#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x3l h ILE 6 N 0.00 1.17 -0.84 4.25 2.04 -2.05 -1.84 117.51 120.24 2x3l h ILE 6 Ca 0.00 -0.52 0.02 0.00 1.00 0.00 0.00 64.86 65.36 2x3l h ILE 6 Cb 0.00 1.37 -0.05 0.00 -0.74 0.00 0.00 36.82 37.40 2x3l h ILE 6 CO 0.00 0.15 0.55 0.25 0.00 0.00 0.00 178.15 179.10 2x3l h LEU 7 N -0.06 0.94 -1.13 1.44 5.85 -2.05 -0.39 115.31 119.91 2x3l h LEU 7 Ca 0.03 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.74 2x3l h LEU 7 Cb 0.21 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 40.98 2x3l h LEU 7 CO -0.00 0.66 0.56 -1.13 -0.34 0.00 0.00 178.44 178.19 2x3l h ASN 8 N 1.10 1.00 -0.04 1.25 -1.24 -1.96 0.20 115.58 115.89 2x3l h ASN 8 Ca 0.32 -0.04 -0.22 0.00 0.71 0.00 0.00 56.30 57.08 2x3l h ASN 8 Cb -0.06 -0.25 0.01 0.00 0.73 0.00 0.00 38.32 38.74 2x3l h ASN 8 CO -0.09 0.74 -0.79 0.50 -1.29 0.00 0.00 177.43 176.49 2x3l h LYS 9 N 1.18 0.70 -0.43 6.67 1.63 -0.74 -2.27 116.57 123.30 2x3l h LYS 9 Ca 0.31 -0.59 -0.07 0.00 -0.85 0.00 0.00 60.65 59.46 2x3l h LYS 9 Cb -0.11 0.13 -0.02 0.00 -0.60 0.00 0.00 32.23 31.63 2x3l h LYS 9 CO -0.07 1.20 0.01 -0.07 -3.45 0.00 0.00 179.45 177.08 2x3l h LEU 10 N 0.47 0.74 -0.54 5.20 3.38 -0.70 -1.29 115.31 122.57 2x3l h LEU 10 Ca -0.05 -0.30 0.01 0.00 0.09 0.00 0.00 57.88 57.63 2x3l h LEU 10 Cb 1.41 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.94 2x3l h LEU 10 CO 0.16 0.86 0.35 -0.33 0.09 0.00 0.00 178.44 179.56 2x3l h GLU 11 N 0.60 0.68 -0.41 1.13 5.08 -0.68 -2.31 114.58 118.68 2x3l h GLU 11 Ca 0.13 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.44 2x3l h GLU 11 Cb 0.47 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 2x3l h GLU 11 CO 0.02 0.45 0.24 0.66 -1.00 0.00 0.00 179.01 179.38 2x3l h SER 12 N 0.70 0.49 -0.82 1.42 4.64 -1.07 -1.17 113.55 117.75 2x3l h SER 12 Ca 0.20 -0.06 0.06 0.00 -0.47 0.00 0.00 61.79 61.52 2x3l h SER 12 Cb -0.05 -0.13 -0.05 0.00 -0.31 0.00 0.00 62.40 61.86 2x3l h SER 12 CO -0.06 0.41 0.54 -0.07 -0.87 0.00 0.00 176.83 176.78 2x3l h LEU 13 N 0.54 0.81 -0.38 5.97 3.38 -1.16 -1.20 115.31 123.26 2x3l h LEU 13 Ca 0.15 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 2x3l h LEU 13 Cb 0.01 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 2x3l h LEU 13 CO -0.03 0.53 0.19 0.78 0.09 0.00 0.00 178.44 180.00 2x3l h ASN 14 N 0.93 0.50 0.39 -0.43 2.35 -0.76 -2.09 115.58 116.47 2x3l h ASN 14 Ca 0.35 -0.12 -0.08 0.00 -0.55 0.00 0.00 56.30 55.89 2x3l h ASN 14 Cb 0.18 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.41 2x3l h ASN 14 CO -0.12 0.48 -0.39 1.56 -1.65 0.00 0.00 177.43 177.31 2x3l h GLN 15 N 0.48 0.00 -0.00 0.81 1.08 -0.54 -1.69 115.11 115.24 2x3l h GLN 15 Ca 0.13 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.33 2x3l h GLN 15 Cb 0.11 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.54 2x3l h GLN 15 CO -0.02 0.39 -0.01 0.39 -0.95 0.00 0.00 178.83 178.63 2x3l n GLU 16 N -4.07 0.97 -3.58 1.46 1.02 -0.52 -4.94 120.64 110.99 2x3l n GLU 16 Ca -0.02 -0.15 -0.22 0.00 -0.02 0.00 0.00 57.16 56.75 2x3l n GLU 16 Cb 0.42 -1.50 0.05 0.00 -0.02 0.00 0.00 31.44 30.39 2x3l n GLU 16 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2x3l n GLU 17 N -0.88 -3.62 -1.83 3.49 1.02 -0.64 -4.88 120.64 113.30 2x3l n GLU 17 Ca 0.21 0.65 -0.41 0.00 -0.02 0.00 0.00 57.16 57.59 2x3l n GLU 17 Cb 0.18 -5.13 -0.00 0.00 -0.02 0.00 0.00 31.44 26.47 2x3l n GLU 17 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2x3l s ALA 18 N -3.54 3.57 -0.24 0.62 0.00 -0.81 -4.98 121.76 116.38 2x3l s ALA 18 Ca 0.21 1.55 -0.08 0.00 0.00 0.00 0.00 51.96 53.64 2x3l s ALA 18 Cb -0.05 -3.60 -0.03 0.00 0.00 0.00 0.00 23.12 19.44 2x3l s ALA 18 CO 0.80 -1.02 0.08 0.42 0.00 0.00 0.00 175.76 176.05 2x3l s ILE 19 N -1.10 4.51 -0.22 0.00 1.01 0.01 -5.02 121.20 120.38 2x3l s ILE 19 Ca 0.53 -0.11 -0.22 0.00 0.00 0.00 0.00 60.65 60.85 2x3l s ILE 19 Cb -0.46 -3.10 -0.02 0.00 0.01 0.00 0.00 42.46 38.89 2x3l s ILE 19 CO 0.62 0.34 0.69 -0.55 0.00 0.00 0.00 174.94 176.04 2x3l s SER 20 N 1.46 6.71 -0.32 3.58 0.15 -1.26 -0.72 113.70 123.30 2x3l s SER 20 Ca 0.06 0.87 0.07 0.00 0.70 0.00 0.00 55.95 57.65 2x3l s SER 20 Cb -0.15 -2.37 0.46 0.00 -1.71 0.00 0.00 66.02 62.25 2x3l s SER 20 CO 0.04 -0.36 1.32 0.18 1.20 0.00 0.00 173.24 175.63 2x3l n LEU 21 N 5.43 4.86 -4.36 3.45 4.77 0.20 -4.83 117.00 126.53 2x3l n LEU 21 Ca 0.01 -4.48 -0.18 0.00 -0.03 0.00 0.00 56.01 51.32 2x3l n LEU 21 Cb 0.49 -0.47 -0.10 0.00 -2.33 0.00 0.00 43.42 41.01 2x3l n LEU 21 CO 0.45 1.85 -0.24 -1.38 -1.33 0.00 0.00 177.39 176.74 2x3l s HIS 22 N -3.54 1.65 0.51 -1.77 -3.43 -1.20 -1.79 115.29 105.71 2x3l s HIS 22 Ca 0.50 -1.18 -0.21 0.00 -0.80 0.00 0.00 55.06 53.37 2x3l s HIS 22 Cb 0.42 -0.98 -0.06 0.00 -1.43 0.00 0.00 32.58 30.52 2x3l s HIS 22 CO 0.01 -0.31 1.15 0.14 -2.00 0.00 0.00 174.74 173.74 2x3l s VAL 23 N -3.61 3.13 0.65 -5.38 -7.23 -1.26 -4.56 120.40 102.14 2x3l s VAL 23 Ca 0.36 0.76 -0.07 0.00 -1.81 0.00 0.00 61.98 61.22 2x3l s VAL 23 Cb 0.07 -3.34 0.03 0.00 0.56 0.00 0.00 36.38 33.70 2x3l s VAL 23 CO 0.15 -0.09 0.97 -2.16 -0.31 0.00 0.00 175.10 173.66 2x3l s PRO 24 N -3.04 2.66 0.00 4.82 0.04 -1.26 -5.01 135.00 133.21 2x3l s PRO 24 Ca 0.69 -0.01 0.05 0.00 0.04 0.00 0.00 61.00 61.77 2x3l s PRO 24 Cb -0.26 -2.20 0.30 0.00 0.04 0.00 0.00 34.50 32.39 2x3l s PRO 24 CO 0.30 -0.94 0.88 0.41 0.04 0.00 0.00 177.00 177.69 2x3l n GLY 25 N -2.77 -0.64 0.00 0.56 0.00 0.68 -1.65 105.19 101.38 2x3l n GLY 25 Ca 0.06 -0.03 0.12 0.00 0.00 0.00 0.00 46.02 46.17 2x3l n GLY 25 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2x3l n HIS 26 N -0.63 0.00 -3.45 1.61 1.44 -1.24 -3.39 115.22 109.56 2x3l n HIS 26 Ca 0.04 0.00 -0.19 0.00 -2.01 0.00 0.00 57.72 55.56 2x3l n HIS 26 Cb 0.02 -0.23 0.03 0.00 0.12 0.00 0.00 29.99 29.93 2x3l n HIS 26 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 2x3l n LYS 27 N -1.50 -1.48 -3.89 -1.40 4.76 -0.66 -1.00 118.16 113.00 2x3l n LYS 27 Ca 0.05 0.85 -0.29 0.00 -2.87 0.00 0.00 58.31 56.05 2x3l n LYS 27 Cb 0.33 -4.61 0.03 0.00 -1.84 0.00 0.00 35.03 28.94 2x3l n LYS 27 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2x3l n ASN 28 N -2.54 -4.42 -2.52 4.39 3.02 -1.26 -2.53 115.26 109.40 2x3l n ASN 28 Ca -0.10 -0.78 -0.17 0.00 -0.03 0.00 0.00 54.58 53.50 2x3l n ASN 28 Cb 0.59 -3.92 0.04 0.00 -0.61 0.00 0.00 39.78 35.88 2x3l n ASN 28 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 2x3l n MET 29 N -4.65 -4.63 -0.05 3.52 2.81 -0.86 -4.91 117.12 108.35 2x3l n MET 29 Ca 0.00 0.66 -0.05 0.00 -1.81 0.00 0.00 57.70 56.50 2x3l n MET 29 Cb 0.54 -5.06 -0.07 0.00 -0.71 0.00 0.00 33.22 27.93 2x3l n MET 29 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 2x3l n THR 30 N -4.27 0.62 -4.08 2.03 -2.24 -0.17 -4.88 114.28 101.28 2x3l n THR 30 Ca -0.05 -0.36 -0.33 0.00 -2.27 0.00 0.00 64.05 61.04 2x3l n THR 30 Cb 0.57 -0.79 -0.07 0.00 -2.10 0.00 0.00 70.33 67.95 2x3l n THR 30 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2x3l s ILE 31 N -2.22 4.82 0.00 2.28 -1.09 -0.21 -1.72 121.20 123.06 2x3l s ILE 31 Ca -0.06 -0.34 0.00 0.00 -2.23 0.00 0.00 60.65 58.02 2x3l s ILE 31 Cb 0.03 -3.19 0.00 0.00 -1.58 0.00 0.00 42.46 37.72 2x3l s ILE 31 CO 0.35 0.38 0.00 0.61 -1.23 0.00 0.00 174.94 175.05 2x3l n GLY 32 N 1.26 -3.35 2.14 6.18 0.00 -1.26 -4.46 105.19 105.71 2x3l n GLY 32 Ca -0.14 -1.84 -0.27 0.00 0.00 0.00 0.00 46.02 43.78 2x3l n GLY 32 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2x3l n HIS 33 N -0.47 2.91 1.03 1.61 8.25 -1.26 -4.70 115.22 122.58 2x3l n HIS 33 Ca 0.00 -2.45 0.13 0.00 -0.26 0.00 0.00 57.72 55.14 2x3l n HIS 