.29 0.00 0.00 177.43 176.31 2d3m h ASP 106 N 0.47 0.84 -0.27 5.81 3.32 -1.87 -0.63 116.42 124.08 2d3m h ASP 106 Ca 0.28 -0.33 -0.12 0.00 0.02 0.00 0.00 57.03 56.88 2d3m h ASP 106 Cb 0.27 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 2d3m h ASP 106 CO -0.24 1.07 -0.25 0.03 -1.72 0.00 0.00 179.24 178.13 2d3m h ARG 107 N 0.70 0.76 -0.39 3.56 3.08 -0.75 -2.54 114.38 118.79 2d3m h ARG 107 Ca 0.08 -0.32 -0.10 0.00 0.07 0.00 0.00 59.98 59.72 2d3m h ARG 107 Cb 0.82 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.83 2d3m h ARG 107 CO 0.07 0.93 -0.14 1.96 -1.07 0.00 0.00 179.97 181.72 2d3m h GLN 108 N 0.66 0.79 0.00 0.04 1.08 -0.36 0.12 115.11 117.44 2d3m h GLN 108 Ca 0.09 -0.32 -0.01 0.00 -1.45 0.00 0.00 58.65 56.96 2d3m h GLN 108 Cb 0.77 -0.03 -0.00 0.00 -0.05 0.00 0.00 27.48 28.16 2d3m h GLN 108 CO 0.06 0.94 -0.03 -0.44 -0.95 0.00 0.00 178.83 178.41 2d3m h ASP 109 N 0.59 0.00 0.00 1.46 3.32 -0.89 0.19 116.42 121.10 2d3m h ASP 109 Ca 0.09 0.00 -0.20 0.00 0.02 0.00 0.00 57.03 56.94 2d3m h ASP 109 Cb 0.68 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.19 2d3m h ASP 109 CO 0.05 0.03 -1.15 0.40 -1.72 0.00 0.00 179.24 176.85 2d3m h ILE 110 N 0.00 0.86 -0.16 0.35 2.04 -1.26 -3.40 117.51 115.93 2d3m h ILE 110 Ca -0.00 -2.07 -0.19 0.00 1.00 0.00 0.00 64.86 63.60 2d3m h ILE 110 Cb 0.07 2.05 -0.00 0.00 -0.74 0.00 0.00 36.82 38.19 2d3m h ILE 110 CO 0.00 0.29 -0.65 0.00 0.00 0.00 0.00 178.15 177.79 2d3m h VAL 112 N 0.45 0.96 0.00 0.00 2.07 -0.84 -0.86 116.25 118.03 2d3m h VAL 112 Ca -0.02 -0.11 -0.12 0.00 0.82 0.00 0.00 66.70 67.28 2d3m h VAL 112 Cb 1.23 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 31.61 2d3m h VAL 112 CO 0.13 0.06 -1.51 -0.81 0.02 0.00 0.00 177.57 175.45 2d3m n PRO 113 N -4.97 0.63 -0.09 1.57 -0.04 -1.25 -4.38 135.00 126.47 2d3m n PRO 113 Ca -0.00 0.11 -0.14 0.00 -0.04 0.00 0.00 63.50 63.43 2d3m n PRO 113 Cb 0.09 -1.74 -0.04 0.00 -0.04 0.00 0.00 33.50 31.77 2d3m n PRO 113 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 2d3m h GLY 114 N 3.86 0.91 0.84 0.55 0.00 -1.18 -2.80 103.07 105.24 2d3m h GLY 114 Ca -0.14 -0.99 -0.02 0.00 0.00 0.00 0.00 47.33 46.19 2d3m h GLY 114 CO 0.03 0.89 0.04 -2.08 0.00 0.00 0.00 176.54 175.42 2d3m h VAL 115 N 0.60 1.20 -0.13 4.60 2.07 -1.36 -1.33 116.25 121.90 2d3m h VAL 115 Ca 0.04 -0.63 -0.05 0.00 0.82 0.00 0.00 66.70 66.88 2d3m h VAL 115 Cb 1.01 1.31 -0.01 0.00 -1.52 0.00 0.00 31.29 32.09 2d3m h VAL 115 CO 0.10 0.19 -0.15 -0.65 0.02 0.00 0.00 177.57 177.08 2d3m h PRO 116 N 0.06 0.21 -0.37 1.57 0.11 -1.76 0.32 132.00 132.13 2d3m h PRO 116 Ca 0.05 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 66.06 2d3m h PRO 116 Cb 0.26 -0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.32 2d3m h PRO 116 CO 0.00 0.36 0.04 0.00 -0.21 0.00 0.00 178.00 178.19 2d3m h ALA 117 N 1.66 0.50 -0.36 -0.75 0.00 -1.32 0.85 119.26 119.84 2d3m h ALA 117 Ca 0.04 -0.23 -0.15 0.00 0.00 0.00 0.00 54.91 54.57 2d3m h ALA 117 Cb 0.39 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2d3m h ALA 117 CO 0.02 0.23 -0.37 1.25 0.00 0.00 0.00 179.25 180.38 2d3m h LEU 118 N 0.47 0.90 -0.84 0.00 5.85 -0.94 -2.60 115.31 118.15 2d3m h LEU 118 Ca 0.11 -0.40 -0.07 0.00 0.84 0.00 0.00 57.88 58.36 2d3m h LEU 118 Cb 0.41 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.16 2d3m h LEU 118 CO 0.01 1.17 0.09 1.23 -0.34 0.00 0.00 178.44 180.61 2d3m h GLY 119 N 0.86 1.04 1.34 3.75 0.00 -0.75 -2.68 103.07 106.63 2d3m h GLY 119 Ca 0.06 -0.66 -0.05 0.00 0.00 0.00 0.00 47.33 46.68 2d3m h GLY 119 CO 0.09 0.62 0.15 -0.84 0.00 0.00 0.00 176.54 176.56 2d3m h THR 120 N 0.91 1.22 -0.85 4.70 2.02 -0.64 -0.75 112.91 119.52 2d3m h THR 120 Ca 0.18 -0.78 -0.01 0.00 0.77 0.00 0.00 66.41 66.58 2d3m h THR 120 Cb 0.40 0.64 -0.04 0.00 -1.74 0.00 0.00 68.15 67.41 2d3m h THR 120 CO 0.01 0.29 0.50 -0.33 0.37 0.00 0.00 175.52 176.36 2d3m h GLU 121 N 0.81 1.16 -0.20 6.66 5.08 -1.12 0.67 114.58 127.63 2d3m h GLU 121 Ca 0.18 -0.11 -0.20 0.00 -1.00 0.00 0.00 59.36 58.23 2d3m h GLU 121 Cb 0.27 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.28 2d3m h GLU 121 CO -0.01 0.82 -0.67 0.00 -1.00 0.00 0.00 179.01 178.16 2d3m h ALA 122 N 1.27 0.43 -0.72 3.43 0.00 -1.32 -3.17 119.26 119.18 2d3m h ALA 122 Ca 0.30 -0.56 -0.05 0.00 0.00 0.00 0.00 54.91 54.60 2d3m h ALA 122 Cb -0.03 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 2d3m h ALA 122 CO -0.05 0.69 0.24 0.00 0.00 0.00 0.00 179.25 180.13 2d3m h ALA 123 N 0.68 1.08 -0.93 0.00 0.00 -0.53 -1.89 119.26 117.66 2d3m h ALA 123 Ca -0.02 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 2d3m h ALA 123 Cb 1.27 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 18.74 2d3m h ALA 123 CO 0.14 0.64 0.56 0.28 0.00 0.00 0.00 179.25 180.86 2d3m h VAL 124 N 1.05 1.26 -0.33 0.00 2.07 -0.89 0.13 116.25 119.54 2d3m h VAL 124 Ca 0.23 -0.57 -0.14 0.00 0.82 0.00 0.00 66.70 67.04 2d3m h VAL 124 Cb 0.27 -0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 29.98 2d3m h VAL 124 CO -0.01 0.27 -0.37 0.11 0.02 0.00 0.00 177.57 177.59 2d3m h LYS 125 N 1.29 0.76 -0.42 1.57 1.57 -1.45 -0.94 116.57 118.95 2d3m h LYS 125 Ca 0.33 -0.38 -0.09 0.00 -1.87 0.00 0.00 60.65 58.64 2d3m h LYS 125 Cb -0.04 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 2d3m h LYS 125 CO -0.06 1.01 -0.08 0.00 -0.57 0.00 0.00 179.45 179.75 2d3m h ALA 126 N 0.95 0.58 -0.52 3.86 0.00 -0.78 -2.05 119.26 121.30 2d3m h ALA 126 Ca 0.06 -0.31 -0.08 0.00 0.00 0.00 0.00 54.91 54.57 2d3m h ALA 126 Cb 0.92 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 2d3m h ALA 126 CO 0.08 0.44 -0.01 0.82 0.00 0.00 0.00 179.25 180.58 2d3m h ILE 127 N 0.63 1.25 -0.57 0.00 2.04 -0.86 -1.55 117.51 118.45 2d3m h ILE 127 Ca 0.11 -1.08 -0.10 0.00 1.00 0.00 0.00 64.86 64.79 2d3m h ILE 127 Cb 0.60 0.87 -0.02 0.00 -0.74 0.00 0.00 36.82 37.53 2d3m h ILE 127 CO 0.04 0.39 -0.03 -0.08 0.00 0.00 0.00 178.15 178.46 2d3m h GLU 128 N 0.82 1.03 -0.36 2.37 4.57 -1.05 -1.77 114.58 120.19 2d3m h GLU 128 Ca 0.15 -0.35 -0.10 0.00 -1.18 0.00 0.00 59.36 57.89 2d3m h GLU 128 Cb 0.51 -0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 29.01 2d3m h GLU 128 CO 0.03 1.04 -0.17 1.49 -1.18 0.00 0.00 179.01 180.22 2d3m h GLU 129 N 0.92 0.75 -0.86 1.92 4.81 -1.16 -3.02 114.58 117.94 2d3m h GLU 129 Ca 0.16 -0.32 0.03 0.00 -0.13 0.00 0.00 59.36 59.09 2d3m h GLU 129 Cb 0.59 -0.02 -0.05 0.00 0.63 0.00 0.00 28.75 29.90 2d3m h GLU 129 CO 0.04 0.94 0.56 2.35 -0.73 0.00 0.00 179.01 182.16 2d3m h TRP 130 N 0.54 1.05 0.00 0.92 7.01 -1.17 -3.47 115.95 120.82 2d3m h TRP 130 Ca 0.08 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.11 2d3m h TRP 130 Cb 0.71 -0.35 0.00 0.00 -2.10 0.00 0.00 29.16 27.42 2d3m h TRP 130 CO 0.06 0.62 0.00 0.41 -2.79 0.00 0.00 178.44 176.74 2d3m n GLY 131 N -1.33 2.49 3.92 2.65 0.00 -0.68 -4.75 105.19 107.48 2d3m n GLY 131 Ca 0.10 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.85 2d3m n GLY 131 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2d3m s ARG 132 N -0.19 3.57 0.45 1.61 0.52 -1.26 -5.05 118.95 118.60 2d3m s ARG 132 Ca 0.00 -0.10 -0.25 0.00 -0.52 0.00 0.00 55.73 54.86 2d3m s ARG 132 Cb 0.00 -2.64 -0.09 0.00 0.52 0.00 0.00 34.95 32.75 2d3m s ARG 132 CO 0.00 0.17 1.36 -2.30 0.02 0.00 0.00 175.30 174.55 2d3m n PRO 133 N -1.30 2.07 0.32 3.54 -0.02 -1.26 -4.90 135.00 133.44 2d3m n PRO 133 Ca -0.03 0.74 0.20 0.00 -2.02 0.00 0.00 63.50 62.39 2d3m n PRO 133 Cb 0.55 -2.53 1.04 0.00 -0.02 0.00 0.00 33.50 32.54 2d3m n PRO 133 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 2d3m h LYS 134 N 2.12 0.00 0.00 -0.52 2.10 -1.96 -1.76 116.57 116.55 2d3m h LYS 134 Ca -0.50 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.15 2d3m h LYS 134 Cb 1.28 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.61 2d3m h LYS 134 CO 0.60 0.01 0.00 0.66 -2.00 0.00 0.00 179.45 178.72 2d3m h SER 135 N 0.00 0.00 -0.06 7.07 4.64 -1.90 -2.51 113.55 120.80 2d3m h SER 135 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2d3m h SER 135 Cb 0.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 2d3m h SER 135 CO 0.00 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.34 2d3m n GLU 136 N -2.35 1.64 -2.78 4.77 1.02 -0.66 -4.76 120.64 117.53 2d3m n GLU 136 Ca 0.02 -0.94 -0.42 0.00 -0.02 0.00 0.00 57.16 55.80 2d3m n GLU 136 Cb 0.24 -1.45 -0.03 0.00 -0.02 0.00 0.00 31.44 30.18 2d3m n GLU 136 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2d3m s ILE 137 N -1.94 4.80 -0.10 -3.67 1.01 -0.95 -4.39 121.20 115.96 2d3m s ILE 137 Ca 0.37 1.84 0.18 0.00 0.00 0.00 0.00 60.65 63.04 2d3m s ILE 137 Cb 0.20 -4.23 -0.27 0.00 0.01 0.00 0.00 42.46 38.17 2d3m s ILE 137 CO 0.31 -0.04 0.25 0.35 0.00 0.00 0.00 174.94 175.82 2d3m n THR 138 N 4.87 0.63 -4.29 2.92 -2.24 -0.54 -4.73 114.28 110.90 2d3m n THR 138 Ca 0.08 -0.62 -0.18 0.00 -2.27 0.00 0.00 64.05 61.06 2d3m n THR 138 Cb 0.48 -0.23 -0.14 0.00 -2.10 0.00 0.00 70.33 68.34 2d3m n THR 138 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2d3m s HIS 139 N -2.92 0.78 -0.13 4.78 3.76 -1.06 -1.11 115.29 119.38 2d3m s HIS 139 Ca -0.08 -0.20 0.00 0.00 -0.15 0.00 0.00 55.06 54.63 2d3m s HIS 139 Cb 0.09 -0.49 0.02 0.00 1.11 0.00 0.00 32.58 33.31 2d3m s HIS 139 CO 0.79 -0.01 -0.12 -1.17 -0.85 0.00 0.00 174.74 173.38 2d3m s LEU 140 N -0.47 1.52 -0.37 0.89 2.96 0.23 -0.37 118.68 123.08 2d3m s LEU 140 Ca 0.01 -0.41 -0.04 0.00 -0.22 0.00 0.00 54.13 53.48 2d3m s LEU 140 Cb -0.04 -1.05 0.08 0.00 0.50 0.00 0.00 46.19 45.68 2d3m s LEU 140 CO -0.00 -0.06 0.14 -0.69 -1.32 0.00 0.00 176.35 174.41 2d3m s VAL 141 N 1.47 3.34 -0.12 1.68 1.01 0.56 -0.29 120.40 128.05 2d3m s VAL 141 Ca 0.03 -1.68 -0.06 0.00 0.00 0.00 0.00 61.98 60.26 2d3m s VAL 141 Cb -0.13 -3.11 -0.04 0.00 0.00 0.00 0.00 36.38 33.10 2d3m s VAL 141 CO -0.08 -0.44 0.12 0.12 0.00 0.00 0.00 175.10 174.82 2d3m s PHE 142 N 1.23 3.52 -0.04 5.22 5.36 0.53 0.03 117.98 133.83 2d3m s PHE 142 Ca 0.03 0.47 0.00 0.00 -0.96 0.00 0.00 56.93 56.46 2d3m s PHE 142 Cb -0.21 -1.93 0.03 0.00 -0.34 0.00 0.00 43.02 40.56 2d3m s PHE 142 CO -0.02 0.68 -0.01 0.00 -1.46 0.00 0.00 175.22 174.41 2d3m s THR 144 N 1.23 0.00 -0.83 0.00 -1.32 -0.55 -1.09 115.64 113.08 2d3m s THR 144 Ca -0.07 0.00 0.08 0.00 -1.21 0.00 0.00 61.69 60.50 2d3m s THR 144 Cb -0.13 -1.00 0.17 0.00 -1.51 0.00 0.00 72.50 70.02 2d3m s THR 144 CO -0.02 0.00 1.02 -1.20 -2.21 0.00 0.00 174.62 172.21 2d3m n SER 145 N 0.90 2.30 -4.02 8.08 7.64 -1.26 -1.33 113.62 125.93 2d3m n SER 145 Ca -0.17 -1.74 -0.33 0.00 1.01 0.00 0.00 58.87 57.64 2d3m n SER 145 Cb 0.57 -0.11 -0.13 0.00 -1.01 0.00 0.00 64.21 63.54 2d3m n SER 145 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2d3m n GLY 147 N 3.68 1.18 3.01 0.00 0.00 -1.26 -4.64 105.19 107.16 2d3m n GLY 147 Ca 0.04 -1.44 -0.16 0.00 0.00 0.00 0.00 46.02 44.46 2d3m n GLY 147 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2d3m s VAL 148 N -0.81 0.58 0.11 1.61 -7.23 -1.26 -4.93 120.40 108.47 2d3m s VAL 148 Ca 0.00 -0.51 -0.25 0.00 -1.81 0.00 0.00 61.98 59.41 2d3m s VAL 148 Cb 0.00 -0.53 0.08 0.00 0.56 0.00 0.00 36.38 36.49 2d3m s VAL 148 CO 0.00 0.03 0.76 -0.62 -0.31 0.00 0.00 175.10 174.96 2d3m s ASP 149 N -0.53 -0.42 -0.17 4.85 2.15 -1.26 -4.96 116.67 116.33 2d3m s ASP 149 Ca -0.00 -0.10 -0.01 0.00 0.43 0.00 0.00 52.55 52.87 2d3m s ASP 149 Cb -0.05 0.52 0.04 0.00 -0.30 0.00 0.00 42.92 43.13 2d3m s ASP 149 CO 0.00 -0.86 -0.03 -0.04 -0.17 0.00 0.00 175.17 174.07 2d3m s MET 150 N -3.47 1.23 0.22 4.34 -1.94 -1.26 -2.37 119.30 116.05 2d3m s MET 150 Ca 0.05 -0.47 -0.30 0.00 -1.71 0.00 0.00 55.69 53.26 2d3m s MET 150 Cb -0.01 -1.96 -0.09 0.00 2.01 0.00 0.00 34.83 34.77 2d3m s MET 150 CO -0.08 -0.47 1.36 -1.25 -0.01 0.00 0.00 175.02 174.57 2d3m s PRO 151 N 1.69 4.34 1.24 2.03 0.04 -1.26 -5.16 135.00 137.92 2d3m s PRO 151 Ca 0.00 2.15 -0.16 0.00 0.04 0.00 0.00 61.00 63.03 2d3m s PRO 151 Cb -0.15 -3.16 0.29 0.00 0.04 0.00 0.00 34.50 31.51 2d3m s PRO 151 CO -0.07 -0.31 0.78 -1.13 0.04 0.00 0.00 177.00 176.30 2d3m n SER 152 N 2.49 -2.52 -0.08 6.66 3.41 -1.00 -4.79 113.62 117.78 2d3m n SER 152 Ca 0.06 -0.35 0.19 0.00 -0.26 0.00 0.00 58.87 58.51 2d3m n SER 152 Cb 0.42 -1.12 0.62 0.00 -0.26 0.00 0.00 64.21 63.86 2d3m n SER 152 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2d3m h ALA 153 N -2.85 2.37 -0.64 7.33 0.00 -1.92 -1.28 119.26 122.28 2d3m h ALA 153 Ca -0.56 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.25 2d3m h ALA 153 Cb 1.32 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.09 2d3m h ALA 153 CO 0.41 -0.55 0.06 0.38 0.00 0.00 0.00 179.25 179.55 2d3m h ASP 154 N 0.17 1.06 -0.15 0.00 2.03 -1.90 -0.98 116.42 116.64 2d3m h ASP 154 Ca 0.31 -0.28 -0.01 0.00 -0.73 0.00 0.00 57.03 56.33 2d3m h ASP 154 Cb 1.00 -0.28 -0.01 0.00 -0.83 0.00 0.00 39.33 39.21 2d3m h ASP 154 CO -0.05 1.07 0.07 0.15 -1.03 0.00 0.00 179.24 179.45 2d3m h PHE 155 N 1.00 0.22 -0.70 4.15 3.04 -1.58 -1.07 116.94 122.01 2d3m h PHE 155 Ca 0.19 -0.01 -0.05 0.00 3.98 0.00 0.00 57.97 62.08 2d3m h PHE 155 Cb 0.50 -0.07 -0.03 0.00 2.56 0.00 0.00 35.95 38.91 2d3m h PHE 155 CO 0.04 0.27 0.25 1.96 -2.02 0.00 0.00 178.31 178.81 2d3m h GLN 156 N 0.10 1.05 -0.36 1.11 1.08 -1.29 -0.90 115.11 115.89 2d3m h GLN 156 Ca 0.05 -0.20 -0.07 0.00 -1.45 0.00 0.00 58.65 56.98 2d3m h GLN 156 Cb 0.14 -0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 27.39 2d3m h GLN 156 CO -0.01 0.88 -0.05 0.00 -0.95 0.00 0.00 178.83 178.70 2d3m h ALA 158 N 0.84 1.29 -0.16 0.00 0.00 -0.92 -0.71 119.26 119.60 2d3m h ALA 158 Ca 0.10 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 2d3m h ALA 158 Cb 0.54 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 2d3m h ALA 158 CO 0.03 0.55 -0.09 -0.22 0.00 0.00 0.00 179.25 179.51 2d3m h LYS 159 N 0.96 0.34 -0.28 0.00 3.64 -0.95 -0.28 116.57 119.99 2d3m h LYS 159 Ca 0.23 -0.16 -0.07 0.00 -1.27 0.00 0.00 60.65 59.39 2d3m h LYS 159 Cb 0.11 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 2d3m h LYS 159 CO -0.03 0.67 -0.12 -0.07 -2.27 0.00 0.00 179.45 177.64 2d3m h LEU 160 N -0.00 0.45 0.00 5.20 3.38 -0.88 -2.63 115.31 120.83 2d3m h LEU 160 Ca 0.03 -0.11 -0.09 0.00 0.09 0.00 0.00 57.88 57.80 2d3m h LEU 160 Cb 0.58 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 2d3m h LEU 160 CO 0.03 0.60 -0.51 -0.07 0.09 0.00 0.00 178.44 178.58 2d3m h LEU 161 N 0.44 0.00 -0.64 1.67 3.38 -1.10 -3.48 115.31 115.57 2d3m h LEU 161 Ca 0.08 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.01 2d3m h LEU 161 Cb 0.47 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.23 2d3m h LEU 161 CO 0.03 0.43 -0.07 0.61 0.09 0.00 0.00 178.44 179.52 2d3m n GLY 162 N 1.22 0.66 3.75 0.83 0.00 -0.25 -5.04 105.19 106.36 2d3m n GLY 162 Ca 0.01 -0.63 -0.30 0.00 0.00 0.00 0.00 46.02 45.10 2d3m n GLY 162 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2d3m s LEU 163 N -1.44 2.50 0.54 0.99 1.43 -0.43 -4.87 118.68 117.40 2d3m s LEU 163 Ca 0.05 1.49 -0.22 0.00 -1.03 0.00 0.00 54.13 54.42 2d3m s LEU 163 Cb -0.02 -4.02 -0.05 0.00 0.03 0.00 0.00 46.19 42.12 2d3m s LEU 163 CO 0.06 -2.33 1.34 1.57 0.23 0.00 0.00 176.35 177.22 2d3m n HIS 164 N -3.68 2.24 0.28 0.29 -0.00 -1.26 -4.89 115.22 108.20 2d3m n HIS 164 Ca 0.07 0.44 0.13 0.00 -0.00 0.00 0.00 57.72 58.36 2d3m n HIS 164 Cb 0.55 -2.36 0.83 0.00 -0.00 0.00 0.00 29.99 29.01 2d3m n HIS 164 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2d3m h ALA 165 N 1.47 1.64 -0.47 1.57 0.00 -1.98 -2.61 119.26 118.88 2d3m h ALA 165 Ca -0.50 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2d3m h ALA 165 Cb 1.30 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.09 2d3m h ALA 165 CO 0.57 0.01 0.00 0.09 0.00 0.00 0.00 179.25 179.92 2d3m n ASN 166 N -4.03 4.67 -4.71 0.00 3.02 -1.26 -4.96 115.26 107.99 2d3m n ASN 166 Ca -0.03 -2.68 -0.42 0.00 -0.03 0.00 0.00 54.58 51.42 2d3m n ASN 166 Cb 0.09 -0.63 -0.03 0.00 -0.61 0.00 0.00 39.78 38.61 2d3m n ASN 166 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2d3m s VAL 167 N -2.31 3.41 -0.43 2.41 0.11 -0.99 -4.95 120.40 117.65 2d3m s VAL 167 Ca 0.43 0.98 -0.29 0.00 -2.93 0.00 0.00 61.98 60.17 2d3m s VAL 167 Cb 0.32 -3.63 0.02 0.00 -1.53 0.00 0.00 36.38 31.57 2d3m s VAL 167 CO 0.14 0.06 1.21 0.20 -3.33 0.00 0.00 175.10 173.38 2d3m s ASN 168 N 1.29 6.59 -0.04 3.54 0.01 -0.27 -4.89 114.94 121.17 2d3m s ASN 168 Ca 0.64 0.67 -0.03 0.00 -0.71 0.00 0.00 52.86 53.44 2d3m s ASN 168 Cb -0.36 -2.55 -0.04 0.00 0.41 0.00 0.00 41.25 38.72 2d3m s ASN 168 CO 0.30 -1.25 0.12 -0.54 -1.51 0.00 0.00 177.10 174.22 2d3m s LYS 169 N 4.48 3.27 -0.09 -0.60 1.02 -1.26 -0.60 119.74 125.96 2d3m s LYS 169 Ca 0.52 -0.33 -0.00 0.00 0.02 0.00 0.00 55.97 56.17 2d3m s LYS 169 Cb -0.10 -3.01 0.02 0.00 -0.52 0.00 0.00 37.83 34.22 2d3m s LYS 169 CO 0.30 0.69 -0.06 0.71 -0.92 0.00 0.00 175.35 176.07 2d3m s TYR 170 N -1.17 1.22 -0.33 3.18 1.51 0.60 -4.95 117.35 117.41 2d3m s TYR 170 Ca 0.21 -0.54 -0.05 0.00 -1.01 0.00 0.00 57.07 55.68 2d3m s TYR 170 Cb -0.12 -1.07 0.04 0.00 -0.11 0.00 0.00 41.96 40.70 2d3m s TYR 170 CO 0.12 -0.42 0.09 0.00 -1.11 0.00 0.00 175.55 174.22 2d3m s ILE 172 N 1.37 5.12 -0.08 0.00 1.01 0.15 -5.00 121.20 123.78 2d3m s ILE 172 Ca -0.02 -1.79 -0.12 0.00 0.00 0.00 0.00 60.65 58.72 2d3m s ILE 172 Cb -0.20 -4.57 -0.05 0.00 0.01 0.00 0.00 42.46 37.65 2d3m s ILE 172 CO 0.02 -1.20 0.29 -0.31 0.00 0.00 0.00 174.94 173.73 2d3m s TYR 173 N 1.63 3.63 -1.39 3.97 2.02 -1.26 -1.48 117.35 124.47 2d3m s TYR 173 Ca 0.21 0.74 -0.02 0.00 -0.37 0.00 0.00 57.07 57.63 2d3m s TYR 173 Cb -0.13 -2.17 0.00 0.00 -0.40 0.00 0.00 41.96 39.26 2d3m s TYR 173 CO -0.05 0.60 0.42 -1.33 -1.57 0.00 0.00 175.55 173.62 2d3m n MET 174 N 2.24 -3.01 -0.30 -0.62 2.81 -0.44 -4.88 117.12 112.92 2d3m n MET 174 Ca -0.16 0.39 0.08 0.00 -1.81 0.00 0.00 57.70 56.20 2d3m n MET 174 Cb 0.53 -4.43 0.24 0.00 -0.71 0.00 0.00 33.22 28.85 2d3m n MET 174 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 2d3m n GLN 175 N -4.41 2.90 0.00 0.03 1.13 -1.26 -5.03 117.38 110.75 2d3m n GLN 175 Ca -0.30 -2.38 0.00 0.00 -1.94 0.00 0.00 57.00 52.38 2d3m n GLN 175 Cb 0.68 -1.46 0.00 0.00 0.11 0.00 0.00 30.24 29.57 2d3m n GLN 175 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2d3m n GLY 176 N 0.92 -0.22 0.43 1.08 0.00 -1.26 -2.94 105.19 103.20 2d3m n GLY 176 Ca 0.18 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.24 2d3m n GLY 176 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2d3m n TYR 178 N 0.00 0.00 0.24 1.61 4.11 -1.16 -3.99 117.16 117.97 2d3m n TYR 178 Ca 0.00 0.00 0.17 0.00 -0.00 0.00 0.00 57.90 58.07 2d3m n TYR 178 Cb 0.00 -0.07 0.87 0.00 -0.00 0.00 0.00 39.34 40.15 2d3m n TYR 178 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 2d3m h ALA 179 N 0.00 1.67 0.00 -3.48 0.00 -1.88 0.03 119.26 115.61 2d3m h ALA 179 Ca 0.00 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 2d3m h ALA 179 Cb 0.00 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2d3m h ALA 179 CO 0.00 -0.23 -0.18 0.78 0.00 0.00 0.00 179.25 179.63 2d3m h GLY 180 N 0.00 0.00 0.94 0.00 0.00 -1.80 -1.57 103.07 100.65 2d3m h GLY 180 Ca 0.06 0.00 -0.34 0.00 0.00 0.00 0.00 47.33 47.06 2d3m h GLY 180 CO -0.00 0.00 -1.74 -1.33 0.00 0.00 0.00 176.54 173.46 2d3m h GLY 181 N 1.60 0.32 0.88 4.60 0.00 -1.32 -3.37 103.07 105.78 2d3m h GLY 181 Ca -0.00 -0.81 0.05 0.00 0.00 0.00 0.00 47.33 46.57 2d3m h GLY 181 CO 0.02 0.71 0.63 -0.84 0.00 0.00 0.00 176.54 177.06 2d3m h THR 182 N 0.08 1.13 -0.10 4.70 2.02 -1.01 -1.70 112.91 118.03 2d3m h THR 182 Ca -0.33 -0.40 -0.05 0.00 0.77 0.00 0.00 66.41 66.40 2d3m h THR 182 Cb 2.05 -0.15 -0.01 0.00 -1.74 0.00 0.00 68.15 68.30 2d3m h THR 182 CO 0.14 0.21 -0.15 -0.37 0.37 0.00 0.00 175.52 175.72 2d3m h VAL 183 N 1.18 1.17 -0.07 3.16 -1.51 -1.47 -0.72 116.25 117.99 2d3m h VAL 183 Ca 0.39 -0.75 -0.17 0.00 -1.23 0.00 0.00 66.70 64.94 2d3m h VAL 183 Cb 0.07 1.26 -0.01 0.00 -2.13 0.00 0.00 31.29 30.48 2d3m h VAL 183 CO -0.13 0.23 -0.71 0.24 -1.23 0.00 0.00 177.57 175.97 2d3m h MET 184 N 0.15 0.33 -0.35 5.19 2.86 -1.49 -0.85 