33 Cb 0.00 -0.51 0.52 0.00 1.12 0.00 0.00 29.99 31.12 2x3l n HIS 33 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2x3l n LEU 34 N -0.71 0.16 0.29 2.41 4.77 -1.26 -2.79 117.00 119.86 2x3l n LEU 34 Ca 0.47 0.34 0.17 0.00 -0.03 0.00 0.00 56.01 56.95 2x3l n LEU 34 Cb 0.87 -0.41 0.83 0.00 -2.33 0.00 0.00 43.42 42.38 2x3l n LEU 34 CO 0.46 0.04 1.14 0.77 -1.33 0.00 0.00 177.39 178.47 2x3l h SER 35 N 0.03 0.00 1.51 -1.43 4.64 -1.92 -0.91 113.55 115.47 2x3l h SER 35 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 2x3l h SER 35 Cb 0.49 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.57 2x3l h SER 35 CO 0.00 0.00 -0.10 1.56 -0.87 0.00 0.00 176.83 177.42 2x3l h GLN 36 N 0.00 0.00 -7.27 4.77 4.20 -1.92 -3.45 115.11 111.44 2x3l h GLN 36 Ca 0.04 0.00 -0.49 0.00 0.06 0.00 0.00 58.65 58.26 2x3l h GLN 36 Cb 0.68 0.00 0.05 0.00 0.30 0.00 0.00 27.48 28.51 2x3l h GLN 36 CO -0.00 0.10 0.39 -0.51 -0.67 0.00 0.00 178.83 178.14 2x3l s LEU 37 N -6.32 3.41 0.07 1.46 1.43 -0.35 -5.10 118.68 113.29 2x3l s LEU 37 Ca 0.04 1.57 -0.11 0.00 -1.03 0.00 0.00 54.13 54.61 2x3l s LEU 37 Cb 0.07 -4.50 0.01 0.00 0.03 0.00 0.00 46.19 41.80 2x3l s LEU 37 CO 0.64 -0.90 0.24 -0.94 0.23 0.00 0.00 176.35 175.62 2x3l s SER 38 N -3.46 -0.00 0.40 2.29 1.04 -1.26 -5.05 113.70 107.65 2x3l s SER 38 Ca 0.58 -0.42 0.29 0.00 0.48 0.00 0.00 55.95 56.88 2x3l s SER 38 Cb -0.12 0.34 1.25 0.00 0.10 0.00 0.00 66.02 67.60 2x3l s SER 38 CO 0.43 -0.66 1.85 0.24 0.98 0.00 0.00 173.24 176.08 2x3l h MET 39 N 3.03 0.00 0.00 4.02 0.00 -2.00 -1.11 114.93 118.88 2x3l h MET 39 Ca -0.33 0.00 -0.00 0.00 0.00 0.00 0.00 59.70 59.37 2x3l h MET 39 Cb 1.20 0.00 -0.00 0.00 0.00 0.00 0.00 31.60 32.80 2x3l h MET 39 CO 0.50 0.00 -0.02 1.79 0.00 0.00 0.00 176.91 179.19 2x3l h THR 40 N 0.00 0.12 -0.00 2.22 1.35 -2.03 -1.18 112.91 113.38 2x3l h THR 40 Ca 0.00 -0.23 0.00 0.00 -0.55 0.00 0.00 66.41 65.63 2x3l h THR 40 Cb 0.35 1.20 0.00 0.00 -1.73 0.00 0.00 68.15 67.97 2x3l h THR 40 CO 0.00 0.02 -0.06 0.23 -0.25 0.00 0.00 175.52 175.46 2x3l n MET 41 N -3.21 0.93 -2.16 4.72 2.00 -0.42 -4.67 117.12 114.31 2x3l n MET 41 Ca -0.02 -0.30 -0.31 0.00 0.00 0.00 0.00 57.70 57.07 2x3l n MET 41 Cb 0.16 -1.49 -0.05 0.00 0.00 0.00 0.00 33.22 31.84 2x3l n MET 41 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 2x3l s ASP 42 N -2.28 5.37 0.00 7.83 2.15 -0.45 -4.52 116.67 124.78 2x3l s ASP 42 Ca 0.35 -1.69 0.00 0.00 0.43 0.00 0.00 52.55 51.64 2x3l s ASP 42 Cb 0.21 -2.58 0.00 0.00 -0.30 0.00 0.00 42.92 40.24 2x3l s ASP 42 CO 0.42 -2.70 0.00 0.29 -0.17 0.00 0.00 175.17 173.02 2x3l n LYS 43 N 8.37 3.08 -2.00 4.34 5.02 -1.26 -5.00 118.16 130.71 2x3l n LYS 43 Ca 0.45 0.00 -0.03 0.00 -2.02 0.00 0.00 58.31 56.71 2x3l n LYS 43 Cb 0.47 0.00 0.01 0.00 -0.02 0.00 0.00 35.03 35.49 2x3l n LYS 43 CO 0.00 0.00 0.00 -2.37 -0.52 0.00 0.00 177.40 174.51 2x3l n THR 44 N 0.00 0.00 -0.91 -0.18 5.66 -1.26 -4.70 114.28 112.89 2x3l n THR 44 Ca 0.00 -0.32 -0.24 0.00 -3.05 0.00 0.00 64.05 60.43 2x3l n THR 44 Cb 0.00 0.33 -0.04 0.00 -1.55 0.00 0.00 70.33 69.07 2x3l n THR 44 CO 0.00 0.00 0.00 -1.84 -3.05 0.00 0.00 175.07 170.18 2x3l n GLU 45 N -0.19 2.44 -3.16 1.09 0.28 -1.26 -4.82 120.64 115.02 2x3l n GLU 45 Ca -0.03 -1.53 -0.35 0.00 -0.16 0.00 0.00 57.16 55.09 2x3l n GLU 45 Cb 0.20 -2.44 -0.06 0.00 1.43 0.00 0.00 31.44 30.58 2x3l n GLU 45 CO 0.00 0.00 0.00 0.96 -0.16 0.00 0.00 177.13 177.93 2x3l s ILE 46 N 2.66 4.65 0.22 3.84 -4.36 -1.26 -4.99 121.20 121.97 2x3l s ILE 46 Ca 0.50 1.09 -0.32 0.00 -0.26 0.00 0.00 60.65 61.67 2x3l s ILE 46 Cb 0.15 -3.76 -0.14 0.00 1.25 0.00 0.00 42.46 39.96 2x3l s ILE 46 CO -0.03 0.08 1.29 -2.65 0.24 0.00 0.00 174.94 173.87 2x3l n PRO 47 N 0.37 1.69 0.00 0.37 -0.02 -1.26 -1.21 135.00 134.94 2x3l n PRO 47 Ca -0.01 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 2x3l n PRO 47 Cb 0.52 -2.18 0.00 0.00 -0.02 0.00 0.00 33.50 31.82 2x3l n PRO 47 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2x3l n GLY 48 N 2.02 2.97 3.95 -1.23 0.00 -1.26 -5.02 105.19 106.62 2x3l n GLY 48 Ca 0.13 -0.86 -0.23 0.00 0.00 0.00 0.00 46.02 45.06 2x3l n GLY 48 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2x3l s LEU 49 N 0.00 4.07 0.00 0.99 1.43 -0.35 -4.85 118.68 119.97 2x3l s LEU 49 Ca 0.00 0.34 0.00 0.00 -1.03 0.00 0.00 54.13 53.44 2x3l s LEU 49 Cb 0.00 -3.19 0.00 0.00 0.03 0.00 0.00 46.19 43.03 2x3l s LEU 49 CO 0.00 -0.26 0.00 -0.67 0.23 0.00 0.00 176.35 175.65 2x3l n ASP 50 N -1.71 0.00 -3.48 2.29 4.64 -1.26 -4.52 116.55 112.50 2x3l n ASP 50 Ca -0.05 0.00 -0.02 0.00 -1.38 0.00 0.00 54.79 53.34 2x3l n ASP 50 Cb 0.56 0.00 -0.05 0.00 -1.04 0.00 0.00 41.12 40.60 2x3l n ASP 50 CO 0.00 0.00 0.00 -0.62 -0.82 0.00 0.00 177.20 175.76 2x3l s ASP 51 N -1.00 -0.89 0.32 1.67 2.15 -1.26 -4.62 116.67 113.03 2x3l s ASP 51 Ca 0.00 1.13 0.02 0.00 0.43 0.00 0.00 52.55 54.13 2x3l s ASP 51 Cb 0.00 1.95 0.58 0.00 -0.30 0.00 0.00 42.92 45.15 2x3l s ASP 51 CO 0.00 -0.24 1.92 0.25 -0.17 0.00 0.00 175.17 176.93 2x3l h LEU 52 N 8.05 0.85 -1.38 -1.34 5.85 -1.97 -0.89 115.31 124.48 2x3l h LEU 52 Ca -0.19 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.53 2x3l h LEU 52 Cb 1.12 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.98 2x3l h LEU 52 CO 0.17 0.55 0.00 1.41 -0.34 0.00 0.00 178.44 180.22 2x3l n HIS 53 N -4.49 0.52 -2.71 1.25 -0.00 -1.26 -3.99 115.22 104.54 2x3l n HIS 53 Ca 0.13 -0.25 -0.08 0.00 -0.00 0.00 0.00 57.72 57.53 2x3l n HIS 53 Cb 0.20 -0.02 0.11 0.00 -0.00 0.00 0.00 29.99 30.28 2x3l n HIS 53 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2x3l n HIS 54 N 0.52 -2.59 -2.53 4.41 -0.00 -0.56 -5.01 115.22 109.46 2x3l n HIS 54 Ca 0.12 -1.97 -0.43 0.00 0.46 0.00 0.00 57.72 55.90 2x3l n HIS 54 Cb 0.33 1.61 -0.02 0.00 -0.12 0.00 0.00 29.99 31.79 2x3l n HIS 54 CO 0.00 0.00 0.00 -1.25 0.46 0.00 0.00 176.34 175.55 2x3l s PRO 55 N 0.22 4.06 0.00 1.57 0.04 -0.45 -4.49 135.00 135.95 2x3l s PRO 55 Ca 0.22 1.27 0.03 0.00 0.04 0.00 0.00 61.00 62.55 2x3l s PRO 55 Cb 0.35 -3.78 0.04 0.00 0.04 0.00 0.00 34.50 31.15 2x3l s PRO 55 CO -0.07 -0.92 0.98 0.39 0.04 0.00 0.00 177.00 177.42 2x3l n GLU 56 N 6.92 0.00 0.00 4.56 1.02 -1.26 -4.67 120.64 127.21 2x3l n GLU 56 Ca 0.13 -1.02 0.00 0.00 -0.02 0.00 0.00 57.16 56.25 2x3l n GLU 56 Cb 0.46 -0.40 0.00 0.00 -0.02 0.00 0.00 31.44 31.48 2x3l n GLU 56 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2x3l n GLU 57 N 0.05 0.00 0.18 3.49 1.02 -1.26 -4.94 120.64 119.18 2x3l n GLU 57 Ca 0.00 0.00 0.16 0.00 -0.02 0.00 0.00 57.16 57.30 2x3l n GLU 57 Cb 0.73 0.00 0.78 0.00 -0.02 0.00 0.00 31.44 32.93 2x3l n GLU 57 CO 0.00 0.00 0.00 -0.39 1.18 0.00 0.00 177.13 177.92 2x3l h VAL 58 N 0.00 0.61 0.05 2.62 -1.51 -1.95 -0.89 116.25 115.18 2x3l h VAL 58 Ca 0.00 0.00 -0.21 0.00 -1.23 0.00 0.00 66.70 65.26 2x3l h VAL 58 Cb 0.00 0.86 0.02 0.00 -2.13 0.00 0.00 31.29 30.04 2x3l h VAL 58 CO 0.00 0.00 -0.87 0.40 -1.23 0.00 0.00 177.57 175.87 2x3l h ILE 59 N 0.00 1.38 -0.75 7.19 5.03 -1.95 -1.93 117.51 126.48 2x3l h ILE 59 Ca 0.10 -2.26 -0.03 0.00 -0.12 0.00 0.00 64.86 62.54 2x3l h ILE 59 Cb 0.47 2.67 -0.03 0.00 -3.03 0.00 0.00 36.82 36.89 2x3l h ILE 59 CO -0.00 0.67 0.33 0.25 -0.68 0.00 0.00 178.15 178.72 2x3l h LEU 60 N 0.04 1.01 -0.86 1.44 5.85 -1.60 0.49 115.31 121.68 2x3l h LEU 60 Ca -0.12 -0.15 -0.02 0.00 0.84 0.00 0.00 57.88 58.43 2x3l h LEU 60 Cb 1.58 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 42.31 2x3l h LEU 60 CO 0.17 0.88 0.46 0.11 -0.34 0.00 0.00 178.44 179.72 2x3l h LYS 61 N 1.07 1.21 -0.69 1.25 1.57 -1.26 -1.26 116.57 118.45 2x3l h LYS 61 Ca 0.25 -0.15 -0.07 0.00 -1.87 0.00 0.00 60.65 58.82 2x3l h LYS 61 Cb 0.16 -0.23 -0.03 0.00 0.08 0.00 0.00 32.23 32.21 2x3l h LYS 61 CO -0.03 0.89 0.17 1.03 -0.57 0.00 0.00 179.45 180.94 2x3l h SER 62 N 1.21 1.05 -1.01 0.86 0.87 -0.80 -2.89 113.55 112.84 2x3l h SER 62 Ca 0.30 -0.24 0.02 0.00 -1.23 0.00 0.00 61.79 60.64 2x3l h SER 62 Cb 0.04 -0.28 -0.05 0.00 -0.44 0.00 0.00 62.40 61.67 2x3l h SER 62 CO -0.05 1.01 0.67 0.24 -0.53 0.00 0.00 176.83 178.17 2x3l h MET 63 N 1.04 1.31 0.00 2.24 2.86 0.53 0.03 114.93 122.94 2x3l h MET 63 Ca 0.22 -0.08 -0.02 0.00 -2.06 0.00 0.00 59.70 57.76 2x3l h MET 63 Cb 0.37 -0.30 -0.00 0.00 0.06 0.00 0.00 31.60 31.74 2x3l h MET 63 CO 0.00 0.87 -0.10 -0.22 1.06 0.00 0.00 176.91 178.52 2x3l h LYS 64 N 1.35 0.00 0.00 1.72 1.63 -1.11 -2.48 116.57 117.68 2x3l h LYS 64 Ca 0.38 0.00 -0.15 0.00 -0.85 0.00 0.00 60.65 60.02 2x3l h LYS 64 Cb -0.12 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 31.48 2x3l h LYS 64 CO -0.09 0.10 -1.00 1.96 -3.45 0.00 0.00 179.45 176.97 2x3l h GLN 65 N 0.00 0.00 0.00 1.90 1.08 -0.84 -3.26 115.11 113.98 2x3l h GLN 65 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2x3l h GLN 65 Cb 0.26 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.69 2x3l h GLN 65 CO 0.01 0.48 0.00 1.55 -0.95 0.00 0.00 178.83 179.92 2x3l n VAL 66 N -3.09 0.82 -1.64 -0.54 3.14 -0.48 -4.85 118.33 111.68 2x3l n VAL 66 Ca -0.04 0.18 -0.48 0.00 -2.96 0.00 0.00 64.34 61.04 2x3l n VAL 66 Cb 0.82 -1.02 -0.05 0.00 -1.06 0.00 0.00 33.84 32.54 2x3l n VAL 66 CO 0.00 0.00 0.00 1.21 -6.46 0.00 0.00 176.83 171.58 2x3l n GLU 67 N -1.93 1.79 -0.02 1.45 2.13 -1.18 -4.90 120.64 117.99 2x3l n GLU 67 Ca 0.03 0.65 0.00 0.00 0.66 0.00 0.00 57.16 58.50 2x3l n GLU 67 Cb 0.23 -2.36 -0.07 0.00 0.27 0.00 0.00 31.44 29.51 2x3l n GLU 67 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 2x3l n LYS 68 N 3.05 1.40 -3.85 5.31 5.02 -1.26 -5.03 118.16 122.80 2x3l n LYS 68 Ca 0.17 -0.05 -0.12 0.00 -2.02 0.00 0.00 58.31 56.30 2x3l n LYS 68 Cb 0.25 -1.22 -0.13 0.00 -0.02 0.00 0.00 35.03 33.91 2x3l n LYS 68 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 2x3l s HIS 69 N -2.43 -0.07 -0.69 2.13 2.46 -1.26 -5.06 115.29 110.37 2x3l s HIS 69 Ca -0.04 0.18 0.25 0.00 0.47 0.00 0.00 55.06 55.92 2x3l s HIS 69 Cb 0.04 0.02 0.88 0.00 -0.13 0.00 0.00 32.58 33.39 2x3l s HIS 69 CO 0.36 -0.04 1.76 -1.13 -2.47 0.00 0.00 174.74 173.23 2x3l n SER 70 N 3.04 0.72 -0.05 9.88 3.41 -1.26 -2.29 113.62 127.07 2x3l n SER 70 Ca -0.12 0.59 0.15 0.00 -0.26 0.00 0.00 58.87 59.24 2x3l n SER 70 Cb 0.60 -0.78 0.84 0.00 -0.26 0.00 0.00 64.21 64.61 2x3l n SER 70 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2x3l n ASP 71 N -2.20 0.17 -4.26 4.04 10.43 -1.26 -4.90 116.55 118.57 2x3l n ASP 71 Ca 0.05 -0.82 -0.25 0.00 2.57 0.00 0.00 54.79 56.33 2x3l n ASP 71 Cb 0.37 -0.07 -0.14 0.00 1.84 0.00 0.00 41.12 43.12 2x3l n ASP 71 CO 0.00 0.00 0.00 -0.31 -1.07 0.00 0.00 177.20 175.82 2x3l s TYR 72 N -2.16 1.83 -0.10 1.24 1.51 -0.97 -1.54 117.35 117.16 2x3l s TYR 72 Ca 0.41 -0.38 -0.09 0.00 -1.01 0.00 0.00 57.07 56.01 2x3l s TYR 72 Cb 0.21 -1.08 -0.04 0.00 -0.11 0.00 0.00 41.96 40.94 2x3l s TYR 72 CO 0.40 0.11 0.19 -0.51 -1.11 0.00 0.00 175.55 174.63 2x3l s ASP 73 N -1.27 6.47 0.07 2.29 1.01 -0.78 -4.83 116.67 119.62 2x3l s ASP 73 Ca 0.07 0.56 0.01 0.00 0.71 0.00 0.00 52.55 53.90 2x3l s ASP 73 Cb -0.09 -2.11 -0.04 0.00 1.01 0.00 0.00 42.92 41.69 2x3l s ASP 73 CO 0.02 0.39 0.17 -0.83 0.21 0.00 0.00 175.17 175.13 2x3l s GLY 74 N -1.00 2.14 -0.03 0.21 0.00 -1.26 -1.34 107.32 106.05 2x3l s GLY 74 Ca 0.17 -0.89 0.02 0.00 0.00 0.00 0.00 44.72 44.02 2x3l s GLY 74 CO 0.06 -0.87 -0.09 -0.19 0.00 0.00 0.00 173.10 172.00 2x3l s TYR 75 N -1.47 0.97 0.16 1.90 1.51 0.42 -4.91 117.35 115.92 2x3l s TYR 75 Ca 0.33 -0.25 -0.30 0.00 -1.01 0.00 0.00 57.07 55.85 2x3l s TYR 75 Cb -0.13 -0.69 -0.07 0.00 -0.11 0.00 0.00 41.96 40.96 2x3l s TYR 75 CO 0.26 -0.11 1.11 -0.06 -1.11 0.00 0.00 175.55 175.65 2x3l s PHE 76 N 0.21 3.57 -0.12 2.71 0.08 -1.26 -1.35 117.98 121.82 2x3l s PHE 76 Ca -0.04 1.56 0.01 0.00 0.12 0.00 0.00 56.93 58.59 2x3l s PHE 76 Cb -0.09 -3.29 -0.01 0.00 -0.57 0.00 0.00 43.02 39.06 2x3l s PHE 76 CO 0.01 -0.68 -0.17 -0.51 -0.10 0.00 0.00 175.22 173.76 2x3l s LEU 77 N -0.13 2.47 0.00 -0.37 1.43 0.13 -4.89 118.68 117.32 2x3l s LEU 77 Ca 0.51 -0.43 0.17 0.00 -1.03 0.00 0.00 54.13 53.35 2x3l s LEU 77 Cb -0.29 -1.54 -0.18 0.00 0.03 0.00 0.00 46.19 44.21 2x3l s LEU 77 CO 0.34 0.15 0.71 1.33 0.23 0.00 0.00 176.35 179.11 2x3l n VAL 78 N 3.60 0.00 -1.81 -1.59 0.24 -1.26 -1.25 118.33 116.26 2x3l n VAL 78 Ca -0.19 -0.11 -0.29 0.00 -2.04 0.00 0.00 64.34 61.72 2x3l n VAL 78 Cb 0.53 1.00 0.04 0.00 -1.47 0.00 0.00 33.84 33.94 2x3l n VAL 78 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 2x3l n ASN 79 N -1.38 5.97 -0.76 -1.34 5.15 -1.25 -4.62 115.26 117.03 2x3l n ASN 79 Ca 0.03 -3.77 0.10 0.00 -0.60 0.00 0.00 54.58 50.35 2x3l n ASN 79 Cb 0.26 -0.60 -0.03 0.00 -0.53 0.00 0.00 39.78 38.89 2x3l n ASN 79 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2x3l n GLY 80 N -0.76 -1.79 0.29 8.20 0.00 0.04 -2.67 105.19 108.51 2x3l n GLY 80 Ca 0.51 -1.32 0.11 0.00 0.00 0.00 0.00 46.02 45.31 2x3l n GLY 80 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2x3l h THR 81 N -0.71 0.84 -0.86 2.61 2.02 -1.87 -2.44 112.91 112.50 2x3l h THR 81 Ca -0.00 0.00 0.16 0.00 0.77 0.00 0.00 66.41 67.34 2x3l h THR 81 Cb 0.70 0.96 -0.16 0.00 -1.74 0.00 0.00 68.15 67.92 2x3l h THR 81 CO 0.01 0.00 -0.28 0.74 0.37 0.00 0.00 175.52 176.36 2x3l h THR 82 N 0.00 0.10 -0.28 3.16 2.02 -1.98 0.36 112.91 116.29 2x3l h THR 82 Ca 0.03 0.00 -0.14 0.00 0.77 0.00 0.00 66.41 67.07 2x3l h THR 82 Cb 0.14 0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 66.64 2x3l h THR 82 CO -0.00 0.00 -0.40 0.77 0.37 0.00 0.00 175.52 176.26 2x3l h SER 83 N -0.03 0.70 -0.27 4.18 4.64 -1.20 -0.52 113.55 121.05 2x3l h SER 83 Ca 0.37 -0.32 0.04 0.00 -0.47 0.00 0.00 61.79 61.41 2x3l h SER 83 Cb 0.62 -0.20 -0.04 0.00 -0.31 0.00 0.00 62.40 62.47 2x3l h SER 83 CO -0.89 1.02 0.05 1.23 -0.87 0.00 0.00 176.83 177.37 2x3l h GLY 84 N 0.99 0.30 1.03 -0.77 0.00 -1.50 -2.19 103.07 100.93 2x3l h GLY 84 Ca 0.04 -0.02 -0.07 0.00 0.00 0.00 0.00 47.33 47.29 2x3l h GLY 84 CO 0.08 -0.01 0.08 -2.22 0.00 0.00 0.00 176.54 174.47 2x3l h ILE 85 N 0.15 1.26 -0.92 2.60 2.04 -0.51 -1.38 117.51 120.75 2x3l h ILE 85 Ca 0.13 -1.00 0.00 0.00 1.00 0.00 0.00 64.86 64.98 2x3l h ILE 85 Cb 0.13 0.79 -0.04 0.00 -0.74 0.00 0.00 36.82 36.95 2x3l h ILE 85 CO -0.17 0.37 0.58 -0.07 0.00 0.00 0.00 178.15 178.86 2x3l h LEU 86 N 0.86 1.07 -0.26 1.44 3.38 -1.06 -2.91 115.31 117.83 2x3l h LEU 86 Ca 0.17 -0.04 -0.21 0.00 0.09 0.00 0.00 57.88 57.89 2x3l h LEU 86 Cb 0.44 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.92 2x3l h LEU 86 CO 0.01 0.80 -0.85 0.28 0.09 0.00 0.00 178.44 178.78 2x3l h SER 87 N 1.25 0.54 -0.01 -0.43 0.02 -0.70 -1.80 113.55 112.42 2x3l h SER 87 Ca 0.33 -0.40 -0.00 0.00 -0.84 0.00 0.00 61.79 60.88 2x3l h SER 87 Cb -0.10 -0.16 -0.00 0.00 0.14 0.00 0.00 62.40 62.27 2x3l h SER 87 CO -0.07 1.17 -0.01 0.58 -1.14 0.00 0.00 176.83 177.37 2x3l h VAL 88 N 0.27 1.33 -0.22 2.27 2.07 -1.30 -3.26 116.25 117.42 2x3l h VAL 88 Ca -0.06 -0.99 -0.13 0.00 0.82 0.00 0.00 66.70 66.34 2x3l h VAL 88 Cb 1.46 1.97 -0.01 0.00 -1.52 0.00 0.00 31.29 33.19 2x3l h VAL 88 CO 0.15 0.26 -0.42 0.40 0.02 0.00 0.00 177.57 177.98 2x3l h ILE 89 N -0.38 1.30 -0.22 4.57 2.04 -1.55 -2.91 117.51 120.36 2x3l h ILE 89 Ca 0.00 -1.58 -0.01 0.00 1.00 0.00 0.00 64.86 64.27 2x3l h ILE 89 