114.93 120.77 2d3m h MET 184 Ca 0.03 -0.26 -0.08 0.00 -2.06 0.00 0.00 59.70 57.33 2d3m h MET 184 Cb 0.37 0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.07 2d3m h MET 184 CO 0.02 0.91 -0.10 -0.09 1.06 0.00 0.00 176.91 178.71 2d3m h ARG 185 N 0.23 0.69 0.12 1.72 2.43 -0.82 -1.42 114.38 117.33 2d3m h ARG 185 Ca -0.02 -0.27 -0.01 0.00 -0.81 0.00 0.00 59.98 58.87 2d3m h ARG 185 Cb 1.27 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.78 2d3m h ARG 185 CO 0.12 0.86 -0.06 1.88 -1.51 0.00 0.00 179.97 181.25 2d3m h TYR 186 N 0.48 -0.15 -0.57 2.20 -1.99 -1.10 -3.13 116.97 112.70 2d3m h TYR 186 Ca 0.09 -0.00 0.07 0.00 2.00 0.00 0.00 58.73 60.89 2d3m h TYR 186 Cb 0.61 0.05 -0.03 0.00 2.00 0.00 0.00 36.73 39.35 2d3m h TYR 186 CO 0.05 0.12 0.38 0.00 -0.00 0.00 0.00 178.16 178.72 2d3m h ALA 187 N 0.41 1.90 0.59 3.88 0.00 -1.13 -2.01 119.26 122.91 2d3m h ALA 187 Ca -0.02 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 2d3m h ALA 187 Cb 0.34 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.02 2d3m h ALA 187 CO 0.03 -0.00 -0.28 -0.22 0.00 0.00 0.00 179.25 178.77 2d3m h LYS 188 N 0.49 -0.77 -0.21 0.00 3.64 -1.20 -0.93 116.57 117.59 2d3m h LYS 188 Ca 0.25 0.05 -0.11 0.00 -1.27 0.00 0.00 60.65 59.58 2d3m h LYS 188 Cb 0.36 0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.35 2d3m h LYS 188 CO -0.07 -0.51 -0.32 -0.44 -2.27 0.00 0.00 179.45 175.84 2d3m h ASP 189 N -0.80 0.44 -0.24 4.20 3.32 -1.47 -1.67 116.42 120.19 2d3m h ASP 189 Ca -0.08 -0.17 -0.05 0.00 0.02 0.00 0.00 57.03 56.75 2d3m h ASP 189 Cb 0.61 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 40.03 2d3m h ASP 189 CO 0.13 0.75 -0.05 -0.07 -1.72 0.00 0.00 179.24 178.28 2d3m h LEU 190 N 0.37 0.46 -0.17 1.55 4.07 -1.32 -1.74 115.31 118.53 2d3m h LEU 190 Ca 0.05 -0.36 -0.12 0.00 0.08 0.00 0.00 57.88 57.53 2d3m h LEU 190 Cb 0.75 -0.13 0.00 0.00 1.08 0.00 0.00 40.66 42.37 2d3m h LEU 190 CO 0.06 0.71 -0.36 0.00 -1.08 0.00 0.00 178.44 177.76 2d3m h ALA 191 N 0.77 0.28 0.00 1.53 0.00 -1.12 -3.12 119.26 117.60 2d3m h ALA 191 Ca 0.06 -0.44 -0.10 0.00 0.00 0.00 0.00 54.91 54.43 2d3m h ALA 191 Cb 0.50 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2d3m h ALA 191 CO 0.02 0.35 -0.49 0.93 0.00 0.00 0.00 179.25 180.06 2d3m h GLU 192 N 0.20 0.00 -0.01 0.00 5.08 -1.34 -3.06 114.58 115.45 2d3m h GLU 192 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2d3m h GLU 192 Cb 0.96 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.21 2d3m h GLU 192 CO 0.08 0.49 -0.12 -1.71 -1.00 0.00 0.00 179.01 176.76 2d3m n ASN 193 N -3.71 1.55 -3.78 1.42 5.15 -0.66 -1.92 115.26 113.31 2d3m n ASN 193 Ca -0.01 -1.36 -0.28 0.00 -0.60 0.00 0.00 54.58 52.34 2d3m n ASN 193 Cb 0.55 0.08 -0.16 0.00 -0.53 0.00 0.00 39.78 39.71 2d3m n ASN 193 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 2d3m s ASN 194 N -2.20 2.89 0.21 1.20 0.01 -1.16 -3.85 114.94 112.05 2d3m s ASN 194 Ca 0.31 -0.78 -0.31 0.00 -0.71 0.00 0.00 52.86 51.37 2d3m s ASN 194 Cb 0.20 -0.69 -0.11 0.00 0.41 0.00 0.00 41.25 41.06 2d3m s ASN 194 CO 0.41 -0.27 1.63 -0.60 -1.51 0.00 0.00 177.10 176.75 2d3m s ARG 195 N 1.78 4.17 0.00 -0.60 3.52 0.17 -1.75 118.95 126.24 2d3m s ARG 195 Ca -0.01 2.49 0.00 0.00 -0.13 0.00 0.00 55.73 58.08 2d3m s ARG 195 Cb -0.17 -3.10 0.00 0.00 -1.56 0.00 0.00 34.95 30.13 2d3m s ARG 195 CO -0.07 -0.66 0.00 0.41 -0.81 0.00 0.00 175.30 174.17 2d3m n GLY 196 N 3.47 2.49 3.73 8.12 0.00 -1.26 -4.94 105.19 116.79 2d3m n GLY 196 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 2d3m n GLY 196 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2d3m s ALA 197 N -2.92 3.82 -0.23 4.61 0.00 -0.72 -4.91 121.76 121.42 2d3m s ALA 197 Ca 0.00 1.48 0.00 0.00 0.00 0.00 0.00 51.96 53.44 2d3m s ALA 197 Cb 0.00 -3.65 0.06 0.00 0.00 0.00 0.00 23.12 19.53 2d3m s ALA 197 CO 0.00 -0.86 -0.04 1.03 0.00 0.00 0.00 175.76 175.89 2d3m s ARG 198 N 0.81 1.52 -0.22 0.00 1.81 -1.26 -4.15 118.95 117.45 2d3m s ARG 198 Ca 0.70 -0.95 -0.17 0.00 -1.72 0.00 0.00 55.73 53.60 2d3m s ARG 198 Cb -0.46 -2.55 -0.03 0.00 -0.45 0.00 0.00 34.95 31.46 2d3m s ARG 198 CO 0.35 -0.61 0.45 0.08 -0.68 0.00 0.00 175.30 174.89 2d3m s VAL 199 N 1.44 5.15 -0.35 3.52 1.01 0.13 -1.46 120.40 129.83 2d3m s VAL 199 Ca -0.05 0.79 -0.14 0.00 0.00 0.00 0.00 61.98 62.57 2d3m s VAL 199 Cb -0.19 -3.77 -0.01 0.00 0.00 0.00 0.00 36.38 32.41 2d3m s VAL 199 CO -0.07 0.19 0.30 -0.22 0.00 0.00 0.00 175.10 175.30 2d3m s LEU 200 N 1.69 4.58 -0.19 3.92 2.96 0.51 -0.40 118.68 131.75 2d3m s LEU 200 Ca 0.20 -0.43 -0.11 0.00 -0.22 0.00 0.00 54.13 53.57 2d3m s LEU 200 Cb -0.15 -2.22 -0.05 0.00 0.50 0.00 0.00 46.19 44.27 2d3m s LEU 200 CO 0.09 -0.31 0.19 -0.69 -1.32 0.00 0.00 176.35 174.31 2d3m s VAL 201 N 1.84 5.37 -0.10 1.68 1.01 0.11 -0.32 120.40 129.99 2d3m s VAL 201 Ca 0.08 0.32 -0.01 0.00 0.00 0.00 0.00 61.98 62.38 2d3m s VAL 201 Cb -0.17 -3.53 0.03 0.00 0.00 0.00 0.00 36.38 32.71 2d3m s VAL 201 CO 0.11 0.42 -0.03 -0.69 0.00 0.00 0.00 175.10 174.91 2d3m s VAL 202 N 0.43 0.65 -0.24 2.92 1.01 0.10 -0.51 120.40 124.77 2d3m s VAL 202 Ca 0.11 -0.11 -0.02 0.00 0.00 0.00 0.00 61.98 61.95 2d3m s VAL 202 Cb -0.12 -0.79 0.01 0.00 0.00 0.00 0.00 36.38 35.49 2d3m s VAL 202 CO 0.00 0.25 -0.06 0.00 0.00 0.00 0.00 175.10 175.30 2d3m s ALA 204 N 1.38 0.37 -0.01 0.00 0.00 -0.25 -0.51 121.76 122.73 2d3m s ALA 204 Ca 0.02 -0.05 0.01 0.00 0.00 0.00 0.00 51.96 51.94 2d3m s ALA 204 Cb -0.16 -0.19 0.01 0.00 0.00 0.00 0.00 23.12 22.78 2d3m s ALA 204 CO -0.04 0.03 -0.02 -1.21 0.00 0.00 0.00 175.76 174.51 2d3m s GLU 205 N 0.35 0.25 -0.42 0.00 0.41 -0.29 -4.30 118.70 114.70 2d3m s GLU 205 Ca -0.04 -0.06 0.02 0.00 -0.41 0.00 0.00 54.97 54.49 2d3m s GLU 205 Cb -0.07 -0.29 0.13 0.00 -1.78 0.00 0.00 34.13 32.12 2d3m s GLU 205 CO -0.01 0.01 0.20 -0.51 -0.49 0.00 0.00 175.26 174.47 2d3m s LEU 206 N 0.21 3.07 0.00 1.80 1.43 -1.26 -2.37 118.68 121.57 2d3m s LEU 206 Ca -0.02 -2.48 0.03 0.00 -1.03 0.00 0.00 54.13 50.64 2d3m s LEU 206 Cb -0.04 -1.16 0.21 0.00 0.03 0.00 0.00 46.19 45.22 2d3m s LEU 206 CO -0.01 -0.30 0.64 0.35 0.23 0.00 0.00 176.35 177.27 2d3m n THR 207 N 3.76 0.00 0.30 5.49 -2.24 -1.26 -3.01 114.28 117.31 2d3m n THR 207 Ca 0.06 0.00 0.17 0.00 -2.27 0.00 0.00 64.05 62.01 2d3m n THR 207 Cb 0.36 -0.88 0.84 0.00 -2.10 0.00 0.00 70.33 68.54 2d3m n THR 207 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 2d3m h ILE 208 N 0.00 0.00 0.00 2.28 2.10 -1.96 -0.37 117.51 119.56 2d3m h ILE 208 Ca 0.00 -0.18 -0.04 0.00 1.08 0.00 0.00 64.86 65.73 2d3m h ILE 208 Cb 0.00 1.03 -0.01 0.00 -1.09 0.00 0.00 36.82 36.76 2d3m h ILE 208 CO 0.00 0.00 -0.17 -0.03 -1.08 0.00 0.00 178.15 176.87 2d3m h MET 209 N 0.00 0.00 0.00 2.19 4.05 -1.87 -2.82 114.93 116.48 2d3m h MET 209 Ca 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.42 2d3m h MET 209 Cb 0.20 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.00 2d3m h MET 209 CO 0.00 0.17 -1.22 -1.33 0.23 0.00 0.00 176.91 174.76 2d3m n MET 210 N -3.72 0.82 -1.99 0.39 2.81 -0.17 -1.28 117.12 113.99 2d3m n MET 210 Ca -0.02 -0.06 -0.42 0.00 -1.81 0.00 0.00 57.70 55.39 2d3m n MET 210 Cb 0.29 -1.39 -0.03 0.00 -0.71 0.00 0.00 33.22 31.37 2d3m n MET 210 CO 0.00 0.00 0.00 -1.17 1.51 0.00 0.00 175.97 176.31 2d3m s LEU 211 N -3.38 4.37 0.25 4.03 2.96 -1.07 -4.87 118.68 120.97 2d3m s LEU 211 Ca 0.02 2.56 -0.22 0.00 -0.22 0.00 0.00 54.13 56.28 2d3m s LEU 211 Cb 0.13 -3.59 0.04 0.00 0.50 0.00 0.00 46.19 43.27 2d3m s LEU 211 CO 0.76 -0.78 0.83 0.00 -1.32 0.00 0.00 176.35 175.84 2d3m s ARG 212 N 1.03 1.63 0.49 1.98 1.70 -1.25 -4.74 118.95 119.79 2d3m s ARG 212 Ca 0.68 -0.94 -0.22 0.00 -0.47 0.00 0.00 55.73 54.79 2d3m s ARG 212 Cb -0.42 0.53 -0.07 0.00 -0.57 0.00 0.00 34.95 34.42 2d3m s ARG 212 CO 0.32 -0.75 1.18 0.00 -1.08 0.00 0.00 175.30 174.97 2d3m s ALA 213 N -3.37 2.89 0.53 7.88 0.00 -0.25 -4.95 121.76 124.49 2d3m s ALA 213 Ca 0.13 0.96 -0.19 0.00 0.00 0.00 0.00 51.96 52.85 2d3m s ALA 213 Cb -0.04 -3.40 -0.07 0.00 0.00 0.00 0.00 23.12 19.61 2d3m s ALA 213 CO 0.06 -0.77 1.08 -1.25 0.00 0.00 0.00 175.76 174.89 2d3m s PRO 214 N -2.85 3.53 0.00 0.00 0.04 -1.26 -4.66 135.00 129.80 2d3m s PRO 214 Ca 0.67 1.46 0.02 0.00 0.04 0.00 0.00 61.00 63.19 2d3m s PRO 214 Cb -0.29 -2.04 -0.01 0.00 0.04 0.00 0.00 34.50 32.20 2d3m s PRO 214 CO 0.34 -0.68 -0.07 1.21 0.04 0.00 0.00 177.00 177.85 2d3m s ASN 215 N -1.96 0.83 0.22 6.66 3.84 -1.26 -5.00 114.94 118.26 2d3m s ASN 215 Ca 0.69 -0.20 -0.03 0.00 0.21 0.00 0.00 52.86 53.54 2d3m s ASN 215 Cb -0.20 -0.07 0.21 0.00 -0.55 0.00 0.00 41.25 40.64 2d3m s ASN 215 CO 0.25 0.04 1.62 -0.33 -2.79 0.00 0.00 177.10 175.89 2d3m h GLU 216 N 5.71 0.67 -0.01 0.43 5.08 -1.98 -2.72 114.58 121.77 2d3m h GLU 216 Ca -0.30 -0.30 0.00 0.00 -1.00 0.00 0.00 59.36 57.76 2d3m h GLU 216 Cb 1.19 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.42 2d3m h GLU 216 CO 0.48 0.89 -0.12 -2.37 -1.00 0.00 0.00 179.01 176.89 2d3m n THR 217 N -4.08 0.00 -2.80 1.13 5.66 -1.26 -3.97 114.28 108.97 2d3m n THR 217 Ca -0.01 -0.12 -0.13 0.00 -3.05 0.00 0.00 64.05 60.74 2d3m n THR 217 Cb 0.47 0.18 0.01 0.00 -1.55 0.00 0.00 70.33 69.43 2d3m n THR 217 CO 0.00 0.00 0.00 1.57 -3.05 0.00 0.00 175.07 173.59 2d3m n HIS 218 N -0.58 1.07 0.22 1.09 -0.00 -1.15 -4.94 115.22 110.93 2d3m n HIS 218 Ca 0.16 -3.11 0.06 0.00 -0.00 0.00 0.00 57.72 54.83 2d3m n HIS 218 Cb 0.31 -0.38 0.55 0.00 -0.00 0.00 0.00 29.99 30.47 2d3m n HIS 218 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.34 177.59 2d3m h LEU 219 N 2.98 0.04 -2.38 0.27 5.85 -1.61 -2.62 115.31 117.84 2d3m h LEU 219 Ca -0.02 -0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.69 2d3m h LEU 219 Cb 1.10 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 42.12 2d3m h LEU 219 CO 0.52 0.12 -0.02 -2.24 -0.34 0.00 0.00 178.44 176.48 2d3m h ASP 220 N 0.05 0.00 -0.01 1.25 3.04 -1.88 -2.27 116.42 116.60 2d3m h ASP 220 Ca 0.01 0.00 -0.22 0.00 -3.24 0.00 0.00 57.03 53.58 2d3m h ASP 220 Cb 0.16 0.00 0.02 0.00 -1.04 0.00 0.00 39.33 38.47 2d3m