Cb 0.43 1.59 -0.01 0.00 -0.74 0.00 0.00 36.82 38.08 2x3l h ILE 89 CO 0.00 0.50 0.11 -0.61 0.00 0.00 0.00 178.15 178.15 2x3l h GLN 90 N 0.43 0.30 0.00 2.37 5.75 -1.43 -2.33 115.11 120.19 2x3l h GLN 90 Ca 0.04 -0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.51 2x3l h GLN 90 Cb 0.91 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 29.40 2x3l h GLN 90 CO 0.08 0.23 0.00 -1.13 -2.65 0.00 0.00 178.83 175.36 2x3l n SER 91 N -4.47 0.61 -0.61 -0.69 3.41 -1.10 -1.77 113.62 109.00 2x3l n SER 91 Ca 0.00 0.69 0.13 0.00 -0.26 0.00 0.00 58.87 59.43 2x3l n SER 91 Cb 0.10 -0.81 0.31 0.00 -0.26 0.00 0.00 64.21 63.56 2x3l n SER 91 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2x3l n PHE 92 N -2.22 0.00 -0.19 7.33 3.01 -0.88 -4.61 117.46 119.90 2x3l n PHE 92 Ca 0.01 0.00 0.02 0.00 1.01 0.00 0.00 57.45 58.49 2x3l n PHE 92 Cb 0.16 -0.02 0.28 0.00 -0.01 0.00 0.00 39.48 39.89 2x3l n PHE 92 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 2x3l h SER 93 N 3.02 0.80 -0.28 4.37 4.64 -1.45 -1.81 113.55 122.84 2x3l h SER 93 Ca 0.00 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 2x3l h SER 93 Cb 0.69 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 2x3l h SER 93 CO 0.00 0.57 0.00 0.00 -0.87 0.00 0.00 176.83 176.53 2x3l n GLN 94 N -4.44 2.05 -3.49 4.77 1.13 -1.26 -4.90 117.38 111.23 2x3l n GLN 94 Ca 0.08 -1.58 -0.34 0.00 -1.94 0.00 0.00 57.00 53.22 2x3l n GLN 94 Cb 0.07 -1.43 -0.05 0.00 0.11 0.00 0.00 30.24 28.94 2x3l n GLN 94 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 2x3l s LYS 95 N -1.63 3.82 0.46 -1.09 -0.14 -0.68 -5.07 119.74 115.41 2x3l s LYS 95 Ca 0.34 0.27 -0.23 0.00 -1.36 0.00 0.00 55.97 54.98 2x3l s LYS 95 Cb 0.19 -2.91 -0.07 0.00 -1.68 0.00 0.00 37.83 33.35 2x3l s LYS 95 CO 0.27 0.49 1.21 0.15 -0.76 0.00 0.00 175.35 176.72 2x3l s LYS 96 N -2.12 3.72 0.00 1.68 -0.14 -1.26 -4.90 119.74 116.71 2x3l s LYS 96 Ca 0.37 1.90 0.00 0.00 -1.36 0.00 0.00 55.97 56.88 2x3l s LYS 96 Cb -0.14 -2.46 0.00 0.00 -1.68 0.00 0.00 37.83 33.56 2x3l s LYS 96 CO 0.19 -0.62 0.00 0.41 -0.76 0.00 0.00 175.35 174.57 2x3l n GLY 97 N 0.54 -1.55 3.59 -3.33 0.00 -1.26 -4.69 105.19 98.49 2x3l n GLY 97 Ca 0.07 -2.22 -0.27 0.00 0.00 0.00 0.00 46.02 43.61 2x3l n GLY 97 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2x3l s ASP 98 N -0.88 3.62 -0.31 1.61 3.84 -1.26 -4.63 116.67 118.67 2x3l s ASP 98 Ca 0.00 -1.36 -0.09 0.00 -0.00 0.00 0.00 52.55 51.10 2x3l s ASP 98 Cb 0.00 -0.35 -0.00 0.00 -1.38 0.00 0.00 42.92 41.19 2x3l s ASP 98 CO 0.00 -0.47 0.13 -0.63 -0.00 0.00 0.00 175.17 174.20 2x3l s ILE 99 N -2.80 4.40 0.41 2.11 1.01 -0.43 0.33 121.20 126.24 2x3l s ILE 99 Ca 0.35 -0.51 -0.22 0.00 0.00 0.00 0.00 60.65 60.27 2x3l s ILE 99 Cb 0.10 -3.26 -0.10 0.00 0.01 0.00 0.00 42.46 39.21 2x3l s ILE 99 CO 0.18 0.07 0.99 -0.76 0.00 0.00 0.00 174.94 175.41 2x3l s LEU 100 N 1.58 4.04 -0.14 2.97 1.02 0.47 -1.54 118.68 127.09 2x3l s LEU 100 Ca 0.04 1.84 -0.11 0.00 0.02 0.00 0.00 54.13 55.92 2x3l s LEU 100 Cb -0.17 -4.37 0.04 0.00 0.02 0.00 0.00 46.19 41.71 2x3l s LEU 100 CO 0.05 -0.42 0.35 -0.04 0.02 0.00 0.00 176.35 176.31 2x3l s MET 101 N -2.83 0.38 0.74 1.70 -1.94 -0.32 -0.06 119.30 116.97 2x3l s MET 101 Ca 0.60 0.55 -0.12 0.00 -1.71 0.00 0.00 55.69 55.01 2x3l s MET 101 Cb -0.15 0.12 0.04 0.00 2.01 0.00 0.00 34.83 36.85 2x3l s MET 101 CO 0.20 -0.08 1.09 0.00 -0.01 0.00 0.00 175.02 176.22 2x3l s ALA 102 N 0.53 2.34 -0.86 3.03 0.00 -0.86 -0.04 121.76 125.91 2x3l s ALA 102 Ca -0.03 0.33 0.20 0.00 0.00 0.00 0.00 51.96 52.46 2x3l s ALA 102 Cb -0.04 -3.28 0.84 0.00 0.00 0.00 0.00 23.12 20.64 2x3l s ALA 102 CO -0.03 -1.60 1.64 0.54 0.00 0.00 0.00 175.76 176.31 2x3l n ARG 103 N -3.19 0.07 -1.25 0.00 1.74 -1.26 -2.91 116.66 109.85 2x3l n ARG 103 Ca 0.09 0.24 -0.19 0.00 -0.77 0.00 0.00 57.85 57.23 2x3l n ARG 103 Cb 0.53 -1.61 0.13 0.00 -1.02 0.00 0.00 32.46 30.49 2x3l n ARG 103 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 2x3l n ASN 104 N -1.74 4.38 -4.76 0.55 6.94 -1.26 -4.96 115.26 114.40 2x3l n ASN 104 Ca 0.04 -3.76 -0.37 0.00 -0.02 0.00 0.00 54.58 50.47 2x3l n ASN 104 Cb 0.24 -0.69 0.01 0.00 -2.36 0.00 0.00 39.78 36.97 2x3l n ASN 104 CO 0.00 0.00 0.00 0.68 -1.03 0.00 0.00 177.26 176.91 2x3l s VAL 105 N -3.90 2.80 0.57 3.53 -7.23 -1.15 -4.65 120.40 110.37 2x3l s VAL 105 Ca 0.53 0.59 -0.17 0.00 -1.81 0.00 0.00 61.98 61.12 2x3l s VAL 105 Cb 0.44 -3.30 -0.05 0.00 0.56 0.00 0.00 36.38 34.04 2x3l s VAL 105 CO 0.02 -0.02 1.08 -2.28 -0.31 0.00 0.00 175.10 173.59 2x3l s HIS 106 N -1.49 2.86 0.54 2.82 2.46 -1.26 -4.92 115.29 116.31 2x3l s HIS 106 Ca 0.67 1.54 0.31 0.00 0.47 0.00 0.00 55.06 58.05 2x3l s HIS 106 Cb -0.32 -3.11 1.48 0.00 -0.13 0.00 0.00 32.58 30.50 2x3l s HIS 106 CO 0.38 -1.24 1.89 1.57 -2.47 0.00 0.00 174.74 174.87 2x3l h LYS 107 N 0.78 0.00 -0.76 2.88 2.10 -2.00 -1.51 116.57 118.06 2x3l h LYS 107 Ca -0.48 0.00 0.10 0.00 -2.00 0.00 0.00 60.65 58.27 2x3l h LYS 107 Cb 1.23 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 32.51 2x3l h LYS 107 CO 0.57 0.00 0.50 0.66 -2.00 0.00 0.00 179.45 179.18 2x3l h SER 108 N 0.00 0.60 -0.56 7.07 4.64 -1.96 0.21 113.55 123.54 2x3l h SER 108 Ca 0.41 0.02 -0.09 0.00 -0.47 0.00 0.00 61.79 61.65 2x3l h SER 108 Cb 1.66 -0.11 -0.02 0.00 -0.31 0.00 0.00 62.40 63.62 2x3l h SER 108 CO -0.00 0.36 0.03 0.58 -0.87 0.00 0.00 176.83 176.92 2x3l h VAL 109 N 0.66 1.26 0.01 0.95 2.07 -1.64 0.74 116.25 120.31 2x3l h VAL 109 Ca 0.35 -1.09 -0.20 0.00 0.82 0.00 0.00 66.70 66.58 2x3l h VAL 109 Cb 0.47 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 31.00 2x3l h VAL 109 CO -0.13 0.40 -0.91 -0.07 0.02 0.00 0.00 177.57 176.88 2x3l h LEU 110 N 0.93 0.14 -0.73 2.57 3.38 -1.23 -2.34 115.31 118.03 2x3l h LEU 110 Ca 0.17 -0.12 -0.09 0.00 0.09 0.00 0.00 57.88 57.93 2x3l h LEU 110 Cb 0.50 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 2x3l h LEU 110 CO 0.02 0.97 0.01 0.45 0.09 0.00 0.00 178.44 179.98 2x3l h HIS 111 N 0.05 1.06 -0.26 1.13 3.86 -0.53 -1.91 115.15 118.56 2x3l h HIS 111 Ca -0.03 -0.17 -0.02 0.00 -1.16 0.00 0.00 60.37 58.99 2x3l h HIS 111 Cb 1.57 -0.28 -0.01 0.00 1.06 0.00 0.00 27.41 29.74 2x3l h HIS 111 CO 0.02 0.94 0.10 0.00 0.86 0.00 0.00 177.93 179.85 2x3l h ALA 112 N 1.09 0.33 -0.38 2.45 0.00 -0.68 -1.57 119.26 120.49 2x3l h ALA 112 Ca 0.17 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 2x3l h ALA 112 Cb 0.52 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 2x3l h ALA 112 CO 0.03 -0.07 0.03 -0.07 0.00 0.00 0.00 179.25 179.16 2x3l h LEU 113 N 0.26 0.56 0.41 0.00 4.07 -1.38 -1.58 115.31 117.64 2x3l h LEU 113 Ca 0.08 -0.10 -0.02 0.00 0.08 0.00 0.00 57.88 57.92 2x3l h LEU 113 Cb 0.19 -0.15 0.00 0.00 1.08 0.00 0.00 40.66 41.78 2x3l h LEU 113 CO -0.01 0.61 -0.20 -0.78 -1.08 0.00 0.00 178.44 176.99 2x3l h ASP 114 N 0.57 -0.46 0.59 -0.43 1.82 -1.10 0.91 116.42 118.32 2x3l h ASP 114 Ca 0.12 -0.12 -0.05 0.00 -0.39 0.00 0.00 57.03 56.59 2x3l h ASP 114 Cb 0.32 0.12 -0.01 0.00 0.68 0.00 0.00 39.33 40.45 2x3l h ASP 114 CO 0.01 -0.10 -0.24 0.16 -1.61 0.00 0.00 179.24 177.46 2x3l h ILE 115 N -0.88 0.75 0.00 2.25 3.07 -1.26 -2.57 117.51 118.87 2x3l h ILE 115 Ca -0.06 -1.00 0.00 0.00 1.55 0.00 0.00 64.86 65.35 2x3l h ILE 115 Cb 0.55 1.62 0.00 0.00 -0.27 0.00 0.00 36.82 38.72 2x3l h ILE 115 CO 0.09 0.24 -0.89 -1.54 -1.05 0.00 0.00 178.15 175.00 2x3l n SER 116 N -3.64 0.69 -3.06 2.16 3.41 -0.60 -5.02 113.62 107.56 2x3l n SER 116 Ca -0.01 -0.49 -0.12 0.00 -0.26 0.00 0.00 58.87 57.99 2x3l n SER 116 Cb 0.37 0.74 0.06 0.00 -0.26 0.00 0.00 64.21 65.11 2x3l n SER 116 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2x3l n GLN 117 N -1.67 -1.94 -5.11 4.33 1.13 0.22 -4.94 117.38 109.40 2x3l n GLN 117 Ca 0.04 0.85 -0.30 0.00 -1.94 0.00 0.00 57.00 55.65 2x3l n GLN 117 Cb 0.37 -5.41 -0.15 0.00 0.11 0.00 0.00 30.24 25.16 2x3l n GLN 117 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 2x3l s GLN 118 N -4.11 1.92 0.38 -1.09 -0.21 -0.64 -4.98 119.66 110.92 2x3l s GLN 118 Ca 0.37 -0.96 -0.26 0.00 0.02 0.00 0.00 55.36 54.52 2x3l s GLN 118 Cb -0.05 -1.94 -0.09 0.00 1.00 0.00 0.00 33.01 31.94 2x3l s GLN 118 CO 0.67 0.52 1.22 -2.00 -2.12 0.00 0.00 175.29 173.58 2x3l s GLU 119 N -0.82 4.13 0.26 2.91 2.12 -1.26 -4.31 118.70 121.71 2x3l s GLU 119 Ca 0.10 1.99 0.01 0.00 0.36 0.00 0.00 54.97 57.43 2x3l s GLU 119 Cb -0.10 -2.81 -0.05 0.00 0.26 0.00 0.00 34.13 31.44 2x3l s GLU 119 CO 0.00 -0.30 0.11 0.20 -0.54 0.00 0.00 175.26 174.73 2x3l s GLY 120 N -0.89 1.73 -0.29 -1.50 0.00 -0.81 -1.31 107.32 104.25 2x3l s GLY 120 Ca 0.55 -1.83 -0.13 0.00 0.00 0.00 0.00 44.72 43.31 2x3l s GLY 120 CO 0.44 -1.56 0.71 -1.58 0.00 0.00 0.00 173.10 171.11 2x3l s HIS 121 N -3.80 -1.15 0.14 1.90 2.46 -0.59 -1.18 115.29 113.08 2x3l s HIS 121 Ca 0.38 2.09 -0.28 0.00 0.47 0.00 0.00 55.06 57.72 2x3l s HIS 121 Cb 0.07 0.69 -0.07 0.00 -0.13 0.00 0.00 32.58 33.14 2x3l s HIS 121 CO 0.14 -0.57 0.87 -0.06 -2.47 0.00 0.00 174.74 172.65 2x3l s PHE 122 N 2.38 3.86 0.34 3.88 0.08 0.21 -1.17 117.98 127.56 2x3l s PHE 122 Ca -0.07 1.72 -0.11 0.00 0.12 0.00 0.00 56.93 58.59 2x3l s PHE 122 Cb -0.09 -2.92 -0.07 0.00 -0.57 0.00 0.00 43.02 39.37 2x3l s PHE 122 CO -0.19 0.36 0.69 0.42 -0.10 0.00 0.00 175.22 176.40 2x3l s ILE 123 N -0.58 4.82 -0.09 0.64 1.01 0.95 -2.12 121.20 125.81 2x3l s ILE 123 Ca 0.41 0.60 -0.35 0.00 0.00 0.00 0.00 60.65 61.31 2x3l s ILE 123 Cb -0.23 -3.68 -0.13 0.00 0.01 0.00 0.00 42.46 38.43 2x3l s ILE 123 CO 0.28 -0.33 1.81 1.21 0.00 0.00 0.00 174.94 177.91 2x3l n GLU 124 N -0.81 1.95 -4.28 2.79 2.13 -1.24 -4.40 120.64 116.79 2x3l n GLU 124 Ca 0.02 0.71 -0.25 0.00 0.66 0.00 0.00 57.16 58.30 2x3l n GLU 124 Cb 0.53 -2.52 -0.17 0.00 0.27 0.00 0.00 31.44 29.56 2x3l n GLU 124 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 2x3l s THR 125 N 3.54 1.07 0.26 6.31 2.01 -0.41 -0.91 115.64 127.51 2x3l s THR 125 Ca 0.92 -0.39 0.08 0.00 0.31 0.00 0.00 61.69 62.61 2x3l s THR 125 Cb -0.77 -1.03 -0.04 0.00 0.01 0.00 0.00 72.50 70.68 2x3l s THR 125 CO 0.53 0.36 0.13 -1.00 -0.69 0.00 0.00 174.62 173.94 2x3l s HIS 126 N 1.11 2.95 -0.12 4.92 3.76 0.13 -4.23 115.29 123.82 2x3l s HIS 126 Ca -0.06 -0.16 -0.07 0.00 -0.15 0.00 0.00 55.06 54.61 2x3l s HIS 126 Cb -0.14 -1.35 -0.04 0.00 1.11 0.00 0.00 32.58 32.15 2x3l s HIS 126 CO -0.02 0.54 0.14 -1.14 -0.85 0.00 0.00 174.74 173.41 2x3l s GLN 127 N -3.79 3.48 0.28 1.40 0.74 -1.26 -0.68 119.66 119.82 2x3l s GLN 127 Ca 0.33 -0.13 -0.29 0.00 0.05 0.00 0.00 55.36 55.31 2x3l s GLN 127 Cb -0.07 -3.20 -0.10 0.00 1.10 0.00 0.00 33.01 30.74 2x3l s GLN 127 CO 0.23 0.76 1.27 0.45 -0.55 0.00 0.00 175.29 177.45 2x3l s SER 128 N -0.96 6.90 0.23 6.67 0.15 0.22 -4.79 113.70 122.12 2x3l s SER 128 Ca 0.15 2.52 0.25 0.00 0.70 0.00 0.00 55.95 59.57 2x3l s SER 128 Cb -0.12 -2.63 0.88 0.00 -1.71 0.00 0.00 66.02 62.44 2x3l s SER 128 CO 0.04 -0.46 1.75 -2.65 1.20 0.00 0.00 173.24 173.12 2x3l n PRO 129 N 1.46 0.24 -0.08 5.44 -0.02 -1.26 -2.13 135.00 138.65 2x3l n PRO 129 Ca 0.02 0.30 -0.13 0.00 -2.02 0.00 0.00 63.50 61.67 2x3l n PRO 129 Cb 0.43 -1.83 -0.07 0.00 -0.02 0.00 0.00 33.50 32.00 2x3l n PRO 129 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2x3l h LEU 130 N 0.00 0.00 0.00 2.45 5.85 -1.96 -3.41 115.31 118.24 2x3l h LEU 130 Ca 0.00 -0.38 0.00 0.00 0.84 0.00 0.00 57.88 58.34 2x3l h LEU 130 Cb 0.60 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.63 2x3l h LEU 130 CO 0.00 1.07 -0.93 0.35 -0.34 0.00 0.00 178.44 178.59 2x3l n THR 131 N -4.56 0.00 -1.46 1.05 -2.24 -1.26 -4.98 114.28 100.83 2x3l n THR 131 Ca -0.17 -0.05 -0.16 0.00 -2.27 0.00 0.00 64.05 61.40 2x3l n THR 131 Cb 0.44 0.99 -0.07 0.00 -2.10 0.00 0.00 70.33 69.59 2x3l n THR 131 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2x3l n ASN 132 N -1.47 -5.17 -4.64 3.42 4.13 -0.90 -4.98 115.26 105.65 2x3l n ASN 132 Ca 0.04 0.40 -0.24 0.00 1.68 0.00 0.00 54.58 56.45 2x3l n ASN 132 Cb 0.30 -4.08 -0.08 0.00 -1.54 0.00 0.00 39.78 34.38 2x3l n ASN 132 CO 0.00 0.00 0.00 -1.00 0.28 0.00 0.00 177.26 176.54 2x3l s HIS 133 N -2.51 2.58 0.20 3.10 3.76 -1.26 -4.76 115.29 116.40 2x3l s HIS 133 Ca 0.00 -0.38 -0.32 0.00 -0.15 0.00 0.00 55.06 54.20 2x3l s HIS 133 Cb 0.00 -1.42 -0.13 0.00 1.11 0.00 0.00 32.58 32.15 2x3l s HIS 133 CO 0.00 0.50 1.64 0.66 -0.85 0.00 0.00 174.74 176.70 2x3l n TYR 134 N -0.95 2.56 -0.68 1.40 4.01 -1.26 0.71 117.16 122.96 2x3l n TYR 134 Ca -0.04 0.16 0.00 0.00 -0.16 0.00 0.00 57.90 57.85 2x3l n TYR 134 Cb 0.61 -2.61 0.00 0.00 -0.31 0.00 0.00 39.34 37.03 2x3l n TYR 134 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 2x3l n ASN 135 N 3.52 0.12 -3.56 7.72 6.94 0.14 -4.77 115.26 125.37 2x3l n ASN 135 Ca 0.15 -0.81 -0.08 0.00 -0.02 0.00 0.00 54.58 53.82 2x3l n ASN 135 Cb 0.33 0.03 -0.02 0.00 -2.36 0.00 0.00 39.78 37.76 2x3l n ASN 135 CO 0.00 0.00 0.00 -1.59 -1.03 0.00 0.00 177.26 174.64 2x3l s LYS 136 N -0.03 1.06 0.20 -3.83 -2.85 -1.22 -4.45 119.74 108.63 2x3l s LYS 136 Ca 0.00 -0.46 0.09 0.00 -1.00 0.00 0.00 55.97 54.60 2x3l s LYS 136 Cb 0.00 0.45 -0.04 0.00 -2.06 0.00 0.00 37.83 36.17 2x3l s LYS 136 CO 0.00 -0.47 -0.17 0.14 0.10 0.00 0.00 175.35 174.95 2x3l s VAL 137 N -3.34 1.88 -0.11 1.79 -7.23 -1.26 -0.69 120.40 111.43 2x3l s VAL 137 Ca 0.06 -2.11 0.01 0.00 -1.81 0.00 0.00 61.98 58.13 2x3l s VAL 137 Cb -0.01 -1.99 0.02 0.00 0.56 0.00 0.00 36.38 34.95 2x3l s VAL 137 CO -0.07 -0.44 -0.14 0.21 -0.31 0.00 0.00 175.10 174.36 2x3l s ASN 138 N -3.05 2.33 0.64 4.85 2.47 -0.09 -4.97 114.94 117.12 2x3l s ASN 138 Ca 0.21 -0.40 -0.14 0.00 0.42 0.00 0.00 52.86 52.95 2x3l s ASN 138 Cb -0.04 -1.02 -0.01 0.00 -1.45 0.00 0.00 41.25 38.73 2x3l s ASN 138 CO 0.08 -0.01 1.07 -0.76 -3.72 0.00 0.00 177.10 173.75 2x3l s LEU 139 N 1.10 3.36 0.00 3.21 1.43 -1.26 -3.71 118.68 122.81 2x3l s LEU 139 Ca -0.05 1.78 0.00 0.00 -1.03 0.00 0.00 54.13 54.83 2x3l s LEU 139 Cb -0.14 -4.52 0.00 0.00 0.03 0.00 0.00 46.19 41.55 2x3l s LEU 139 CO -0.03 -1.35 0.08 0.00 0.23 0.00 0.00 176.35 175.29 2x3l n HIS 147 N -2.46 0.00 0.45 0.29 -0.00 1.01 -5.00 115.22 109.50 2x3l n HIS 147 Ca 0.09 0.00 0.11 0.00 -0.00 0.00 0.00 57.72 57.92 2x3l n HIS 147 Cb 0.53 0.04 -0.05 0.00 -0.00 0.00 0.00 29.99 30.51 2x3l n HIS 147 CO 0.00 0.00 0.00 0.36 -0.00 0.00 0.00 176.34 176.70 2x3l n LYS 148 N 0.00 0.37 -3.55 -1.40 2.85 0.01 -4.77 118.16 111.67 2x3l n LYS 148 Ca 0.00 -0.04 -0.14 0.00 -1.05 0.00 0.00 58.31 57.08 2x3l n LYS 148 Cb 0.33 -1.58 -0.06 0.00 -0.65 0.00 0.00 35.03 33.08 2x3l n LYS 148 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 177.40 176.18 2x3l s LEU 149 N -4.06 -0.52 -0.04 -5.58 2.96 -1.24 -4.41 118.68 105.79 2x3l s LEU 149 Ca 0.01 0.60 0.05 0.00 -0.22 0.00 0.00 54.13 54.57 2x3l s LEU 149 Cb 0.14 2.20 -0.01 0.00 0.50 0.00 0.00 46.19 49.02 2x3l s LEU 149 CO 0.84 -0.46 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.51 2x3l s VAL 150 N -1.06 1.67 -0.13 1.68 1.01 -0.76 -0.39 120.40 122.41 2x3l s VAL 150 Ca -0.06 -0.86 0.03 0.00 0.00 0.00 0.00 61.98 61.08 2x3l s VAL 150 Cb -0.01 -1.42 0.00 0.00 0.00 0.00 0.00 36.38 34.96 2x3l s VAL 150 CO 0.05 0.47 -0.22 -0.69 0.00 0.00 0.00 175.10 174.72 2x3l s VAL 151 N -0.14 2.16 0.04 2.92 1.01 0.91 -0.02 120.40 