h ASP 220 CO 0.01 0.02 -0.84 -1.13 -2.04 0.00 0.00 179.24 175.27 2d3m h ASN 221 N 0.00 0.76 0.05 4.15 -1.24 -1.66 -2.79 115.58 114.85 2d3m h ASN 221 Ca -0.00 -0.74 -0.08 0.00 0.71 0.00 0.00 56.30 56.19 2d3m h ASN 221 Cb 0.19 -0.23 -0.01 0.00 0.73 0.00 0.00 38.32 38.99 2d3m h ASN 221 CO 0.00 1.39 -0.24 0.00 -1.29 0.00 0.00 177.43 177.30 2d3m h ALA 222 N 0.38 1.27 -0.47 1.57 0.00 -1.55 -1.89 119.26 118.56 2d3m h ALA 222 Ca -0.10 -0.31 -0.08 0.00 0.00 0.00 0.00 54.91 54.42 2d3m h ALA 222 Cb 1.51 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 19.18 2d3m h ALA 222 CO 0.17 0.49 -0.03 0.82 0.00 0.00 0.00 179.25 180.70 2d3m h ILE 223 N 0.29 1.25 -0.16 0.00 2.04 -1.44 -0.88 117.51 118.60 2d3m h ILE 223 Ca 0.05 -1.05 -0.17 0.00 1.00 0.00 0.00 64.86 64.69 2d3m h ILE 223 Cb 0.59 0.91 -0.01 0.00 -0.74 0.00 0.00 36.82 37.57 2d3m h ILE 223 CO 0.04 0.37 -0.59 1.23 0.00 0.00 0.00 178.15 179.19 2d3m h GLY 224 N 0.97 0.59 2.00 5.37 0.00 -1.16 -2.83 103.07 108.02 2d3m h GLY 224 Ca 0.14 -0.71 -0.03 0.00 0.00 0.00 0.00 47.33 46.73 2d3m h GLY 224 CO 0.02 0.64 -0.13 -2.22 0.00 0.00 0.00 176.54 174.85 2d3m h ILE 225 N 0.40 0.35 0.00 2.60 2.04 -0.83 -0.81 117.51 121.27 2d3m h ILE 225 Ca -0.00 -0.82 0.00 0.00 1.00 0.00 0.00 64.86 65.03 2d3m h ILE 225 Cb 1.15 1.62 0.00 0.00 -0.74 0.00 0.00 36.82 38.84 2d3m h ILE 225 CO 0.11 0.13 -0.04 -1.54 0.00 0.00 0.00 178.15 176.81 2d3m n SER 226 N -3.31 0.61 -0.11 1.72 3.41 -0.38 -4.07 113.62 111.48 2d3m n SER 226 Ca 0.00 0.52 -0.21 0.00 -0.26 0.00 0.00 58.87 58.92 2d3m n SER 226 Cb 0.36 -0.66 -0.09 0.00 -0.26 0.00 0.00 64.21 63.56 2d3m n SER 226 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2d3m n LEU 227 N -2.06 2.24 -4.70 1.04 4.77 -0.72 -5.00 117.00 112.58 2d3m n LEU 227 Ca 0.06 0.11 -0.42 0.00 -0.03 0.00 0.00 56.01 55.73 2d3m n LEU 227 Cb 0.41 -0.73 -0.03 0.00 -2.33 0.00 0.00 43.42 40.74 2d3m n LEU 227 CO 0.30 0.66 1.17 -0.36 -1.33 0.00 0.00 177.39 177.83 2d3m s PHE 228 N -2.44 2.91 0.18 -1.77 2.99 -0.39 -1.35 117.98 118.11 2d3m s PHE 228 Ca -0.32 0.71 0.05 0.00 0.00 0.00 0.00 56.93 57.37 2d3m s PHE 228 Cb 0.10 -3.78 -0.05 0.00 0.00 0.00 0.00 43.02 39.29 2d3m s PHE 228 CO 0.46 -2.93 -0.09 0.20 -0.00 0.00 0.00 175.22 172.85 2d3m s GLY 229 N 1.64 1.26 0.25 4.36 0.00 0.18 -4.87 107.32 110.15 2d3m s GLY 229 Ca 0.68 -1.59 -0.10 0.00 0.00 0.00 0.00 44.72 43.71 2d3m s GLY 229 CO 0.30 -1.65 0.57 0.99 0.00 0.00 0.00 173.10 173.30 2d3m s ASP 230 N -3.24 6.61 0.00 1.64 1.01 -0.31 -4.08 116.67 118.30 2d3m s ASP 230 Ca 0.20 0.93 0.00 0.00 0.71 0.00 0.00 52.55 54.40 2d3m s ASP 230 Cb 0.02 -2.23 0.00 0.00 1.01 0.00 0.00 42.92 41.72 2d3m s ASP 230 CO 0.04 -0.11 0.00 0.61 0.21 0.00 0.00 175.17 175.92 2d3m n GLY 231 N -0.27 1.35 2.90 0.21 0.00 -1.00 -4.51 105.19 103.87 2d3m n GLY 231 Ca 0.01 -0.89 -0.11 0.00 0.00 0.00 0.00 46.02 45.02 2d3m n GLY 231 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2d3m s ALA 232 N -2.00 0.02 -0.03 4.61 0.00 0.79 -1.13 121.76 124.01 2d3m s ALA 232 Ca 0.00 -0.12 0.02 0.00 0.00 0.00 0.00 51.96 51.86 2d3m s ALA 232 Cb 0.00 0.03 0.01 0.00 0.00 0.00 0.00 23.12 23.16 2d3m s ALA 232 CO 0.00 -0.04 -0.06 0.00 0.00 0.00 0.00 175.76 175.66 2d3m s ALA 233 N -0.33 0.69 -0.02 0.00 0.00 0.33 -0.83 121.76 121.60 2d3m s ALA 233 Ca -0.04 -0.18 0.04 0.00 0.00 0.00 0.00 51.96 51.78 2d3m s ALA 233 Cb -0.02 -0.32 -0.00 0.00 0.00 0.00 0.00 23.12 22.77 2d3m s ALA 233 CO -0.00 0.07 -0.13 0.00 0.00 0.00 0.00 175.76 175.70 2d3m s ALA 234 N 0.46 1.10 0.04 0.00 0.00 0.14 -0.36 121.76 123.14 2d3m s ALA 234 Ca -0.06 -0.52 0.04 0.00 0.00 0.00 0.00 51.96 51.43 2d3m s ALA 234 Cb -0.10 -0.34 -0.02 0.00 0.00 0.00 0.00 23.12 22.66 2d3m s ALA 234 CO 0.00 0.23 -0.13 -0.51 0.00 0.00 0.00 175.76 175.35 2d3m s LEU 235 N -0.08 2.18 -0.22 0.00 1.02 0.34 -0.21 118.68 121.71 2d3m s LEU 235 Ca 0.01 -0.46 -0.04 0.00 0.02 0.00 0.00 54.13 53.66 2d3m s LEU 235 Cb -0.07 -0.52 -0.01 0.00 0.02 0.00 0.00 46.19 45.61 2d3m s LEU 235 CO 0.00 -0.00 -0.03 -0.63 0.02 0.00 0.00 176.35 175.71 2d3m s ILE 236 N -0.91 3.48 -0.04 -0.59 1.01 -0.46 0.07 121.20 123.76 2d3m s ILE 236 Ca -0.00 -0.47 0.06 0.00 0.00 0.00 0.00 60.65 60.24 2d3m s ILE 236 Cb -0.08 -2.59 -0.01 0.00 0.01 0.00 0.00 42.46 39.79 2d3m s ILE 236 CO 0.01 0.41 -0.23 -0.63 0.00 0.00 0.00 174.94 174.49 2d3m s ILE 237 N 1.49 1.90 -0.03 2.92 1.01 0.47 -0.60 121.20 128.36 2d3m s ILE 237 Ca 0.06 -1.00 -0.29 0.00 0.00 0.00 0.00 60.65 59.42 2d3m s ILE 237 Cb -0.14 -1.60 0.09 0.00 0.01 0.00 0.00 42.46 40.82 2d3m s ILE 237 CO -0.03 0.53 0.79 -0.83 0.00 0.00 0.00 174.94 175.41 2d3m s GLY 238 N -0.27 -0.49 0.41 6.18 0.00 -0.44 0.22 107.32 112.93 2d3m s GLY 238 Ca 0.01 1.29 -0.01 0.00 0.00 0.00 0.00 44.72 46.00 2d3m s GLY 238 CO 0.02 0.71 0.64 -0.56 0.00 0.00 0.00 173.10 173.90 2d3m s SER 239 N -1.72 6.17 -0.76 1.64 0.01 -1.26 -0.42 113.70 117.37 2d3m s SER 239 Ca -0.03 0.53 -0.01 0.00 1.31 0.00 0.00 55.95 57.75 2d3m s SER 239 Cb -0.00 -1.97 0.00 0.00 0.21 0.00 0.00 66.02 64.26 2d3m s SER 239 CO -0.00 -0.47 0.66 0.47 0.41 0.00 0.00 173.24 174.31 2d3m n ASP 240 N -1.98 -6.71 -4.77 2.44 8.00 -1.26 -4.73 116.55 107.54 2d3m n ASP 240 Ca -0.02 -0.38 -0.41 0.00 0.71 0.00 0.00 54.79 54.69 2d3m n ASP 240 Cb 0.56 -3.95 -0.01 0.00 -0.02 0.00 0.00 41.12 37.71 2d3m n ASP 240 CO 0.00 0.00 0.00 -2.84 -0.39 0.00 0.00 177.20 173.97 2d3m s PRO 241 N -3.68 4.12 -0.37 -0.24 0.02 -1.26 -3.12 135.00 130.46 2d3m s PRO 241 Ca 0.01 2.57 -0.28 0.00 0.02 0.00 0.00 61.00 63.32 2d3m s PRO 241 Cb -0.00 -2.99 0.02 0.00 0.02 0.00 0.00 34.50 31.55 2d3m s PRO 241 CO 0.81 -0.57 1.06 0.42 -0.33 0.00 0.00 177.00 178.39 2d3m s ILE 242 N -0.70 4.45 0.15 2.83 1.01 -1.26 -2.56 121.20 125.13 2d3m s ILE 242 Ca 0.57 1.49 -0.31 0.00 0.00 0.00 0.00 60.65 62.39 2d3m s ILE 242 Cb -0.47 -4.44 -0.09 0.00 0.01 0.00 0.00 42.46 37.46 2d3m s ILE 242 CO 0.57 -0.63 1.49 -0.63 0.00 0.00 0.00 174.94 175.75 2d3m s ILE 243 N 3.81 2.89 0.00 2.92 -1.09 -1.26 -0.90 121.20 127.58 2d3m s ILE 243 Ca 0.44 0.65 0.00 0.00 -2.23 0.00 0.00 60.65 59.51 2d3m s ILE 243 Cb -0.11 -3.41 0.00 0.00 -1.58 0.00 0.00 42.46 37.36 2d3m s ILE 243 CO 0.20 0.05 0.00 0.61 -1.23 0.00 0.00 174.94 174.57 2d3m n GLY 244 N 3.59 2.56 0.80 6.18 0.00 -1.26 -4.79 105.19 112.28 2d3m n GLY 244 Ca 0.13 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.09 2d3m n GLY 244 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2d3m n VAL 245 N -2.00 0.62 -3.43 1.61 0.31 -1.06 -5.07 118.33 109.31 2d3m n VAL 245 Ca 0.00 0.02 -0.26 0.00 -0.01 0.00 0.00 64.34 64.09 2d3m n VAL 245 Cb 0.00 -1.64 -0.02 0.00 -0.91 0.00 0.00 33.84 31.27 2d3m n VAL 245 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 2d3m s GLU 246 N -2.15 3.54 -0.71 5.55 2.02 -0.07 -4.90 118.70 121.97 2d3m s GLU 246 Ca -0.09 -0.22 -0.01 0.00 0.02 0.00 0.00 54.97 54.68 2d3m s GLU 246 Cb 0.03 -2.70 0.18 0.00 0.10 0.00 0.00 34.13 31.74 2d3m s GLU 246 CO 0.11 0.23 0.54 0.21 0.02 0.00 0.00 175.26 176.37 2d3m s LYS 247 N -3.82 2.73 -0.03 1.61 2.20 -1.26 -4.77 119.74 116.39 2d3m s LYS 247 Ca 0.41 -2.90 -0.30 0.00 -0.36 0.00 0.00 55.97 52.82 2d3m s LYS 247 Cb -0.10 -3.73 -0.06 0.00 -1.51 0.00 0.00 37.83 32.43 2d3m s LYS 247 CO 0.32 -1.21 1.62 -1.25 -0.36 0.00 0.00 175.35 174.47 2d3m s PRO 248 N -0.70 4.20 -0.02 4.03 0.04 -1.26 -4.27 135.00 137.01 2d3m s PRO 248 Ca 0.21 2.17 -0.05 0.00 0.04 0.00 0.00 61.00 63.37 2d3m s PRO 248 Cb -0.14 -3.88 -0.03 0.00 0.04 0.00 0.00 34.50 30.49 2d3m s PRO 248 CO -0.08 -0.80 -0.11 -1.33 0.04 0.00 0.00 177.00 174.72 2d3m n MET 249 N 6.72 0.18 -4.31 4.56 2.81 0.07 -4.71 117.12 122.44 2d3m n MET 249 Ca 0.17 0.07 -0.25 0.00 -1.81 0.00 0.00 57.70 55.88 2d3m n MET 249 Cb 0.43 -0.80 -0.17 0.00 -0.71 0.00 0.00 33.22 31.96 2d3m n MET 249 CO 0.00 0.00 0.00 -0.06 1.51 0.00 0.00 175.97 177.42 2d3m s PHE 250 N -2.25 1.44 -0.17 2.03 0.40 -1.19 -1.17 117.98 117.08 2d3m s PHE 250 Ca -0.10 -0.60 -0.17 0.00 -0.60 0.00 0.00 56.93 55.46 2d3m s PHE 250 Cb 0.02 -1.12 -0.04 0.00 0.51 0.00 0.00 43.02 42.40 2d3m s PHE 250 CO 0.14 -0.36 0.42 -1.21 0.70 0.00 0.00 175.22 174.92 2d3m s GLU 251 N 1.06 4.24 -0.84 0.44 2.02 0.15 -0.30 118.70 125.47 2d3m s GLU 251 Ca -0.07 0.29 -0.19 0.00 0.02 0.00 0.00 54.97 55.02 2d3m s GLU 251 Cb -0.15 -3.49 0.13 0.00 0.10 0.00 0.00 34.13 30.72 2d3m s GLU 251 CO -0.01 0.05 1.02 0.42 0.02 0.00 0.00 175.26 176.76 2d3m s ILE 252 N 1.02 4.75 -0.02 -1.63 1.01 0.78 -0.75 121.20 126.37 2d3m s ILE 252 Ca 0.22 -1.39 -0.20 0.00 0.00 0.00 0.00 60.65 59.27 2d3m s ILE 252 Cb -0.15 -4.70 -0.29 0.00 0.01 0.00 0.00 42.46 37.33 2d3m s ILE 252 CO 0.08 -1.41 0.98 0.58 0.00 0.00 0.00 174.94 175.17 2d3m h VAL 253 N 5.77 1.46 -2.90 2.92 2.07 -1.48 -3.39 116.25 120.69 2d3m h VAL 253 Ca 0.03 -2.39 -0.16 0.00 0.82 0.00 0.00 66.70 65.00 2d3m h VAL 253 Cb 1.04 2.96 -0.27 0.00 -1.52 0.00 0.00 31.29 33.50 2d3m h VAL 253 CO 1.09 0.69 -0.38 0.00 0.02 0.00 0.00 177.57 178.98 2d3m s THR 255 N 0.91 0.59 -0.02 0.00 -4.23 -1.26 0.01 115.64 111.63 2d3m s THR 255 Ca -0.06 -0.39 0.03 0.00 -1.18 0.00 0.00 61.69 60.09 2d3m s THR 255 Cb -0.07 -0.94 -0.00 0.00 1.34 0.00 0.00 72.50 72.82 2d3m s THR 255 CO -0.06 -0.02 -0.11 -0.54 -0.54 0.00 0.00 174.62 173.34 2d3m s LYS 256 N 1.85 1.01 -0.17 3.99 1.02 -0.49 -5.01 119.74 121.94 2d3m s LYS 256 Ca 0.01 -0.39 -0.06 0.00 0.02 0.00 0.00 55.97 55.54 2d3m s LYS 256 Cb -0.15 -0.95 -0.04 0.00 -0.52 0.00 0.00 37.83 36.17 2d3m s LYS 256 CO -0.07 0.20 0.04 -1.14 -0.92 0.00 0.00 175.35 173.47 2d3m s GLN 257 N -0.10 3.84 -0.02 1.68 0.74 -1.26 -0.61 119.66 123.92 2d3m s GLN 257 Ca 0.01 -0.37 0.04 0.00 0.05 0.00 0.00 55.36 55.10 2d3m s GLN 257 Cb -0.06 -3.13 -0.01 0.00 1.10 0.00 0.00 33.01 30.91 2d3m s GLN 257 CO 0.00 0.32 -0.15 0.99 -0.55 0.00 0.00 175.29 175.90 2d3m s THR 258 N 0.22 1.23 -0.17 -0.34 2.01 0.89 -4.98 115.64 114.50 2d3m s THR 258 Ca 0.03 -0.63 -0.07 0.00 0.31 0.00 0.00 61.69 61.32 2d3m s THR 258 Cb -0.13 -1.04 -0.04 0.00 0.01 0.00 0.00 72.50 71.30 2d3m s THR 258 CO 0.01 0.35 0.07 -0.69 -0.69 0.00 0.00 174.62 173.67 2d3m s VAL 259 N -0.15 4.85 -0.26 3.82 1.01 -1.26 -0.11 120.40 128.29 2d3m s VAL 259 Ca 0.01 -0.02 -0.21 0.00 0.00 0.00 0.00 61.98 61.77 2d3m s VAL 259 Cb -0.08 -3.17 -0.01 0.00 0.00 0.00 0.00 36.38 33.12 2d3m s VAL 259 CO 0.00 0.49 0.67 -0.63 0.00 0.00 0.00 175.10 175.64 2d3m s ILE 260 N 0.11 4.94 0.58 2.22 1.01 0.51 -5.01 121.20 125.56 2d3m s ILE 260 Ca 0.05 1.16 -0.21 0.00 0.00 0.00 0.00 60.65 61.66 2d3m s ILE 260 Cb -0.12 -3.99 -0.04 0.00 0.01 0.00 0.00 42.46 38.32 2d3m s ILE 260 CO 0.00 -0.04 1.35 -2.84 0.00 0.00 0.00 174.94 173.42 2d3m s PRO 261 N 2.61 2.95 -1.47 2.79 0.02 -1.26 -3.65 135.00 136.98 2d3m s PRO 261 Ca 0.28 2.21 -0.07 0.00 0.02 0.00 0.00 61.00 63.44 2d3m s PRO 261 Cb -0.15 -2.14 0.02 0.00 0.02 0.00 0.00 34.50 32.26 2d3m s PRO 261 CO 0.09 -1.34 0.81 0.09 -0.33 0.00 0.00 177.00 176.32 2d3m n ASN 262 N -1.30 -5.81 -0.80 2.53 3.02 -1.26 -4.91 115.26 106.74 2d3m n ASN 262 Ca 0.12 -0.43 0.04 0.00 -0.03 0.00 0.00 54.58 54.28 2d3m n ASN 262 Cb 0.46 -4.65 0.07 0.00 -0.61 0.00 0.00 39.78 35.04 2d3m n ASN 262 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2d3m n THR 263 N -4.62 0.70 -0.23 3.41 -2.24 -1.24 -4.87 114.28 105.18 2d3m n THR 263 Ca -0.05 -1.30 -0.03 0.00 -2.27 0.00 0.00 64.05 60.40 2d3m n THR 263 Cb 0.58 0.43 0.14 0.00 -2.10 0.00 0.00 70.33 69.38 2d3m n THR 263 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 2d3m h GLU 264 N 0.53 1.05 0.00 -0.78 4.81 -1.78 -2.76 114.58 115.65 2d3m h GLU 264 Ca -0.08 -0.16 0.00 0.00 -0.13 0.00 0.00 59.36 58.99 2d3m h GLU 264 Cb 1.44 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 30.64 2d3m h GLU 264 CO 0.04 0.83 0.00 -0.25 -0.73 0.00 0.00 179.01 178.90 2d3m n ASP 265 N -4.31 0.00 -0.02 1.04 9.92 -1.26 -4.00 116.55 117.91 2d3m n ASP 265 Ca 0.07 -1.08 -0.11 0.00 -0.53 0.00 0.00 54.79 53.14 2d3m n ASP 265 Cb 0.16 0.00 -0.09 0.00 -0.64 0.00 0.00 41.12 40.55 2d3m n ASP 265 CO 0.00 0.00 0.00 0.58 0.13 0.00 0.00 177.20 177.91 2d3m h VAL 266 N 0.00 1.21 -3.52 2.53 2.07 -1.85 -3.42 116.25 113.28 2d3m h VAL 266 Ca 0.00 -1.63 -0.61 0.00 0.82 0.00 0.00 66.70 65.28 2d3m h VAL 266 Cb 0.00 2.18 -0.38 0.00 -1.52 0.00 0.00 31.29 31.57 2d3m h VAL 266 CO 0.00 0.37 -0.80 -0.63 0.02 0.00 0.00 177.57 176.53 2d3m s ILE 267 N -2.79 1.56 -0.05 4.57 1.01 -1.26 -1.10 121.20 123.15 2d3m s ILE 267 Ca -0.14 -1.08 0.04 0.00 0.00 0.00 0.00 60.65 59.47 2d3m s ILE 267 Cb -0.01 -1.73 -0.00 0.00 0.01 0.00 0.00 42.46 40.73 2d3m s ILE 267 CO 0.53 0.05 -0.17 -1.00 0.00 0.00 0.00 174.94 174.35 2d3m s HIS 268 N 1.41 1.73 -0.06 3.97 3.76 -0.65 -4.02 115.29 121.43 2d3m s HIS 268 Ca -0.03 -0.51 -0.02 0.00 -0.15 0.00 0.00 55.06 54.35 2d3m s HIS 268 Cb -0.17 -1.17 0.03 0.00 1.11 0.00 0.00 32.58 32.38 2d3m s HIS 268 CO -0.07 -0.18 0.02 -0.51 -0.85 0.00 0.00 174.74 173.15 2d3m s LEU 269 N 0.07 0.43 -0.09 0.89 1.02 -1.26 -0.40 118.68 119.35 2d3m s LEU 269 Ca -0.05 -0.02 0.03 0.00 0.02 0.00 0.00 54.13 54.11 2d3m s LEU 269 Cb -0.12 -0.31 -0.02 0.00 0.02 0.00 0.00 46.19 45.76 2d3m s LEU 269 CO 0.02 -0.21 -0.17 -1.00 0.02 0.00 0.00 176.35 175.01 2d3m s HIS 270 N 2.02 2.66 -0.49 0.29 3.76 -0.61 -4.93 115.29 118.00 2d3m s HIS 270 Ca 0.05 -0.55 -0.21 0.00 -0.15 0.00 0.00 55.06 54.19 2d3m s HIS 270 Cb -0.12 -1.71 0.04 0.00 1.11 0.00 0.00 32.58 31.90 2d3m s HIS 270 CO -0.04 -0.11 0.72 -1.17 -0.85 0.00 0.00 174.74 173.28 2d3m s LEU 271 N -0.10 4.54 0.00 0.89 2.96 -1.26 -0.55 118.68 125.16 2d3m s LEU 271 Ca -0.03 -0.51 0.01 0.00 -0.22 0.00 0.00 54.13 53.37 2d3m s LEU 271 Cb -0.14 -2.68 0.01 0.00 0.50 0.00 0.00 46.19 43.87 2d3m s LEU 271 CO 0.04 -0.93 0.05 0.54 -1.32 0.00 0.00 176.35 174.72 2d3m n ARG 272 N 6.55 1.14 0.20 1.98 5.12 -0.05 -4.98 116.66 126.63 2d3m n ARG 272 Ca -0.02 -2.46 0.15 0.00 -1.93 0.00 0.00 57.85 53.59 2d3m n ARG 272 Cb 0.47 0.59 0.69 0.00 -1.16 0.00 0.00 32.46 33.05 2d3m n ARG 272 CO 0.00 0.00 0.00 0.93 -1.93 0.00 0.00 177.63 176.63 2d3m h GLU 273 N 0.00 0.00 -0.70 5.56 5.08 -1.98 -0.22 114.58 122.32 2d3m h GLU 273 Ca -0.28 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.08 2d3m h GLU 273 Cb 0.86 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.11 2d3m h GLU 273 CO 0.45 0.00 0.00 0.25 -1.00 0.00 0.00 179.01 178.71 2d3m n THR 274 N -2.55 1.27 -1.74 1.13 -2.24 -1.26 -1.13 114.28 107.76 2d3m n THR 274 Ca -0.00 -1.07 0.00 0.00 -2.27 0.00 0.00 64.05 60.71 2d3m n THR 274 Cb 0.15 0.38 0.00 0.00 -2.10 0.00 0.00 70.33 68.76 2d3m n THR 274 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2d3m n GLY 275 N 1.46 -1.20 3.62 3.38 0.00 -0.10 -4.62 105.19 107.73 2d3m n GLY 275 Ca 0.25 -1.64 -0.42 0.00 0.00 0.00 0.00 46.02 44.20 2d3m n GLY 275 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2d3m s MET 276 N 0.00 4.00 -0.28 1.61 1.75 -0.40 -0.87 119.30 125.11 2d3m s MET 276 Ca 0.00 0.77 -0.17 0.00 -1.25 0.00 0.00 55.69 55.04 2d3m s MET 276 Cb 0.00 -3.73 -0.03 0.00 2.84 0.00 0.00 34.83 33.91 2d3m s MET 276 CO 0.00 -0.77 0.47 -1.64 -0.65 0.00 0.00 175.02 172.43 2d3m s MET 277 N 3.22 3.96 -0.16 4.11 -1.94 0.28 -4.42 119.30 124.36 2d3m s MET 277 Ca 0.37 0.14 -0.13 0.00 -1.71 0.00 0.00 55.69 54.36 2d3m s MET 277 Cb -0.13 -3.68 -0.05 0.00 2.01 0.00 0.00 34.83 32.97 2d3m s MET 277 CO 0.14 -0.39 0.25 0.12 -0.01 0.00 0.00 175.02 175.13 2d3m s PHE 278 N 2.25 3.46 -0.05 -0.03 5.36 -1.26 -1.57 117.98 126.14 2d3m s PHE 278 Ca 0.19 0.54 0.03 0.00 -0.96 0.00 0.00 56.93 56.72 2d3m s PHE 278 Cb -0.16 -2.28 0.01 0.00 -0.34 0.00 0.00 43.02 40.26 2d3m s PHE 278 CO 0.10 0.29 -0.12 0.71 -1.46 0.00 0.00 175.22 174.73 2d3m s TYR 279 N 0.33 1.40 -0.04 10.12 2.02 0.46 -4.33 117.35 127.30 2d3m s TYR 279 Ca 0.14 -0.46 -0.02 0.00 -0.37 0.00 0.00 57.07 56.37 2d3m s TYR 279 Cb -0.13 -1.01 0.03 0.00 -0.40 0.00 0.00 41.96 40.46 2d3m s TYR 279 CO 0.03 -0.22 0.09 -1.17 -1.57 0.00 0.00 175.55 172.71 2d3m s LEU 280 N 0.45 0.84 0.40 -1.29 2.96 -1.26 -1.64 118.68 119.15 2d3m s LEU 280 Ca -0.10 0.18 -0.05 0.00 -0.22 0.00 0.00 54.13 53.94 2d3m s LEU 280 Cb -0.14 0.15 -0.04 0.00 0.50 0.00 0.00 46.19 46.66 2d3m s LEU 280 CO 0.03 -0.15 0.69 -0.44 -1.32 0.00 0.00 176.35 175.16 2d3m s SER 281 N 1.19 6.35 0.49 3.68 0.01 -0.25 -4.78 113.70 120.39 2d3m s SER 281 Ca -0.08 0.83 0.25 0.00 1.31 0.00 0.00 55.95 58.26 2d3m s SER 281 Cb -0.12 -2.20 1.28 0.00 0.21 0.00 0.00 66.02 65.19 2d3m s SER 281 CO -0.05 -0.41 2.00 0.11 0.41 0.00 0.00 173.24 175.31 2d3m h LYS 282 N 0.82 0.00 -0.51 12.44 6.56 -1.98 -3.26 116.57 130.63 2d3m h LYS 282 Ca -0.48 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.11 2d3m h LYS 282 Cb 1.20 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.86 2d3m h LYS 282 CO 0.63 0.16 0.00 0.41 -2.06 0.00 0.00 179.45 178.59 2d3m n GLY 283 N -0.51 0.67 0.28 3.86 0.00 -1.26 -4.47 105.19 103.76 2d3m n GLY 283 Ca -0.01 -0.16 -0.08 0.00 0.00 0.00 0.00 46.02 45.76 2d3m n GLY 283 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2d3m h SER 284 N 0.80 0.92 -0.39 1.61 4.64 -1.93 -2.31 113.55 116.89 2d3m h SER 284 Ca 0.00 -0.24 -0.10 0.00 -0.47 0.00 0.00 61.79 60.97 2d3m h SER 284 Cb 0.47 -0.24 -0.02 0.00 -0.31 0.00 0.00 62.40 62.30 2d3m h SER 284 CO 0.04 0.93 -0.13 -0.65 -0.87 0.00 0.00 176.83 176.15 2d3m h PRO 285 N 0.87 0.86 -0.26 4.77 0.11 -1.90 -2.66 132.00 133.78 2d3m h PRO 285 Ca 0.18 -0.31 -0.07 0.00 0.11 0.00 0.00 66.00 65.92 2d3m h PRO 285 Cb 0.38 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.42 2d3m h PRO 285 CO 0.01 0.94 -0.12 0.52 -0.21 0.00 0.00 178.00 179.14 2d3m h MET 286 N 0.76 0.54 -0.46 1.05 2.86 -1.88 -2.25 114.93 115.56 2d3m h MET 286 Ca 0.12 -0.23 -0.10 0.00 -2.06 0.00 0.00 59.70 57.43 2d3m h MET 286 Cb 0.64 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.27 2d3m h MET 286 CO 0.04 0.79 -0.11 1.15 1.06 0.00 0.00 176.91 179.84 2d3m h THR 287 N 0.28 1.26 -0.21 2.22 2.02 -1.42 -1.28 112.91 115.78 2d3m h THR 287 Ca 0.06 -1.20 -0.06 0.00 0.77 0.00 0.00 66.41 65.98 2d3m h THR 287 Cb 0.62 1.03 -0.01 0.00 -1.74 0.00 0.00 68.15 68.05 2d3m h THR 287 CO 0.04 0.41 -0.09 0.40 0.37 0.00 0.00 175.52 176.65 2d3m h ILE 288 N 0.76 1.30 -0.54 3.11 2.04 -1.48 -3.11 117.51 119.59 2d3m h ILE 288 Ca 0.12 -1.13 -0.07 0.00 1.00 0.00 0.00 64.86 64.78 2d3m h ILE 288 Cb 0.62 1.61 -0.02 0.00 -0.74 0.00 0.00 36.82 38.28 2d3m h ILE 288 CO 0.04 0.34 0.06 0.77 0.00 0.00 0.00 178.15 179.36 2d3m h SER 289 N 0.13 0.83 0.77 1.72 4.64 -1.28 -0.93 113.55 119.42 2d3m h SER 289 Ca 0.05 -0.19 0.00 0.00 -0.47 0.00 0.00 61.79 61.18 2d3m h SER 289 Cb 0.57 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 62.44 2d3m h SER 289 CO 0.03 0.86 0.00 0.59 -0.87 0.00 0.00 176.83 177.44 2d3m n ASN 290 N -4.23 0.48 -0.00 4.97 3.02 -0.49 -3.38 115.26 115.62 2d3m n ASN 290 Ca 0.03 0.60 0.00 0.00 -0.03 0.00 0.00 54.58 55.19 2d3m n ASN 290 Cb 0.28 -0.71 -0.00 0.00 -0.61 0.00 0.00 39.78 38.74 2d3m n ASN 290 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2d3m n ASN 291 N -2.01 0.20 -0.21 6.41 3.02 -1.03 -4.77 115.26 116.86 2d3m n ASN 291 Ca 0.03 -0.60 -0.05 0.00 -0.03 0.00 0.00 54.58 53.93 2d3m n ASN 291 Cb 0.24 0.81 0.11 0.00 -0.61 0.00 0.00 39.78 40.33 2d3m n ASN 291 CO 0.00 0.00 0.00 1.62 -2.62 0.00 0.00 177.26 176.26 2d3m h VAL 292 N 0.00 1.25 -0.62 2.41 3.04 -1.19 -2.99 116.25 118.15 2d3m h VAL 292 Ca 0.00 -0.89 -0.05 0.00 -1.01 0.00 0.00 66.70 64.76 2d3m h VAL 292 Cb 0.00 0.54 -0.03 0.00 -2.01 0.00 0.00 31.29 29.80 2d3m h VAL 292 CO 0.00 0.34 0.20 -0.08 -1.01 0.00 0.00 177.57 177.02 2d3m h GLU 293 N 0.99 0.93 -0.30 4.17 4.81 -1.86 -1.61 114.58 121.71 2d3m h GLU 293 Ca 0.21 -0.17 -0.07 0.00 -0.13 0.00 0.00 59.36 59.20 2d3m h GLU 293 Cb 0.31 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.53 2d3m h GLU 293 CO -0.00 0.79 -0.13 0.00 -0.73 0.00 0.00 179.01 178.94 2d3m h ALA 294 N 1.32 1.22 -0.28 2.92 0.00 -1.86 -0.18 119.26 122.41 2d3m h ALA 294 Ca 0.20 -0.28 -0.15 0.00 0.00 0.00 0.00 54.91 54.69 2d3m h ALA 294 Cb 0.25 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 2d3m h ALA 294 CO -0.01 0.50 -0.44 0.00 0.00 0.00 0.00 179.25 179.30 2d3m h LEU 296 N 0.58 0.85 -0.88 0.00 3.38 -0.80 -1.88 115.31 116.56 2d3m h LEU 296 Ca 0.04 -0.51 -0.03 0.00 0.09 0.00 0.00 57.88 57.47 2d3m h LEU 296 Cb 1.00 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 41.46 2d3m h LEU 296 CO 0.09 1.20 0.41 0.40 0.09 0.00 0.00 178.44 180.63 2d3m h ILE 297 N 0.53 1.26 -0.16 1.22 2.04 -0.99 -2.19 117.51 119.22 2d3m h ILE 297 Ca 0.03 -0.72 -0.01 0.00 1.00 0.00 0.00 64.86 65.16 2d3m h ILE 297 Cb 1.01 0.16 -0.01 0.00 -0.74 0.00 0.00 36.82 37.25 2d3m h ILE 297 CO 0.10 0.31 0.06 -0.78 0.00 0.00 0.00 178.15 177.84 2d3m h ASP 298 N 1.21 0.23 -0.25 1.72 3.58 -1.21 -0.64 116.42 121.06 2d3m h ASP 298 Ca 0.29 -0.17 -0.04 0.00 0.42 0.00 0.00 57.03 57.53 2d3m h ASP 298 Cb 0.11 -0.06 -0.02 0.00 1.72 0.00 0.00 39.33 41.08 2d3m h ASP 298 CO -0.04 0.34 0.03 1.62 -2.88 0.00 0.00 179.24 178.32 2d3m h VAL 299 N 0.10 1.18 0.01 2.25 3.04 -1.07 -0.92 116.25 120.84 2d3m h VAL 299 Ca 0.05 -0.70 -0.08 0.00 -1.01 0.00 0.00 66.70 64.96 2d3m h VAL 299 Cb 0.19 0.89 0.01 0.00 -2.01 0.00 0.00 31.29 30.36 2d3m h VAL 299 CO -0.00 0.24 -0.33 -0.26 -1.01 0.00 0.00 177.57 176.21 2d3m h PHE 300 N 0.50 0.32 0.00 3.17 0.04 -1.26 -3.30 116.94 116.42 2d3m h PHE 300 Ca 0.11 -0.18 -0.05 0.00 2.80 0.00 0.00 57.97 60.65 2d3m h PHE 300 Cb 0.27 -0.03 -0.01 0.00 2.20 0.00 0.00 35.95 38.38 2d3m h PHE 300 CO 0.01 1.00 -0.24 0.87 -0.60 0.00 0.00 178.31 179.35 2d3m h LYS 301 N -0.45 0.00 0.00 1.51 1.57 -0.99 -1.18 116.57 117.03 2d3m h LYS 301 Ca -0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2d3m h LYS 301 Cb 1.10 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.41 2d3m h LYS 301 CO 0.06 0.24 0.00 0.77 -0.57 0.00 0.00 179.45 179.96 2d3m h SER 302 N 0.00 0.00 -0.02 0.86 0.02 -1.24 -2.06 113.55 111.11 2d3m h SER 302 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2d3m h SER 302 Cb 0.51 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.05 2d3m h SER 302 CO 0.03 0.00 0.00 1.33 -1.14 0.00 0.00 176.83 177.05 2d3m n VAL 303 N -2.47 1.67 -1.04 2.27 0.24 -0.98 -4.99 118.33 113.03 2d3m n VAL 303 Ca 0.01 -1.92 -0.01 0.00 -2.04 0.00 0.00 64.34 60.38 2d3m n VAL 303 Cb 0.20 -0.04 -0.01 0.00 -1.47 0.00 0.00 33.84 32.52 2d3m n VAL 303 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2d3m n GLY 304 N -1.14 0.42 3.76 7.63 0.00 -0.78 -5.01 105.19 110.06 2d3m n GLY 304 Ca 0.12 -0.10 -0.38 0.00 0.00 0.00 0.00 46.02 45.66 2d3m n GLY 304 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2d3m s ILE 305 N -1.71 5.17 -0.01 -0.61 1.01 -0.48 -4.98 121.20 119.59 2d3m s ILE 305 Ca 0.00 0.81 -0.30 0.00 0.00 0.00 0.00 60.65 61.16 2d3m s ILE 305 Cb 0.00 -3.74 -0.05 0.00 0.01 0.00 0.00 42.46 38.69 2d3m s ILE 305 CO 0.00 0.42 1.30 -0.89 0.00 0.00 0.00 174.94 175.77 2d3m s THR 306 N 0.08 3.94 0.22 2.92 2.01 -1.26 -3.33 115.64 120.23 2d3m s THR 306 Ca 0.23 1.31 -0.32 0.00 0.31 0.00 0.00 61.69 63.22 2d3m s THR 306 Cb -0.15 -3.84 -0.13 0.00 0.01 0.00 0.00 72.50 68.39 2d3m s THR 306 CO 0.09 0.01 1.58 -2.65 -0.69 0.00 0.00 174.62 172.96 2d3m n PRO 307 N 5.15 2.42 -1.86 4.92 -0.02 -1.26 -4.92 135.00 139.42 2d3m n PRO 307 Ca 0.12 0.87 -0.41 0.00 -2.02 0.00 0.00 63.50 62.05 2d3m n PRO 307 Cb 0.45 -2.63 -0.01 0.00 -0.02 0.00 0.00 33.50 31.29 2d3m n PRO 307 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2d3m s PRO 308 N 0.32 4.16 0.44 0.52 0.04 -1.26 -4.91 135.00 134.31 2d3m s PRO 308 Ca 0.72 2.51 0.16 0.00 0.04 0.00 0.00 61.00 64.43 2d3m s PRO 308 Cb -0.58 -2.99 1.02 0.00 0.04 0.00 0.00 34.50 31.98 2d3m s PRO 308 CO 0.42 -0.48 1.97 0.93 0.04 0.00 0.00 177.00 179.88 2d3m h GLU 309 N 3.24 0.00 -4.94 4.56 5.08 -2.05 -3.39 114.58 117.08 2d3m h GLU 309 Ca -0.50 0.00 -0.66 0.00 -1.00 0.00 0.00 59.36 57.20 2d3m h GLU 309 Cb 1.23 0.00 -0.35 0.00 0.50 0.00 0.00 28.75 30.13 2d3m h GLU 309 CO 0.66 0.21 -0.85 0.34 -1.00 0.00 0.00 179.01 178.37 2d3m s ASP 310 N -6.84 3.21 0.10 1.42 -1.08 -1.26 -5.00 116.67 107.22 2d3m s ASP 310 Ca -0.03 -0.71 0.18 0.00 -0.52 0.00 0.00 52.55 51.47 2d3m s ASP 310 Cb 0.15 -1.42 0.77 0.00 -1.46 0.00 0.00 42.92 40.96 2d3m s ASP 310 CO 0.68 -0.04 1.57 0.79 0.52 0.00 0.00 175.17 178.70 2d3m n TRP 311 N 4.63 0.33 0.58 -5.34 7.02 -1.26 -2.44 117.44 120.95 2d3m n TRP 311 Ca -0.19 0.13 0.10 0.00 -1.02 0.00 0.00 57.50 56.52 2d3m n TRP 311 Cb 0.49 -0.71 0.43 0.00 -2.42 0.00 0.00 31.31 29.10 2d3m n TRP 311 CO 0.00 0.00 0.00 0.09 -2.02 0.00 0.00 177.69 175.76 2d3m n ASN 312 N -1.80 0.29 0.00 -0.99 3.02 -1.26 -2.68 115.26 111.84 2d3m n ASN 312 Ca 0.03 0.56 0.11 0.00 -0.03 0.00 0.00 54.58 55.25 2d3m n ASN 312 Cb 0.20 -0.62 0.51 0.00 -0.61 0.00 0.00 39.78 39.25 2d3m n ASN 312 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2d3m n SER 313 N -1.80 0.00 -4.70 6.41 3.41 -1.02 -4.81 113.62 111.11 2d3m n SER 313 Ca 0.04 0.39 -0.24 0.00 -0.26 0.00 0.00 58.87 58.80 2d3m n SER 313 Cb 0.25 -0.46 -0.07 0.00 -0.26 0.00 0.00 64.21 63.67 2d3m n SER 313 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2d3m s LEU 314 N -2.92 3.41 0.30 1.04 1.43 -1.09 -4.68 118.68 116.17 2d3m s LEU 314 Ca 0.13 -0.43 -0.03 0.00 -1.03 0.00 0.00 54.13 52.78 2d3m s LEU 314 Cb 0.15 -1.99 -0.04 0.00 0.03 0.00 0.00 46.19 44.33 2d3m s LEU 314 CO 0.40 0.03 0.54 0.72 0.23 0.00 0.00 176.35 178.27 2d3m s PHE 315 N -2.00 3.49 -0.02 0.29 -0.71 -0.54 -4.96 117.98 113.53 2d3m s PHE 315 Ca 0.30 0.52 0.02 0.00 -1.04 0.00 0.00 56.93 56.73 2d3m s PHE 315 Cb -0.08 -2.01 -0.00 0.00 -1.21 0.00 0.00 43.02 39.72 2d3m s PHE 315 CO 0.21 0.17 -0.08 -1.58 -1.34 0.00 0.00 175.22 172.59 2d3m s TRP 316 N -2.15 0.80 -0.55 3.49 0.52 -1.26 -1.71 118.94 118.08 2d3m s TRP 316 Ca 0.42 -0.17 0.06 0.00 0.02 0.00 0.00 56.10 56.42 2d3m s TRP 316 Cb -0.10 -0.55 0.21 0.00 -1.15 0.00 0.00 33.47 31.87 2d3m s TRP 316 CO 0.32 -0.06 0.53 -0.89 0.02 0.00 0.00 176.95 176.88 2d3m n ILE 317 N 3.12 0.68 -3.14 2.03 -0.00 -0.29 -4.79 119.36 116.97 2d3m n ILE 317 Ca -0.16 -4.45 -0.37 0.00 -0.00 0.00 0.00 62.75 57.77 2d3m n ILE 317 Cb 0.56 -1.99 -0.06 0.00 -0.00 0.00 0.00 39.64 38.14 2d3m n ILE 317 CO 0.00 0.00 0.00 -2.16 -0.00 0.00 0.00 176.55 174.39 2d3m s PRO 318 N -1.34 4.27 0.04 0.38 0.04 -1.26 -0.78 135.00 136.35 2d3m s PRO 318 Ca 0.33 0.85 -0.30 0.00 0.04 0.00 0.00 61.00 61.92 2d3m s PRO 318 Cb 0.07 -3.03 -0.07 0.00 0.04 0.00 0.00 34.50 31.51 2d3m s PRO 318 CO -0.12 0.49 1.63 -1.58 0.04 0.00 0.00 177.00 177.45 2d3m s HIS 319 N -1.37 2.37 -1.48 0.56 5.65 0.07 -4.87 115.29 116.23 2d3m s HIS 319 Ca 0.38 0.34 -0.11 0.00 0.25 0.00 0.00 55.06 55.92 2d3m s HIS 319 Cb -0.18 -3.92 0.02 0.00 -1.18 0.00 0.00 32.58 27.32 2d3m s HIS 319 CO 0.21 -3.72 2.45 -0.35 -0.65 0.00 0.00 174.74 172.68 2d3m n PRO 320 N 5.90 3.43 0.27 2.88 -0.04 -1.26 -4.69 135.00 141.49 2d3m n PRO 320 Ca 0.16 -2.68 0.10 0.00 -0.04 0.00 0.00 63.50 61.04 2d3m n PRO 320 Cb 0.41 -3.01 0.71 0.00 -0.04 0.00 0.00 33.50 31.57 2d3m n PRO 320 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 2d3m h GLY 321 N 8.23 0.00 -3.91 0.55 0.00 -1.93 -3.42 103.07 102.60 2d3m h GLY 321 Ca 0.67 0.00 0.30 0.00 0.00 0.00 0.00 47.33 48.29 2d3m h GLY 321 CO 1.78 0.00 0.91 -0.32 0.00 0.00 0.00 176.54 178.91 2d3m s GLY 322 N -4.08 -0.23 0.27 4.60 0.00 -1.26 -4.99 107.32 101.63 2d3m s GLY 322 Ca -0.05 1.81 -0.04 0.00 0.00 0.00 0.00 44.72 46.44 2d3m s GLY 322 CO 0.64 0.61 1.91 -0.09 0.00 0.00 0.00 173.10 176.17 2d3m h ARG 323 N 2.00 1.15 -0.13 2.90 2.43 -1.87 -2.54 114.38 118.32 2d3m h ARG 323 Ca -0.05 -0.11 -0.08 0.00 -0.81 0.00 0.00 59.98 58.94 2d3m h ARG 323 Cb 1.14 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 30.44 2d3m h ARG 323 CO 0.20 0.81 -0.27 0.00 -1.51 0.00 0.00 179.97 179.21 2d3m h ALA 324 N 1.38 1.31 -0.27 2.80 0.00 -1.93 0.24 119.26 122.79 2d3m h ALA 324 Ca 0.30 -0.31 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 2d3m h ALA 324 Cb -0.03 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2d3m h ALA 324 CO -0.06 0.47 -0.04 0.82 0.00 0.00 0.00 179.25 180.44 2d3m h ILE 325 N 0.21 1.27 -0.44 0.00 2.04 -1.79 -0.38 117.51 118.43 2d3m h ILE 325 Ca 0.03 -1.03 -0.03 0.00 1.00 0.00 0.00 64.86 64.83 2d3m h ILE 325 Cb 0.59 1.40 -0.02 0.00 -0.74 0.00 0.00 36.82 38.05 2d3m h ILE 325 CO 0.04 0.33 0.17 -0.07 0.00 0.00 0.00 178.15 178.62 2d3m h LEU 326 N 0.28 0.61 -0.39 1.44 3.38 -1.19 -1.45 115.31 117.98 2d3m h LEU 326 Ca 0.07 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 2d3m h LEU 326 Cb 0.50 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 2d3m h LEU 326 CO 0.02 0.62 0.19 0.44 0.09 0.00 0.00 178.44 179.80 2d3m h ASP 327 N 0.56 0.51 0.32 -0.43 3.32 -0.84 -1.58 116.42 118.29 2d3m h ASP 327 Ca 0.15 -0.13 -0.18 0.00 0.02 0.00 0.00 57.03 56.89 2d3m h ASP 327 Cb 0.20 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 2d3m h ASP 327 CO -0.01 0.49 -0.73 1.56 -1.72 0.00 0.00 179.24 178.84 2d3m h GLN 328 N 0.50 0.34 -0.34 3.56 4.20 -0.98 -1.79 115.11 120.60 2d3m h GLN 328 Ca 0.14 -0.28 -0.16 0.00 0.06 0.00 0.00 58.65 58.40 2d3m h GLN 328 Cb 0.12 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.95 2d3m h GLN 328 CO -0.02 0.93 -0.42 0.28 -0.67 0.00 0.00 178.83 178.93 2d3m h VAL 329 N 0.23 1.28 -0.52 -0.54 2.07 -1.22 -1.17 116.25 116.38 2d3m h VAL 329 Ca -0.03 -1.60 -0.02 0.00 0.82 0.00 0.00 66.70 65.88 2d3m h VAL 329 Cb 1.29 1.46 -0.02 0.00 -1.52 0.00 0.00 31.29 32.50 2d3m h VAL 329 CO 0.12 0.53 0.26 -0.08 0.02 0.00 0.00 177.57 178.42 2d3m h GLU 330 N 0.69 0.74 -0.33 1.57 4.81 -1.25 -1.81 114.58 119.00 2d3m h GLU 330 Ca 0.05 -0.10 -0.09 0.00 -0.13 0.00 0.00 59.36 59.09 2d3m h GLU 330 Cb 1.00 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 30.23 2d3m h GLU 330 CO 0.10 0.60 -0.14 0.00 -0.73 0.00 0.00 179.01 178.83 2d3m h ALA 331 N 1.10 0.47 -0.48 2.92 0.00 -1.21 -0.36 119.26 121.69 2d3m h ALA 331 Ca 0.18 -0.33 -0.08 0.00 0.00 0.00 0.00 54.91 54.68 2d3m h ALA 331 Cb 0.10 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2d3m h ALA 331 CO -0.02 0.36 -0.02 -0.22 0.00 0.00 0.00 179.25 179.35 2d3m h LYS 