127.28 2x3l s VAL 151 Ca -0.01 -0.96 0.05 0.00 0.00 0.00 0.00 61.98 61.06 2x3l s VAL 151 Cb -0.11 -1.86 -0.02 0.00 0.00 0.00 0.00 36.38 34.39 2x3l s VAL 151 CO 0.02 0.55 -0.13 -0.76 0.00 0.00 0.00 175.10 174.78 2x3l s LEU 152 N 0.66 2.19 -0.10 3.92 1.43 -0.77 -2.03 118.68 123.97 2x3l s LEU 152 Ca -0.11 -0.47 -0.15 0.00 -1.03 0.00 0.00 54.13 52.37 2x3l s LEU 152 Cb -0.16 -0.54 -0.05 0.00 0.03 0.00 0.00 46.19 45.47 2x3l s LEU 152 CO 0.02 -0.00 0.39 -0.89 0.23 0.00 0.00 176.35 176.09 2x3l s THR 153 N -0.93 5.19 -0.26 5.49 2.01 -1.26 0.04 115.64 125.92 2x3l s THR 153 Ca 0.00 0.77 -0.07 0.00 0.31 0.00 0.00 61.69 62.70 2x3l s THR 153 Cb -0.08 -3.71 0.13 0.00 0.01 0.00 0.00 72.50 68.84 2x3l s THR 153 CO 0.01 0.42 0.54 -0.47 -0.69 0.00 0.00 174.62 174.44 2x3l s TYR 154 N 0.06 -1.17 1.21 4.92 6.14 -0.71 -4.45 117.35 123.35 2x3l s TYR 154 Ca 0.22 1.84 -0.19 0.00 0.64 0.00 0.00 57.07 59.57 2x3l s TYR 154 Cb -0.15 0.54 0.29 0.00 0.42 0.00 0.00 41.96 43.06 2x3l s TYR 154 CO 0.09 -0.65 1.10 -1.25 0.64 0.00 0.00 175.55 175.47 2x3l s PRO 155 N 2.77 -1.26 1.06 4.97 0.04 -1.26 -3.90 135.00 137.42 2x3l s PRO 155 Ca 0.02 -0.02 -0.16 0.00 0.04 0.00 0.00 61.00 60.87 2x3l s PRO 155 Cb -0.13 -1.59 0.22 0.00 0.04 0.00 0.00 34.50 33.05 2x3l s PRO 155 CO -0.17 -3.74 1.17 0.54 0.04 0.00 0.00 177.00 174.83 2x3l s ASN 156 N -3.82 2.21 0.27 6.66 2.20 -0.93 -4.70 114.94 116.83 2x3l s ASN 156 Ca 0.71 0.67 0.01 0.00 -0.94 0.00 0.00 52.86 53.30 2x3l s ASN 156 Cb -0.10 -0.98 0.60 0.00 -2.00 0.00 0.00 41.25 38.77 2x3l s ASN 156 CO 0.56 -3.33 1.76 0.22 -2.94 0.00 0.00 177.10 173.37 2x3l h TYR 157 N -2.04 0.83 -0.14 1.54 5.03 -1.91 -1.03 116.97 119.25 2x3l h TYR 157 Ca -0.47 0.03 0.00 0.00 2.58 0.00 0.00 58.73 60.87 2x3l h TYR 157 Cb 1.29 -0.23 0.00 0.00 1.55 0.00 0.00 36.73 39.34 2x3l h TYR 157 CO -1.11 0.18 0.00 0.66 -1.32 0.00 0.00 178.16 176.57 2x3l n TYR 158 N -4.86 0.28 -1.70 -3.82 4.02 -1.26 -4.89 117.16 104.94 2x3l n TYR 158 Ca 0.19 -0.12 -0.07 0.00 -0.01 0.00 0.00 57.90 57.90 2x3l n TYR 158 Cb 0.48 -0.07 -0.01 0.00 -0.02 0.00 0.00 39.34 39.72 2x3l n TYR 158 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2x3l n GLY 159 N 0.52 0.46 3.86 2.72 0.00 -0.39 -4.87 105.19 107.49 2x3l n GLY 159 Ca 0.05 -0.68 -0.36 0.00 0.00 0.00 0.00 46.02 45.04 2x3l n GLY 159 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2x3l s GLU 160 N -3.52 3.82 0.45 1.61 2.02 -1.26 -1.77 118.70 120.05 2x3l s GLU 160 Ca 0.00 0.27 0.06 0.00 0.02 0.00 0.00 54.97 55.32 2x3l s GLU 160 Cb 0.00 -3.06 -0.03 0.00 0.10 0.00 0.00 34.13 31.14 2x3l s GLU 160 CO 0.00 0.60 0.21 0.95 0.02 0.00 0.00 175.26 177.03 2x3l s THR 161 N -1.30 2.01 0.38 3.63 -4.23 -1.26 -2.19 115.64 112.68 2x3l s THR 161 Ca 0.30 -1.69 -0.08 0.00 -1.18 0.00 0.00 61.69 59.04 2x3l s THR 161 Cb -0.15 -2.70 0.03 0.00 1.34 0.00 0.00 72.50 71.02 2x3l s THR 161 CO 0.16 0.00 0.64 0.72 -0.54 0.00 0.00 174.62 175.61 2x3l s PHE 162 N -2.67 0.64 -1.43 3.99 -0.71 -1.26 -4.92 117.98 111.62 2x3l s PHE 162 Ca 0.35 -1.10 -0.15 0.00 -1.04 0.00 0.00 56.93 54.99 2x3l s PHE 162 Cb 0.02 0.38 0.04 0.00 -1.21 0.00 0.00 43.02 42.24 2x3l s PHE 162 CO 0.20 -1.39 2.18 -1.71 -1.34 0.00 0.00 175.22 173.16 2x3l n ASN 163 N -1.53 3.92 0.06 1.98 2.85 -1.26 -4.66 115.26 116.63 2x3l n ASN 163 Ca -0.04 -2.84 -0.08 0.00 -0.11 0.00 0.00 54.58 51.51 2x3l n ASN 163 Cb 0.61 -1.65 0.06 0.00 1.24 0.00 0.00 39.78 40.04 2x3l n ASN 163 CO 0.00 0.00 0.00 1.62 -2.11 0.00 0.00 177.26 176.77 2x3l h VAL 164 N 4.14 1.39 -0.50 3.44 3.04 -1.99 -3.14 116.25 122.62 2x3l h VAL 164 Ca 0.56 -2.10 0.09 0.00 -1.01 0.00 0.00 66.70 64.24 2x3l h VAL 164 Cb 0.66 2.08 -0.08 0.00 -2.01 0.00 0.00 31.29 31.94 2x3l h VAL 164 CO 1.86 0.63 0.06 -0.08 -1.01 0.00 0.00 177.57 179.02 2x3l h GLU 165 N 0.23 0.18 -0.45 4.17 4.81 -1.95 0.89 114.58 122.46 2x3l h GLU 165 Ca -0.02 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.15 2x3l h GLU 165 Cb 1.23 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 30.55 2x3l h GLU 165 CO 0.11 0.12 0.07 1.49 -0.73 0.00 0.00 179.01 180.07 2x3l h GLU 166 N 0.18 0.75 -0.35 1.92 4.57 -1.96 -1.07 114.58 118.63 2x3l h GLU 166 Ca 0.25 -0.20 0.05 0.00 -1.18 0.00 0.00 59.36 58.27 2x3l h GLU 166 Cb 0.36 -0.09 -0.04 0.00 -0.16 0.00 0.00 28.75 28.82 2x3l h GLU 166 CO -0.37 0.78 0.10 0.28 -1.18 0.00 0.00 179.01 178.62 2x3l h VAL 167 N 0.62 0.87 -0.39 0.32 2.07 -1.39 -0.07 116.25 118.28 2x3l h VAL 167 Ca 0.14 -0.08 0.02 0.00 0.82 0.00 0.00 66.70 67.60 2x3l h VAL 167 Cb 0.39 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 2x3l h VAL 167 CO 0.01 0.04 0.21 0.40 0.02 0.00 0.00 177.57 178.26 2x3l h ILE 168 N 0.24 1.02 0.13 4.57 2.04 -0.56 -0.88 117.51 124.06 2x3l h ILE 168 Ca 0.16 -0.15 0.01 0.00 1.00 0.00 0.00 64.86 65.88 2x3l h ILE 168 Cb 0.16 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 36.77 2x3l h ILE 168 CO -0.19 0.08 -0.15 0.11 0.00 0.00 0.00 178.15 178.00 2x3l h LYS 169 N 0.44 -0.30 -0.65 2.37 1.57 -1.02 -1.87 116.57 117.11 2x3l h LYS 169 Ca 0.16 0.02 0.09 0.00 -1.87 0.00 0.00 60.65 59.05 2x3l h LYS 169 Cb 0.03 0.07 -0.07 0.00 0.08 0.00 0.00 32.23 32.34 2x3l h LYS 169 CO -0.09 -0.20 0.28 0.77 -0.57 0.00 0.00 179.45 179.64 2x3l h SER 170 N -0.31 0.32 0.16 0.86 0.02 -0.69 -1.37 113.55 112.55 2x3l h SER 170 Ca 0.01 0.07 -0.10 0.00 -0.84 0.00 0.00 61.79 60.93 2x3l h SER 170 Cb 0.31 0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.87 2x3l h SER 170 CO -0.06 0.19 -0.36 -0.07 -1.14 0.00 0.00 176.83 175.39 2x3l h LEU 171 N 0.49 0.29 -0.78 5.07 3.38 -1.03 -2.91 115.31 119.81 2x3l h LEU 171 Ca 0.32 -0.11 -0.12 0.00 0.09 0.00 0.00 57.88 58.06 2x3l h LEU 171 Cb 0.37 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 2x3l h LEU 171 CO -0.29 0.64 -0.38 0.45 0.09 0.00 0.00 178.44 178.95 2x3l h HIS 172 N 0.24 0.55 0.00 1.13 3.86 -0.55 0.28 115.15 120.67 2x3l h HIS 172 Ca 0.03 -0.15 0.00 0.00 -1.16 0.00 0.00 60.37 59.09 2x3l h HIS 172 Cb 0.76 -0.12 0.00 0.00 1.06 0.00 0.00 27.41 29.11 2x3l h HIS 172 CO 0.02 0.78 0.00 1.96 0.86 0.00 0.00 177.93 181.55 2x3l h GLN 173 N 0.39 0.00 -0.64 2.45 1.08 -1.09 0.11 115.11 117.42 2x3l h GLN 173 Ca 0.04 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.24 2x3l h GLN 173 Cb 0.84 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.27 2x3l h GLN 173 CO 0.07 0.00 0.00 1.28 -0.95 0.00 0.00 178.83 179.23 2x3l n LEU 174 N -2.90 3.83 -1.43 1.46 4.77 -1.01 -4.98 117.00 116.73 2x3l n LEU 174 Ca -0.01 -1.84 -0.14 0.00 -0.03 0.00 0.00 56.01 53.99 2x3l n LEU 174 Cb 0.17 -0.42 -0.03 0.00 -2.33 0.00 0.00 43.42 40.81 2x3l n LEU 174 CO 0.22 0.92 -0.17 0.59 -1.33 0.00 0.00 177.39 177.62 2x3l n ASN 175 N 1.63 -4.51 -4.62 -1.43 4.13 0.40 -5.02 115.26 105.83 2x3l n ASN 175 Ca 0.23 0.13 -0.37 0.00 1.68 0.00 0.00 54.58 56.25 2x3l n ASN 175 Cb 0.62 -3.52 -0.10 0.00 -1.54 0.00 0.00 39.78 35.24 2x3l n ASN 175 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2x3l s ILE 176 N -2.65 5.27 0.63 2.41 1.01 0.05 -4.98 121.20 122.95 2x3l s ILE 176 Ca 0.00 0.15 -0.12 0.00 0.00 0.00 0.00 60.65 60.69 2x3l s ILE 176 Cb 0.00 -3.48 -0.03 0.00 0.01 0.00 0.00 42.46 38.96 2x3l s ILE 176 CO 0.00 0.31 1.04 -2.16 0.00 0.00 0.00 174.94 174.13 2x3l s PRO 177 N 1.32 3.40 -0.01 2.79 0.04 -1.26 -3.80 135.00 137.48 2x3l s PRO 177 Ca 0.07 0.87 0.05 0.00 0.04 0.00 0.00 61.00 62.02 2x3l s PRO 177 Cb -0.14 -2.05 -0.01 0.00 0.04 0.00 0.00 34.50 32.33 2x3l s PRO 177 CO 0.07 -0.73 -0.15 0.08 0.04 0.00 0.00 177.00 176.31 2x3l s VAL 178 N -3.04 1.21 -0.23 -0.36 1.01 -1.26 -1.83 120.40 115.90 2x3l s VAL 178 Ca 0.57 -0.67 -0.05 0.00 0.00 0.00 0.00 