332 N 0.46 0.82 -0.14 0.00 1.63 -1.08 -2.46 116.57 115.81 2d3m h LYS 332 Ca 0.08 -0.24 0.00 0.00 -0.85 0.00 0.00 60.65 59.64 2d3m h LYS 332 Cb 0.67 -0.09 0.00 0.00 -0.60 0.00 0.00 32.23 32.21 2d3m h LYS 332 CO 0.05 0.84 0.00 1.28 -3.45 0.00 0.00 179.45 178.17 2d3m n LEU 333 N -4.20 1.45 -3.90 5.20 4.77 -0.69 -4.93 117.00 114.70 2d3m n LEU 333 Ca 0.02 -0.60 -0.30 0.00 -0.03 0.00 0.00 56.01 55.11 2d3m n LEU 333 Cb 0.32 -0.09 0.03 0.00 -2.33 0.00 0.00 43.42 41.35 2d3m n LEU 333 CO 0.42 0.30 0.11 0.29 -1.33 0.00 0.00 177.39 177.18 2d3m n LYS 334 N 0.18 -5.62 -2.92 3.23 5.02 -0.93 -4.43 118.16 112.69 2d3m n LYS 334 Ca 0.16 0.61 -0.35 0.00 -2.02 0.00 0.00 58.31 56.71 2d3m n LYS 334 Cb 0.30 -5.50 -0.06 0.00 -0.02 0.00 0.00 35.03 29.75 2d3m n LYS 334 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2d3m s LEU 335 N -7.28 4.21 0.49 -0.35 1.43 -0.19 -4.82 118.68 112.18 2d3m s LEU 335 Ca 0.65 1.62 -0.21 0.00 -1.03 0.00 0.00 54.13 55.15 2d3m s LEU 335 Cb -0.32 -4.03 -0.07 0.00 0.03 0.00 0.00 46.19 41.80 2d3m s LEU 335 CO 0.83 -0.13 1.14 -0.13 0.23 0.00 0.00 176.35 178.29 2d3m s ARG 336 N -2.41 3.60 0.65 1.70 0.52 -1.26 -4.78 118.95 116.97 2d3m s ARG 336 Ca 0.52 1.68 0.23 0.00 -0.52 0.00 0.00 55.73 57.64 2d3m s ARG 336 Cb -0.15 -2.23 1.21 0.00 0.52 0.00 0.00 34.95 34.30 2d3m s ARG 336 CO 0.20 -0.66 1.68 -1.00 0.02 0.00 0.00 175.30 175.53 2d3m h PRO 337 N 1.68 0.00 -0.01 3.54 0.13 -1.97 -2.07 132.00 133.31 2d3m h PRO 337 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2d3m h PRO 337 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 2d3m h PRO 337 CO 0.59 0.00 -0.41 0.39 -0.23 0.00 0.00 178.00 178.34 2d3m n GLU 338 N -2.92 0.57 0.17 0.86 -0.58 -1.26 -4.24 120.64 113.25 2d3m n GLU 338 Ca 0.01 -0.37 0.04 0.00 -0.42 0.00 0.00 57.16 56.42 2d3m n GLU 338 Cb 0.61 -1.49 0.44 0.00 -0.57 0.00 0.00 31.44 30.42 2d3m n GLU 338 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 2d3m h LYS 339 N 0.90 0.10 -0.50 3.49 1.79 -1.74 -2.44 116.57 118.18 2d3m h LYS 339 Ca 0.00 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.45 2d3m h LYS 339 Cb 0.53 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.17 2d3m h LYS 339 CO 0.00 0.29 0.00 1.19 -1.08 0.00 0.00 179.45 179.85 2d3m n PHE 340 N -4.28 1.78 -0.20 -1.35 0.99 -1.26 -4.34 117.46 108.80 2d3m n PHE 340 Ca -0.02 -0.76 -0.03 0.00 -0.00 0.00 0.00 57.45 56.64 2d3m n PHE 340 Cb 0.27 -0.46 0.07 0.00 -1.00 0.00 0.00 39.48 38.37 2d3m n PHE 340 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 176.76 176.67 2d3m h ARG 341 N 3.44 0.60 -0.70 -1.08 9.65 -1.65 -0.85 114.38 123.79 2d3m h ARG 341 Ca 0.00 -0.04 -0.02 0.00 -1.10 0.00 0.00 59.98 58.83 2d3m h ARG 341 Cb 1.84 -0.14 -0.03 0.00 -1.39 0.00 0.00 29.97 30.25 2d3m h ARG 341 CO 0.42 0.40 0.37 0.00 2.80 0.00 0.00 179.97 183.96 2d3m h ALA 342 N 1.31 1.33 -0.35 2.80 0.00 -1.83 -0.31 119.26 122.21 2d3m h ALA 342 Ca 0.26 -0.12 -0.16 0.00 0.00 0.00 0.00 54.91 54.90 2d3m h ALA 342 Cb 0.14 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 2d3m h ALA 342 CO -0.16 0.54 -0.40 0.00 0.00 0.00 0.00 179.25 179.23 2d3m h ALA 343 N 1.43 0.52 -0.06 0.00 0.00 -1.76 -2.54 119.26 116.85 2d3m h ALA 343 Ca 0.25 -0.46 -0.13 0.00 0.00 0.00 0.00 54.91 54.57 2d3m h ALA 343 Cb 0.04 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2d3m h ALA 343 CO -0.04 0.63 -0.56 0.00 0.00 0.00 0.00 179.25 179.28 2d3m h ARG 344 N 0.69 0.18 -0.36 0.00 3.08 -0.80 -1.44 114.38 115.73 2d3m h ARG 344 Ca 0.05 -0.12 -0.09 0.00 0.07 0.00 0.00 59.98 59.89 2d3m h ARG 344 Cb 0.99 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 31.05 2d3m h ARG 344 CO 0.10 0.70 -0.14 1.15 -1.07 0.00 0.00 179.97 180.70 2d3m h THR 345 N 0.14 1.28 -0.46 2.04 2.02 -0.97 -0.44 112.91 116.52 2d3m h THR 345 Ca -0.00 -1.25 -0.14 0.00 0.77 0.00 0.00 66.41 65.79 2d3m h THR 345 Cb 1.03 1.32 -0.01 0.00 -1.74 0.00 0.00 68.15 68.76 2d3m h THR 345 CO 0.08 0.41 -0.26 0.58 0.37 0.00 0.00 175.52 176.71 2d3m h VAL 346 N 0.53 1.27 -0.64 3.16 2.07 -1.37 -0.36 116.25 120.91 2d3m h VAL 346 Ca 0.09 -1.43 -0.03 0.00 0.82 0.00 0.00 66.70 66.15 2d3m h VAL 346 Cb 0.68 1.19 -0.03 0.00 -1.52 0.00 0.00 31.29 31.60 2d3m h VAL 346 CO 0.05 0.49 0.27 0.25 0.02 0.00 0.00 177.57 178.65 2d3m h LEU 347 N 0.83 0.85 0.07 2.57 5.85 -1.13 0.28 115.31 124.63 2d3m h LEU 347 Ca 0.10 -0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.71 2d3m h LEU 347 Cb 0.84 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 41.66 2d3m h LEU 347 CO 0.07 0.75 -0.03 -0.25 -0.34 0.00 0.00 178.44 178.64 2d3m h TRP 348 N 0.92 -0.09 0.00 1.25 2.91 -0.74 -0.30 115.95 119.89 2d3m h TRP 348 Ca 0.22 -0.00 -0.03 0.00 1.13 0.00 0.00 58.89 60.21 2d3m h TRP 348 Cb 0.15 0.03 -0.00 0.00 -0.51 0.00 0.00 29.16 28.83 2d3m h TRP 348 CO 0.01 0.35 -0.20 -0.44 -1.03 0.00 0.00 178.44 177.13 2d3m h ASP 349 N -0.57 0.00 0.00 2.65 3.32 -0.94 0.50 116.42 121.38 2d3m h ASP 349 Ca -0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.04 2d3m h ASP 349 Cb 0.48 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.03 2d3m h ASP 349 CO 0.02 0.13 -0.16 -1.22 -1.72 0.00 0.00 179.24 176.28 2d3m n TYR 350 N -3.10 0.00 -4.15 4.55 4.02 0.96 -4.51 117.16 114.93 2d3m n TYR 350 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.92 2d3m n TYR 350 Cb 0.58 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.90 2d3m n TYR 350 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2d3m n GLY 351 N 0.63 -1.27 3.42 2.72 0.00 -0.12 -4.53 105.19 106.03 2d3m n GLY 351 Ca 0.00 -1.26 -0.44 0.00 0.00 0.00 0.00 46.02 44.32 2d3m n GLY 351 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2d3m s ASN 352 N -4.00 6.20 -0.33 1.61 3.84 -0.46 -4.33 114.94 117.47 2d3m s ASN 352 Ca 0.00 -1.14 0.02 0.00 0.21 0.00 0.00 52.86 51.95 2d3m s ASN 352 Cb 0.00 -2.32 0.40 0.00 -0.55 0.00 0.00 41.25 38.78 2d3m s ASN 352 CO 0.00 -1.09 1.71 0.23 -2.79 0.00 0.00 177.10 175.16 2d3m n MET 353 N 6.54 1.90 0.00 0.43 2.81 -1.26 -0.64 117.12 126.89 2d3m n MET 353 Ca -0.07 -2.02 0.00 0.00 -1.81 0.00 0.00 57.70 53.80 2d3m n MET 353 Cb 0.44 -1.79 0.00 0.00 -0.71 0.00 0.00 33.22 31.16 2d3m n MET 353 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 2d3m n VAL 354 N -0.45 0.00 0.30 2.03 0.31 -1.26 -1.91 118.33 117.35 2d3m n VAL 354 Ca 0.40 0.00 0.18 0.00 -0.01 0.00 0.00 64.34 64.91 2d3m n VAL 354 Cb 1.10 0.00 0.95 0.00 -0.91 0.00 0.00 33.84 34.98 2d3m n VAL 354 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 2d3m h SER 355 N 0.00 0.00 1.67 4.52 4.64 -1.95 -2.75 113.55 119.68 2d3m h SER 355 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2d3m h SER 355 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2d3m h SER 355 CO 0.00 0.03 0.00 0.00 -0.87 0.00 0.00 176.83 175.99 2d3m h ALA 356 N 1.97 1.00 -0.25 5.18 0.00 -1.62 -3.32 119.26 122.21 2d3m h ALA 356 Ca -0.00 0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.93 2d3m h ALA 356 Cb 0.16 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 2d3m h ALA 356 CO 0.00 0.00 0.09 0.77 0.00 0.00 0.00 179.25 180.11 2d3m h SER 357 N 0.00 0.11 0.29 0.00 0.02 -1.59 -2.34 113.55 110.04 2d3m h SER 357 Ca 0.00 0.02 -0.07 0.00 -0.84 0.00 0.00 61.79 60.91 2d3m h SER 357 Cb 0.83 0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.37 2d3m h SER 357 CO 0.00 0.09 -0.31 -0.37 -1.14 0.00 0.00 176.83 175.10 2d3m h VAL 358 N 0.21 1.23 -0.46 2.27 -1.51 -1.80 -1.18 116.25 115.01 2d3m h VAL 358 Ca 0.11 -1.10 -0.12 0.00 -1.23 0.00 0.00 66.70 64.35 2d3m h VAL 358 Cb 0.07 1.57 -0.01 0.00 -2.13 0.00 0.00 31.29 30.78 2d3m h VAL 358 CO -0.11 0.32 -0.21 1.23 -1.23 0.00 0.00 177.57 177.57 2d3m h GLY 359 N 0.96 1.01 1.19 5.19 0.00 -1.73 0.13 103.07 109.81 2d3m h GLY 359 Ca 0.00 -0.87 -0.09 0.00 0.00 0.00 0.00 47.33 46.37 2d3m h GLY 359 CO 0.04 0.80 -0.00 -0.97 0.00 0.00 0.00 176.54 176.41 2d3m h TYR 360 N 0.81 1.05 -0.32 5.60 0.05 -0.90 -1.52 116.97 121.74 2d3m h TYR 360 Ca 0.11 -0.17 -0.15 0.00 0.05 0.00 0.00 58.73 58.56 2d3m h TYR 360 Cb 0.76 -0.28 -0.00 0.00 1.01 0.00 0.00 36.73 38.22 2d3m h TYR 360 CO 0.05 0.94 -0.40 0.82 -1.05 0.00 0.00 178.16 178.52 2d3m h ILE 361 N 0.90 1.28 -0.57 -2.88 2.04 -0.92 0.36 117.51 117.73 2d3m h ILE 361 Ca 0.16 -1.58 -0.04 0.00 1.00 0.00 0.00 64.86 64.40 2d3m h ILE 361 Cb 0.52 1.53 -0.03 0.00 -0.74 0.00 0.00 36.82 38.11 2d3m h ILE 361 CO 0.03 0.52 0.18 0.25 0.00 0.00 0.00 178.15 179.12 2d3m h LEU 362 N 0.62 0.78 -0.24 1.44 5.85 -0.86 0.17 115.31 123.07 2d3m h LEU 362 Ca 0.04 -0.12 -0.07 0.00 0.84 0.00 0.00 57.88 58.57 2d3m h LEU 362 Cb 0.99 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.82 2d3m h LEU 362 CO 0.10 0.74 -0.13 -0.78 -0.34 0.00 0.00 178.44 178.02 2d3m h ASP 363 N 0.82 0.54 -0.61 1.25 3.58 -1.06 -1.50 116.42 119.44 2d3m h ASP 363 Ca 0.19 -0.42 -0.02 0.00 0.42 0.00 0.00 57.03 57.19 2d3m h ASP 363 Cb 0.24 -0.15 -0.03 0.00 1.72 0.00 0.00 39.33 41.11 2d3m h ASP 363 CO -0.01 0.84 0.29 -0.08 -2.88 0.00 0.00 179.24 177.40 2d3m h GLU 364 N 0.24 0.88 0.08 0.28 4.57 -0.47 -1.45 114.58 118.70 2d3m h GLU 364 Ca 0.05 -0.13 -0.00 0.00 -1.18 0.00 0.00 59.36 58.10 2d3m h GLU 364 Cb 0.65 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 29.08 2d3m h GLU 364 CO 0.04 0.71 -0.04 1.98 -1.18 0.00 0.00 179.01 180.52 2d3m h MET 365 N 0.83 -0.11 -0.26 1.92 4.05 -0.58 -1.25 114.93 119.54 2d3m h MET 365 Ca 0.21 0.01 -0.08 0.00 -0.28 0.00 0.00 59.70 59.55 2d3m h MET 365 Cb 0.13 0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 30.94 2d3m h MET 365 CO -0.03 0.07 -0.20 0.07 0.23 0.00 0.00 176.91 177.06 2d3m h ARG 366 N -0.27 0.46 -0.22 0.39 -0.00 -1.19 -1.11 114.38 112.44 2d3m h ARG 366 Ca -0.01 -0.15 -0.11 0.00 -0.00 0.00 0.00 59.98 59.70 2d3m h ARG 366 Cb 0.23 -0.04 -0.00 0.00 -0.00 0.00 0.00 29.97 30.16 2d3m h ARG 366 CO 0.02 0.64 -0.30 0.00 -0.00 0.00 0.00 179.97 180.33 2d3m h ARG 367 N 0.42 0.59 -0.08 0.08 3.08 -1.20 -1.49 114.38 115.77 2d3m h ARG 367 Ca 0.07 -0.34 -0.13 0.00 0.07 0.00 0.00 59.98 59.65 2d3m h ARG 367 Cb 0.58 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.65 2d3m h ARG 367 CO 0.04 0.94 -0.52 0.87 -1.07 0.00 0.00 179.97 180.23 2d3m h LYS 368 N 0.27 0.22 -0.39 0.04 1.79 -1.14 -0.37 116.57 116.99 2d3m h LYS 368 Ca 0.02 -0.13 -0.15 0.00 -2.18 0.00 0.00 60.65 58.21 2d3m h LYS 368 Cb 0.87 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.53 2d3m h LYS 368 CO 0.07 0.69 -0.34 0.77 -1.08 0.00 0.00 179.45 179.57 2d3m h SER 369 N 0.18 0.98 -0.27 0.86 0.02 -1.17 -1.79 113.55 112.35 2d3m h SER 369 Ca 0.00 -0.45 -0.18 0.00 -0.84 0.00 0.00 61.79 60.33 2d3m h SER 369 Cb 0.98 -0.27 -0.00 0.00 0.14 0.00 0.00 62.40 63.24 2d3m h SER 369 CO 0.08 1.22 -0.51 0.00 -1.14 0.00 0.00 176.83 176.49 2d3m h ALA 370 N 0.78 0.52 0.00 3.77 0.00 -1.14 -0.39 119.26 122.80 2d3m h ALA 370 Ca 0.07 -0.50 -0.05 0.00 0.00 0.00 0.00 54.91 54.43 2d3m h ALA 370 Cb 0.93 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 2d3m h ALA 370 CO 0.09 0.68 -0.23 0.00 0.00 0.00 0.00 179.25 179.78 2d3m h ALA 371 N 0.75 1.26 -0.02 0.00 0.00 -0.96 -2.09 119.26 118.19 2d3m h ALA 371 Ca 0.03 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2d3m h ALA 371 Cb 1.11 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.86 2d3m h ALA 371 CO 0.11 0.29 -0.04 1.63 0.00 0.00 0.00 179.25 181.24 2d3m n LYS 372 N -3.75 1.88 -2.46 0.00 5.02 -0.68 -4.96 118.16 113.21 2d3m n LYS 372 Ca -0.01 -1.36 -0.13 0.00 -2.02 0.00 0.00 58.31 54.78 2d3m n LYS 372 Cb 0.34 -1.47 0.01 0.00 -0.02 0.00 0.00 35.03 33.88 2d3m n LYS 372 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2d3m n GLY 373 N 1.28 -0.13 3.73 0.72 0.00 -0.79 -5.01 105.19 105.00 2d3m n GLY 373 Ca 0.16 -0.28 -0.30 0.00 0.00 0.00 0.00 46.02 45.60 2d3m n GLY 373 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2d3m s LEU 374 N -4.03 2.37 0.24 0.99 1.43 -0.18 -4.97 118.68 114.53 2d3m s LEU 374 Ca 0.08 1.50 -0.06 0.00 -1.03 0.00 0.00 54.13 54.62 2d3m s LEU 374 Cb -0.04 -3.97 0.24 0.00 0.03 0.00 0.00 46.19 42.46 2d3m s LEU 374 CO 0.10 -2.50 1.86 -0.33 0.23 0.00 0.00 176.35 175.72 2d3m h GLU 375 N -1.45 1.22 -4.79 1.70 3.07 -1.87 -3.42 114.58 109.04 2d3m h GLU 375 Ca -0.49 -0.14 -0.31 0.00 -0.50 0.00 0.00 59.36 57.92 2d3m h GLU 375 Cb 1.28 -0.24 -0.15 0.00 -0.84 0.00 0.00 28.75 28.80 2d3m h GLU 375 CO 0.55 0.90 -0.62 0.95 -1.40 0.00 0.00 179.01 179.38 2d3m s THR 376 N -5.80 0.40 0.02 1.13 -4.23 -1.26 -1.84 115.64 104.06 2d3m s THR 376 Ca -0.12 -2.00 0.30 0.00 -1.18 0.00 0.00 61.69 58.69 2d3m s THR 376 Cb 0.17 -2.56 0.36 0.00 1.34 0.00 0.00 72.50 71.80 2d3m s THR 376 CO 0.83 -0.03 1.90 1.88 -0.54 0.00 0.00 174.62 178.65 2d3m h TYR 377 N 2.48 0.00 -2.09 3.99 -1.99 -1.83 -2.93 116.97 114.60 2d3m h TYR 377 Ca -0.37 0.00 -0.79 0.00 2.00 0.00 0.00 58.73 59.56 2d3m h TYR 377 Cb 1.24 0.00 -0.24 0.00 2.00 0.00 0.00 36.73 39.74 2d3m h TYR 377 CO 0.43 0.04 1.32 0.41 -0.00 0.00 0.00 178.16 180.36 2d3m n GLY 378 N 0.22 5.78 2.68 3.88 0.00 -1.26 -3.55 105.19 112.94 2d3m n GLY 378 Ca 0.01 -2.47 -0.18 0.00 0.00 0.00 0.00 46.02 43.38 2d3m n GLY 378 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2d3m n GLU 379 N 0.64 -2.76 -0.56 1.61 1.02 -1.24 -1.18 120.64 118.17 2d3m n GLU 379 Ca 0.47 0.75 0.00 0.00 -0.02 0.00 0.00 57.16 58.36 2d3m n GLU 379 Cb 0.27 -5.44 0.00 0.00 -0.02 0.00 0.00 31.44 26.25 2d3m n GLU 379 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2d3m n GLY 380 N -1.05 1.60 3.95 0.62 0.00 -1.10 -4.92 105.19 104.28 2d3m n GLY 380 Ca -0.15 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.64 2d3m n GLY 380 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2d3m s LEU 381 N 0.00 4.26 -0.15 0.99 1.43 -0.32 -4.43 118.68 120.46 2d3m s LEU 381 Ca 0.00 0.21 -0.21 0.00 -1.03 0.00 0.00 54.13 53.09 2d3m s LEU 381 Cb 0.00 -2.99 -0.24 0.00 0.03 0.00 0.00 46.19 42.98 2d3m s LEU 381 CO 0.00 -0.08 0.51 -0.33 0.23 0.00 0.00 176.35 176.68 2d3m h GLU 382 N 1.43 0.10 -6.30 1.70 3.07 -1.85 -3.39 114.58 109.34 2d3m h GLU 382 Ca -0.50 -0.17 -0.67 0.00 -0.50 0.00 0.00 59.36 57.51 2d3m h GLU 382 Cb 1.21 0.06 -0.16 0.00 -0.84 0.00 0.00 28.75 29.03 2d3m h GLU 382 CO 0.64 1.08 -0.69 -1.58 -1.40 0.00 0.00 179.01 177.06 2d3m s TRP 383 N -2.37 2.91 0.31 4.33 0.52 -1.26 -0.28 118.94 123.09 2d3m s TRP 383 Ca -0.22 -0.03 -0.19 0.00 0.02 0.00 0.00 56.10 55.67 2d3m s TRP 383 Cb 0.03 -1.59 0.03 0.00 -1.15 0.00 0.00 33.47 30.78 2d3m s TRP 383 CO 0.69 0.40 0.73 0.20 0.02 0.00 0.00 176.95 178.99 2d3m s GLY 384 N -1.61 0.08 -0.02 0.98 0.00 0.24 -1.47 107.32 105.52 2d3m s GLY 384 Ca 0.19 -0.47 0.02 0.00 0.00 0.00 0.00 44.72 44.46 2d3m s GLY 384 CO 0.10 -0.18 -0.07 0.14 0.00 0.00 0.00 173.10 173.08 2d3m s VAL 385 N -3.47 0.63 -0.20 1.40 1.01 -0.69 -0.13 120.40 118.95 2d3m s VAL 385 Ca 0.13 -0.27 -0.07 0.00 0.00 0.00 0.00 61.98 61.77 2d3m s VAL 385 Cb -0.05 -0.58 -0.04 0.00 0.00 0.00 0.00 36.38 35.71 2d3m s VAL 385 CO 0.08 0.21 0.06 -0.22 0.00 0.00 0.00 175.10 175.23 2d3m s LEU 386 N 0.26 3.67 -0.07 3.92 0.20 0.27 -1.13 118.68 125.81 2d3m s LEU 386 Ca -0.04 -0.01 0.05 0.00 0.69 0.00 0.00 54.13 54.83 2d3m s LEU 386 Cb -0.08 -1.94 -0.01 0.00 -0.43 0.00 0.00 46.19 43.73 2d3m s LEU 386 CO 0.00 0.12 -0.23 -0.76 -0.29 0.00 0.00 176.35 175.18 2d3m s LEU 387 N 0.71 2.04 -0.05 -0.68 1.43 0.04 -0.63 118.68 121.54 2d3m s LEU 387 Ca 0.03 -0.50 0.05 0.00 -1.03 0.00 0.00 54.13 52.68 2d3m s LEU 387 Cb -0.13 -1.32 -0.02 0.00 0.03 0.00 0.00 46.19 44.75 2d3m s LEU 387 CO 0.02 0.21 -0.21 -0.83 0.23 0.00 0.00 176.35 175.77 2d3m s GLY 388 N 0.01 1.39 -0.03 -3.19 0.00 -0.21 -0.75 107.32 104.55 2d3m s GLY 388 Ca -0.08 -1.04 0.03 0.00 0.00 0.00 0.00 44.72 43.63 2d3m s GLY 388 CO 0.05 -0.77 -0.09 -1.36 0.00 0.00 0.00 173.10 170.93 2d3m s PHE 389 N -0.51 0.97 0.00 1.90 0.08 -1.26 -0.83 117.98 118.33 2d3m s PHE 389 Ca 0.07 -0.24 0.00 0.00 0.12 0.00 0.00 56.93 56.87 2d3m s PHE 389 Cb -0.11 -0.69 0.00 0.00 -0.57 0.00 0.00 43.02 41.65 2d3m s PHE 389 CO 0.01 -0.10 0.00 0.41 -0.10 0.00 0.00 175.22 175.44 2d3m n GLY 390 N 3.29 1.49 3.59 4.36 0.00 -0.57 -3.01 105.19 114.34 2d3m n GLY 390 Ca -0.18 -0.70 -0.54 0.00 0.00 0.00 0.00 46.02 44.59 2d3m n GLY 390 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2d3m n PRO 391 N 0.00 0.90 0.00 1.61 -0.02 -1.26 -1.46 135.00 134.77 2d3m n PRO 391 Ca 0.00 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.80 2d3m n PRO 391 Cb 0.00 -1.94 0.00 0.00 -0.02 0.00 0.00 33.50 31.54 2d3m n PRO 391 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2d3m n GLY 392 N 2.53 1.31 3.73 -1.23 0.00 -1.26 -3.22 105.19 107.06 2d3m n GLY 392 Ca 0.20 -0.11 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 2d3m n GLY 392 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2d3m s ILE 393 N 0.00 4.27 -0.11 -0.61 1.01 -1.16 -2.52 121.20 122.08 2d3m s ILE 393 Ca 0.00 1.82 0.00 0.00 0.00 0.00 0.00 60.65 62.47 2d3m s ILE 393 Cb 0.00 -4.16 -0.02 0.00 0.01 0.00 0.00 42.46 38.29 2d3m s ILE 393 CO 0.00 0.25 -0.11 -0.89 0.00 0.00 0.00 174.94 174.19 2d3m s THR 394 N 0.26 3.28 -0.11 2.92 2.01 -0.53 -0.37 115.64 123.10 2d3m s THR 394 Ca 0.50 -0.60 0.02 0.00 0.31 0.00 0.00 61.69 61.93 2d3m s THR 394 Cb -0.26 -2.37 -0.01 0.00 0.01 0.00 0.00 72.50 69.88 2d3m s THR 394 CO 0.31 0.54 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.90 2d3m s VAL 395 N -0.02 2.45 -0.27 3.82 1.01 0.84 -1.51 120.40 126.72 2d3m s VAL 395 Ca -0.02 -0.88 -0.07 0.00 0.00 0.00 0.00 61.98 61.01 2d3m s VAL 395 Cb -0.14 -1.98 -0.01 0.00 0.00 0.00 0.00 36.38 34.25 2d3m s VAL 395 CO 0.04 0.55 0.08 -1.61 0.00 0.00 0.00 175.10 174.15 2d3m s GLU 396 N 0.36 3.42 -0.29 2.72 0.41 -0.01 -0.08 118.70 125.22 2d3m s GLU 396 Ca -0.16 -0.64 -0.05 0.00 -0.41 0.00 0.00 54.97 53.72 2d3m s GLU 396 Cb -0.17 -3.35 0.02 0.00 -1.78 0.00 0.00 34.13 28.86 2d3m s GLU 396 CO 0.07 -0.30 0.04 0.99 -0.49 0.00 0.00 175.26 175.57 2d3m s THR 397 N 1.57 3.50 -0.31 3.63 2.01 0.22 -1.05 115.64 125.22 2d3m s THR 397 Ca 0.05 -0.96 -0.03 0.00 0.31 0.00 0.00 61.69 61.06 2d3m s THR 397 Cb -0.16 -2.86 0.05 0.00 0.01 0.00 0.00 72.50 69.54 2d3m s THR 397 CO 0.03 0.04 0.03 -0.63 -0.69 0.00 0.00 174.62 173.39 2d3m s ILE 398 N 1.40 3.17 -0.17 1.82 -1.09 0.19 -1.39 121.20 125.13 2d3m s ILE 398 Ca 0.00 -1.34 -0.26 0.00 -2.23 0.00 0.00 60.65 56.82 2d3m s ILE 398 Cb -0.18 -2.82 -0.01 0.00 -1.58 0.00 0.00 42.46 37.87 2d3m s ILE 398 CO 0.00 -0.13 0.86 -0.22 -1.23 0.00 0.00 174.94 174.22 2d3m s LEU 399 N 1.28 4.17 0.04 2.97 2.96 0.10 -0.56 118.68 129.65 2d3m s LEU 399 Ca -0.04 1.22 0.08 0.00 -0.22 0.00 0.00 54.13 55.17 2d3m s LEU 399 Cb -0.20 -3.28 -0.03 0.00 0.50 0.00 0.00 46.19 43.18 2d3m s LEU 399 CO -0.00 -0.42 -0.23 -0.76 -1.32 0.00 0.00 176.35 173.62 2d3m s LEU 400 N 2.22 2.36 -0.18 -0.68 1.43 0.81 -1.27 118.68 123.37 2d3m s LEU 400 Ca 0.40 -0.51 0.01 0.00 -1.03 0.00 0.00 54.13 53.00 2d3m s LEU 400 Cb -0.17 -1.39 0.02 0.00 0.03 0.00 0.00 46.19 44.69 2d3m s LEU 400 CO 0.12 0.26 -0.19 -2.28 0.23 0.00 0.00 176.35 174.49 2d3m s HIS 401 N -0.85 2.79 0.13 0.29 5.65 0.07 -0.59 115.29 122.78 2d3m s HIS 401 Ca 0.13 -1.68 -0.23 0.00 0.25 0.00 0.00 55.06 53.54 2d3m s HIS 401 Cb -0.10 -1.91 -0.07 0.00 -1.18 0.00 0.00 32.58 29.31 2d3m s HIS 401 CO 0.03 -0.81 0.69 0.45 -0.65 0.00 0.00 174.74 174.45 2d3m s SER 402 N 1.29 7.25 0.30 9.88 0.15 0.61 0.33 113.70 133.50 2d3m s SER 402 Ca 0.04 1.48 -0.01 0.00 0.70 0.00 0.00 55.95 58.16 2d3m s SER 402 Cb -0.13 -2.44 -0.04 0.00 -1.71 0.00 0.00 66.02 61.70 2d3m s SER 402 CO -0.13 0.23 0.52 -0.76 1.20 0.00 0.00 173.24 174.31 2d3m s LEU 403 N -1.15 4.07 0.77 3.45 1.43 -0.32 -4.78 118.68 122.15 2d3m s LEU 403 Ca 0.33 0.51 -0.11 0.00 -1.03 0.00 0.00 54.13 53.84 2d3m s LEU 403 Cb -0.21 -3.35 0.06 0.00 0.03 0.00 0.00 46.19 42.71 2d3m s LEU 403 CO 0.23 -0.22 1.09 -2.16 0.23 0.00 0.00 176.35 175.53 2d3m s PRO 404 N -3.90 2.25 0.00 1.29 0.04 -1.26 -3.03 135.00 130.39 2d3m s PRO 404 Ca 0.41 1.19 0.27 0.00 0.04 0.00 0.00 61.00 62.91 2d3m s PRO 404 Cb -0.10 -1.89 1.60 0.00 0.04 0.00 0.00 34.50 34.14 2d3m s PRO 404 CO 0.33 -1.65 1.95 1.28 0.04 0.00 0.00 177.00 178.95