61.98 61.82 2x3l s VAL 178 Cb -0.12 -1.01 -0.02 0.00 0.00 0.00 0.00 36.38 35.23 2x3l s VAL 178 CO 0.51 0.33 0.01 -0.22 0.00 0.00 0.00 175.10 175.73 2x3l s LEU 179 N -0.39 3.16 -0.33 3.92 2.96 0.98 -2.22 118.68 126.74 2x3l s LEU 179 Ca 0.06 -0.29 -0.12 0.00 -0.22 0.00 0.00 54.13 53.55 2x3l s LEU 179 Cb -0.06 -1.82 -0.02 0.00 0.50 0.00 0.00 46.19 44.79 2x3l s LEU 179 CO -0.00 -0.02 0.23 -0.63 -1.32 0.00 0.00 176.35 174.61 2x3l s ILE 180 N 1.47 5.22 -0.84 6.68 -1.09 0.84 -1.86 121.20 131.62 2x3l s ILE 180 Ca 0.05 -0.21 -0.25 0.00 -2.23 0.00 0.00 60.65 58.01 2x3l s ILE 180 Cb -0.15 -3.66 0.02 0.00 -1.58 0.00 0.00 42.46 37.09 2x3l s ILE 180 CO 0.00 0.02 1.50 -0.62 -1.23 0.00 0.00 174.94 174.61 2x3l s ASP 181 N 1.71 6.04 -0.57 3.58 -1.08 0.11 -2.59 116.67 123.87 2x3l s ASP 181 Ca 0.06 -0.73 0.01 0.00 -0.52 0.00 0.00 52.55 51.36 2x3l s ASP 181 Cb -0.17 -2.56 0.50 0.00 -1.46 0.00 0.00 42.92 39.22 2x3l s ASP 181 CO 0.10 -1.90 1.90 1.21 0.52 0.00 0.00 175.17 177.00 2x3l n GLU 182 N 9.12 2.66 -0.10 4.34 2.13 0.52 -1.74 120.64 137.56 2x3l n GLU 182 Ca 0.21 -3.32 0.16 0.00 0.66 0.00 0.00 57.16 54.87 2x3l n GLU 182 Cb 0.50 -2.24 0.56 0.00 0.27 0.00 0.00 31.44 30.53 2x3l n GLU 182 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2x3l h ALA 183 N 1.78 2.22 -0.47 4.31 0.00 -1.76 -1.26 119.26 124.07 2x3l h ALA 183 Ca 0.57 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 55.31 2x3l h ALA 183 Cb 1.33 -0.03 -0.10 0.00 0.00 0.00 0.00 17.79 18.98 2x3l h ALA 183 CO 1.36 -0.39 0.09 0.72 0.00 0.00 0.00 179.25 181.03 2x3l n HIS 184 N -4.45 1.52 -2.01 0.00 8.25 -1.26 -3.08 115.22 114.19 2x3l n HIS 184 Ca 0.12 -1.32 0.05 0.00 -0.26 0.00 0.00 57.72 56.31 2x3l n HIS 184 Cb 0.52 -0.52 0.10 0.00 1.12 0.00 0.00 29.99 31.21 2x3l n HIS 184 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2x3l n GLY 185 N -0.74 2.75 0.23 -1.41 0.00 -0.48 -4.60 105.19 100.94 2x3l n GLY 185 Ca 0.34 -0.95 0.10 0.00 0.00 0.00 0.00 46.02 45.51 2x3l n GLY 185 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x3l h ALA 186 N 0.82 1.06 -0.01 4.61 0.00 -1.79 -2.14 119.26 121.81 2x3l h ALA 186 Ca -0.11 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2x3l h ALA 186 Cb 1.45 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.21 2x3l h ALA 186 CO 0.05 0.27 -0.34 -2.39 0.00 0.00 0.00 179.25 176.83 2x3l n HIS 187 N -3.44 0.00 -1.91 0.00 1.44 -1.26 -4.92 115.22 105.13 2x3l n HIS 187 Ca -0.00 0.00 -0.42 0.00 -2.01 0.00 0.00 57.72 55.29 2x3l n HIS 187 Cb 0.40 -0.09 -0.02 0.00 0.12 0.00 0.00 29.99 30.39 2x3l n HIS 187 CO 0.00 0.00 0.00 -0.06 -2.81 0.00 0.00 176.34 173.47 2x3l s PHE 188 N -2.53 2.96 0.00 -1.40 2.99 -0.81 -2.86 117.98 116.33 2x3l s PHE 188 Ca 0.22 0.80 0.00 0.00 0.00 0.00 0.00 56.93 57.94 2x3l s PHE 188 Cb 0.19 -3.93 0.00 0.00 0.00 0.00 0.00 43.02 39.27 2x3l s PHE 188 CO 0.55 -3.23 0.00 0.41 -0.00 0.00 0.00 175.22 172.95 2x3l n GLY 189 N 2.80 1.20 3.79 4.36 0.00 -0.52 -4.50 105.19 112.33 2x3l n GLY 189 Ca 0.10 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.76 2x3l n GLY 189 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2x3l s LEU 190 N 0.00 4.16 -0.22 0.99 1.43 -1.14 -4.95 118.68 118.95 2x3l s LEU 190 Ca 0.00 1.85 -0.40 0.00 -1.03 0.00 0.00 54.13 54.55 2x3l s LEU 190 Cb 0.00 -4.23 -0.16 0.00 0.03 0.00 0.00 46.19 41.83 2x3l s LEU 190 CO 0.00 -0.29 1.67 0.00 0.23 0.00 0.00 176.35 177.97 2x3l n GLN 191 N 0.00 1.12 0.00 1.70 10.64 -1.26 -1.34 117.38 128.24 2x3l n GLN 191 Ca 0.04 0.41 0.00 0.00 -1.83 0.00 0.00 57.00 55.62 2x3l n GLN 191 Cb 0.51 -2.08 0.00 0.00 -0.86 0.00 0.00 30.24 27.81 2x3l n GLN 191 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2x3l n GLY 192 N 3.90 2.39 3.98 2.61 0.00 -1.26 -4.79 105.19 112.02 2x3l n GLY 192 Ca 0.25 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.09 2x3l n GLY 192 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2x3l s PHE 193 N -2.66 2.93 1.06 1.61 0.40 -0.45 -4.87 117.98 116.00 2x3l s PHE 193 Ca 0.00 -0.33 -0.12 0.00 -0.60 0.00 0.00 56.93 55.88 2x3l s PHE 193 Cb 0.00 -2.16 0.22 0.00 0.51 0.00 0.00 43.02 41.59 2x3l s PHE 193 CO 0.00 -0.18 1.07 -2.14 0.70 0.00 0.00 175.22 174.67 2x3l s PRO 194 N -4.23 -0.08 0.16 0.24 0.02 -1.26 -4.54 135.00 125.32 2x3l s PRO 194 Ca 0.49 1.01 -0.11 0.00 0.02 0.00 0.00 61.00 62.41 2x3l s PRO 194 Cb -0.09 -1.64 -0.07 0.00 0.02 0.00 0.00 34.50 32.73 2x3l s PRO 194 CO 0.31 -3.21 0.50 -0.51 -0.33 0.00 0.00 177.00 173.77 2x3l s ASP 195 N -2.73 6.69 0.81 2.53 -0.00 -1.26 -1.44 116.67 121.27 2x3l s ASP 195 Ca 0.67 0.92 -0.12 0.00 -0.00 0.00 0.00 52.55 54.03 2x3l s ASP 195 Cb -0.23 -2.23 0.08 0.00 -0.00 0.00 0.00 42.92 40.54 2x3l s ASP 195 CO 0.61 0.05 1.10 -0.55 -0.00 0.00 0.00 175.17 176.39 2x3l s SER 196 N -2.01 4.40 0.00 0.27 0.15 -1.26 -4.87 113.70 110.38 2x3l s SER 196 Ca 0.40 1.30 0.29 0.00 0.70 0.00 0.00 55.95 58.64 2x3l s SER 196 Cb -0.13 -2.02 1.31 0.00 -1.71 0.00 0.00 66.02 63.47 2x3l s SER 196 CO 0.20 -2.03 1.94 1.07 1.20 0.00 0.00 173.24 175.62 2x3l n THR 197 N -3.47 0.00 0.10 6.45 5.66 -1.26 -2.95 114.28 118.80 2x3l n THR 197 Ca 0.07 -0.01 0.20 0.00 -3.05 0.00 0.00 64.05 61.26 2x3l n THR 197 Cb 0.56 -0.38 0.75 0.00 -1.55 0.00 0.00 70.33 69.72 2x3l n THR 197 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 175.07 171.95 2x3l h LEU 198 N 0.10 0.00 0.00 1.09 3.38 -1.93 -1.11 115.31 116.84 2x3l h LEU 198 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2x3l h LEU 198 Cb 0.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.13 2x3l h LEU 198 CO 0.00 0.00 -0.02 0.78 0.09 0.00 0.00 178.44 179.29 2x3l h ASN 199 N 0.00 0.00 -0.26 -0.43 -0.26 -1.93 -3.36 115.58 109.34 2x3l h ASN 199 Ca 0.19 -0.01 -0.06 0.00 -0.56 0.00 0.00 56.30 55.86 2x3l h ASN 199 Cb 0.95 0.00 -0.03 0.00 -1.06 0.00 0.00 38.32 38.18 2x3l h ASN 199 CO -0.00 0.00 -0.02 -1.22 -1.06 0.00 0.00 177.43 175.13 2x3l n TYR 200 N -2.30 0.89 -2.21 1.19 0.53 -0.42 -4.97 117.16 109.86 2x3l n TYR 200 Ca 0.05 -1.12 -0.16 0.00 -1.02 0.00 0.00 57.90 55.66 2x3l n TYR 200 Cb 0.44 -0.35 -0.01 0.00 -1.03 0.00 0.00 39.34 38.38 2x3l n TYR 200 CO 0.00 0.00 0.00 1.04 -1.02 0.00 0.00 176.86 176.88 2x3l n GLN 201 N -0.81 -1.23 -1.81 -0.72 6.02 -1.23 -4.79 117.38 112.80 2x3l n GLN 201 Ca 0.25 0.79 -0.41 0.00 -0.01 0.00 0.00 57.00 57.61 2x3l n GLN 201 Cb 0.91 -5.14 -0.01 0.00 1.02 0.00 0.00 30.24 27.02 2x3l n GLN 201 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2x3l s ALA 202 N -2.76 3.69 0.07 -1.58 0.00 -1.21 -4.93 121.76 115.05 2x3l s ALA 202 Ca 0.00 1.54 -0.19 0.00 0.00 0.00 0.00 51.96 53.32 2x3l s ALA 202 Cb 0.00 -3.63 -0.11 0.00 0.00 0.00 0.00 23.12 19.38 2x3l s ALA 202 CO 0.00 -0.97 1.44 -0.44 0.00 0.00 0.00 175.76 175.79 2x3l h ASP 203 N 4.45 0.44 -3.37 0.00 5.19 -1.90 -3.40 116.42 117.83 2x3l h ASP 203 Ca -0.48 -0.40 -0.49 0.00 -0.62 0.00 0.00 57.03 55.04 2x3l h ASP 203 Cb 1.22 -0.12 -0.34 0.00 0.18 0.00 0.00 39.33 40.27 2x3l h ASP 203 CO 0.76 0.74 -0.80 -0.31 -3.12 0.00 0.00 179.24 176.50 2x3l s TYR 204 N -4.64 1.29 -0.19 4.55 2.02 -0.94 -0.53 117.35 118.90 2x3l s TYR 204 Ca -0.14 -0.50 -0.02 0.00 -0.37 0.00 0.00 57.07 56.05 2x3l s TYR 204 Cb 0.07 -1.01 0.05 0.00 -0.40 0.00 0.00 41.96 40.67 2x3l s TYR 204 CO 0.76 -0.31 0.00 0.08 -1.57 0.00 0.00 175.55 174.50 2x3l s VAL 205 N 1.00 0.79 -0.13 0.71 1.01 -0.35 -0.11 120.40 123.32 2x3l s VAL 205 Ca -0.09 -0.64 -0.09 0.00 0.00 0.00 0.00 61.98 61.17 2x3l s VAL 205 Cb -0.15 -1.17 -0.04 0.00 0.00 0.00 0.00 36.38 35.02 2x3l s VAL 205 CO -0.00 -0.10 0.18 -0.69 0.00 0.00 0.00 175.10 174.50 2x3l s VAL 206 N 1.75 5.41 -0.04 2.92 1.01 -1.07 -1.02 120.40 129.36 2x3l s VAL 206 Ca -0.01 0.31 0.04 0.00 0.00 0.00 0.00 61.98 62.32 2x3l s VAL 206 Cb -0.17 -3.47 -0.00 0.00 0.00 0.00 0.00 36.38 32.74 2x3l s VAL 206 CO -0.07 0.56 -0.14 -1.10 0.00 0.00 0.00 175.10 174.34 2x3l s GLN 207 N -0.62 1.49 -1.00 2.72 -0.21 -0.66 -0.36 119.66 121.02 2x3l s GLN 207 Ca 0.15 -0.50 -0.17 0.00 0.02 0.00 0.00 55.36 54.86 2x3l s GLN 207 Cb -0.12 -1.32 0.15 0.00 1.00 0.00 0.00 33.01 32.72 2x3l s GLN 207 CO 0.04 0.20 1.19 -1.12 -2.12 0.00 0.00 175.29 173.48 2x3l s SER 208 N 0.09 6.77 0.19 5.90 0.01 -1.18 -1.60 113.70 123.88 2x3l s SER 208 Ca -0.03 -2.37 -0.21 0.00 1.31 0.00 0.00 55.95 54.64 2x3l s SER 208 Cb -0.10 -2.38 0.12 0.00 0.21 0.00 0.00 66.02 63.87 2x3l s SER 208 CO 0.02 -0.93 1.59 -0.26 0.41 0.00 0.00 173.24 174.06 2x3l h PHE 209 N 8.27 -0.93 0.00 2.43 -1.00 -1.85 -3.32 116.94 120.54 2x3l h PHE 209 Ca 0.20 0.07 0.00 0.00 2.81 0.00 0.00 57.97 61.05 2x3l h PHE 209 Cb 0.98 0.50 0.00 0.00 3.61 0.00 0.00 35.95 41.04 2x3l h PHE 209 CO 1.13 -0.38 0.00 -2.39 -1.61 0.00 0.00 178.31 175.06 2x3l n HIS 210 N -5.43 0.00 0.00 -0.55 1.44 -0.94 0.04 115.22 109.77 2x3l n HIS 210 Ca 0.04 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.75 2x3l n HIS 210 Cb 0.36 -0.16 0.00 0.00 0.12 0.00 0.00 29.99 30.31 2x3l n HIS 210 CO 0.00 0.00 0.00 0.25 -2.81 0.00 0.00 176.34 173.78 2x3l n THR 212 N 1.46 0.00 -4.18 0.61 -2.24 -1.25 -0.23 114.28 108.46 2x3l n THR 212 Ca 0.00 0.42 -0.23 0.00 -2.27 0.00 0.00 64.05 61.97 2x3l n THR 212 Cb 0.00 -1.29 -0.06 0.00 -2.10 0.00 0.00 70.33 66.87 2x3l n THR 212 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2x3l s LEU 213 N -1.72 3.29 -1.36 3.22 1.43 0.11 -4.66 118.68 118.99 2x3l s LEU 213 Ca 0.00 -0.67 -0.16 0.00 -1.03 0.00 0.00 54.13 52.28 2x3l s LEU 213 Cb 0.00 -1.79 0.02 0.00 0.03 0.00 0.00 46.19 44.45 2x3l s LEU 213 CO 0.00 -0.15 2.12 -0.81 0.23 0.00 0.00 176.35 177.74 2x3l n PRO 214 N -1.05 2.74 -4.49 1.29 -0.04 -1.22 -2.79 135.00 129.45 2x3l n PRO 214 Ca -0.05 -2.62 -0.24 0.00 -0.04 0.00 0.00 63.50 60.54 2x3l n PRO 214 Cb 0.60 -3.29 -0.10 0.00 -0.04 0.00 0.00 33.50 30.66 2x3l n PRO 214 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2x3l s ALA 215 N 3.71 2.76 0.38 0.55 0.00 -1.26 -4.03 121.76 123.86 2x3l s ALA 215 Ca 0.50 -1.95 -0.24 0.00 0.00 0.00 0.00 51.96 50.26 2x3l s ALA 215 Cb 0.12 -0.14 -0.09 0.00 0.00 0.00 0.00 23.12 23.01 2x3l s ALA 215 CO -0.04 0.17 1.01 -0.51 0.00 0.00 0.00 175.76 176.39 2x3l s LEU 216 N -3.53 4.18 0.16 0.00 1.43 -1.26 -4.49 118.68 115.17 2x3l s LEU 216 Ca 0.30 1.95 -0.33 0.00 -1.03 0.00 0.00 54.13 55.03 2x3l s LEU 216 Cb -0.01 -4.16 -0.16 0.00 0.03 0.00 0.00 46.19 41.88 2x3l s LEU 216 CO 0.15 -0.36 1.13 0.41 0.23 0.00 0.00 176.35 177.91 2x3l n THR 217 N 0.07 0.85 0.00 5.49 -1.04 -1.26 -1.41 114.28 116.97 2x3l n THR 217 Ca 0.04 -0.21 0.00 0.00 -2.04 0.00 0.00 64.05 61.84 2x3l n THR 217 Cb 0.50 -0.75 0.00 0.00 -1.82 0.00 0.00 70.33 68.26 2x3l n THR 217 CO 0.00 0.00 0.00 0.23 -0.64 0.00 0.00 175.07 174.66 2x3l n MET 218 N 1.73 0.00 -2.28 -2.82 2.81 -1.26 -5.03 117.12 110.26 2x3l n MET 218 Ca 0.16 0.00 -0.42 0.00 -1.81 0.00 0.00 57.70 55.62 2x3l n MET 218 Cb 0.23 -0.18 -0.03 0.00 -0.71 0.00 0.00 33.22 32.54 2x3l n MET 218 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 2x3l s GLY 219 N -2.45 2.04 0.24 3.03 0.00 -0.50 -0.78 107.32 108.90 2x3l s GLY 219 Ca 0.00 0.91 -0.10 0.00 0.00 0.00 0.00 44.72 45.53 2x3l s GLY 219 CO 0.00 2.33 0.42 -0.56 0.00 0.00 0.00 173.10 175.28 2x3l s SER 220 N 1.44 -0.00 -0.04 1.64 0.01 -0.38 -2.21 113.70 114.15 2x3l s SER 220 Ca 0.62 -1.04 0.02 0.00 1.31 0.00 0.00 55.95 56.86 2x3l s SER 220 Cb -0.32 0.56 0.02 0.00 0.21 0.00 0.00 66.02 66.48 2x3l s SER 220 CO 0.28 -1.10 -0.06 -0.69 0.41 0.00 0.00 173.24 172.08 2x3l s VAL 221 N -3.99 0.64 -0.25 3.43 1.01 -0.63 0.23 120.40 120.84 2x3l s VAL 221 Ca 0.26 -0.21 -0.12 0.00 0.00 0.00 0.00 61.98 61.90 2x3l s VAL 221 Cb 0.01 -0.63 -0.05 0.00 0.00 0.00 0.00 36.38 35.71 2x3l s VAL 221 CO 0.10 0.24 0.23 -0.22 0.00 0.00 0.00 175.10 175.45 2x3l s LEU 222 N 0.68 4.08 -0.24 3.92 2.96 -0.46 -1.65 118.68 127.98 2x3l s LEU 222 Ca -0.10 0.15 -0.10 0.00 -0.22 0.00 0.00 54.13 53.87 2x3l s LEU 222 Cb -0.13 -2.21 -0.05 0.00 0.50 0.00 0.00 46.19 44.30 2x3l s LEU 222 CO 0.01 -0.03 0.14 -0.31 -1.32 0.00 0.00 176.35 174.84 2x3l s TYR 223 N 1.47 3.26 -0.13 5.38 1.51 -0.19 -0.44 117.35 128.20 2x3l s TYR 223 Ca 0.10 0.10 -0.01 0.00 -1.01 0.00 0.00 57.07 56.26 2x3l s TYR 223 Cb -0.15 -2.27 -0.02 0.00 -0.11 0.00 0.00 41.96 39.42 2x3l s TYR 223 CO 0.08 -0.03 -0.12 0.42 -1.11 0.00 0.00 175.55 174.80 2x3l s ILE 224 N 1.20 3.19 0.24 2.71 1.01 -0.45 -1.21 121.20 127.89 2x3l s ILE 224 Ca 0.07 -0.61 -0.30 0.00 0.00 0.00 0.00 60.65 59.80 2x3l s ILE 224 Cb -0.14 -2.35 -0.10 0.00 0.01 0.00 0.00 42.46 39.88 2x3l s ILE 224 CO 0.05 0.52 1.41 -2.28 0.00 0.00 0.00 174.94 174.65 2x3l s HIS 225 N 0.30 3.07 -0.07 3.97 5.65 0.31 -1.87 115.29 126.65 2x3l s HIS 225 Ca -0.09 1.07 0.27 0.00 0.25 0.00 0.00 55.06 56.56 2x3l s HIS 225 Cb -0.15 -3.77 1.39 0.00 -1.18 0.00 0.00 32.58 28.86 2x3l s HIS 225 CO 0.05 -2.50 1.82 0.87 -0.65 0.00 0.00 174.74 174.33 2x3l h LYS 226 N 5.11 0.00 -0.07 2.88 1.57 -1.62 0.17 116.57 124.61 2x3l h LYS 226 Ca -0.46 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 2x3l h LYS 226 Cb 1.22 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.53 2x3l h LYS 226 CO 0.78 0.00 0.00 0.09 -0.57 0.00 0.00 179.45 179.75 2x3l n ASN 227 N -2.45 2.62 -4.76 0.86 3.02 -1.26 -5.05 115.26 108.25 2x3l n ASN 227 Ca -0.01 -1.79 -0.38 0.00 -0.03 0.00 0.00 54.58 52.38 2x3l n ASN 227 Cb 0.08 -0.03 0.03 0.00 -0.61 0.00 0.00 39.78 39.25 2x3l n ASN 227 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2x3l s ALA 228 N -1.49 2.81 0.43 5.41 0.00 0.05 -4.96 121.76 124.00 2x3l s ALA 228 Ca 0.23 1.15 -0.26 0.00 0.00 0.00 0.00 51.96 53.08 2x3l s ALA 228 Cb 0.16 -3.49 -0.09 0.00 0.00 0.00 0.00 23.12 19.69 2x3l s ALA 228 CO 0.23 -1.13 1.45 -2.14 0.00 0.00 0.00 175.76 174.17 2x3l s PRO 229 N -2.93 3.82 -1.69 0.00 0.02 -1.26 -3.71 135.00 129.25 2x3l s PRO 229 Ca 0.70 2.47 0.00 0.00 0.02 0.00 0.00 61.00 64.19 2x3l s PRO 229 Cb -0.35 -2.76 0.00 0.00 0.02 0.00 0.00 34.50 31.41 2x3l s PRO 229 CO 0.41 -0.72 0.00 0.66 -0.33 0.00 0.00 177.00 177.01 2x3l n TYR 230 N 0.02 -0.84 -0.20 6.54 0.53 -1.26 -4.90 117.16 117.05 2x3l n TYR 230 Ca 0.04 0.00 -0.00 0.00 -1.02 0.00 0.00 57.90 56.91 2x3l n TYR 230 Cb 0.41 -3.72 0.08 0.00 -1.03 0.00 0.00 39.34 35.08 2x3l n TYR 230 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 2x3l h ARG 231 N 0.00 0.05 -0.27 -0.72 3.08 -1.95 -1.11 114.38 113.46 2x3l h ARG 231 Ca -0.45 -0.00 -0.03 0.00 0.07 0.00 0.00 59.98 59.56 2x3l h ARG 231 Cb 1.33 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 31.36 2x3l h ARG 231 CO 0.55 0.03 0.05 0.93 -1.07 0.00 0.00 179.97 180.46 2x3l h GLU 232 N 0.05 0.44 -0.60 0.04 5.08 -1.92 -1.76 114.58 115.92 2x3l h GLU 232 Ca 0.30 -0.11 0.03 0.00 -1.00 0.00 0.00 59.36 58.58 2x3l h GLU 232 Cb 0.48 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.63 2x3l h GLU 232 CO -0.57 0.55 0.36 -0.91 -1.00 0.00 0.00 179.01 177.44 2x3l h ASN 233 N 0.26 0.59 -0.38 1.42 4.21 -1.86 -1.46 115.58 118.36 2x3l h ASN 233 Ca 0.08 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.60 2x3l h ASN 233 Cb 0.31 -0.12 -0.02 0.00 -1.12 0.00 0.00 38.32 37.37 2x3l h ASN 233 CO 0.00 0.41 0.24 0.40 -1.29 0.00 0.00 177.43 177.19 2x3l h ILE 234 N 0.72 1.12 -0.54 2.81 2.04 -1.02 -1.16 117.51 121.47 2x3l h ILE 234 Ca 0.24 -0.25 0.02 0.00 1.00 0.00 0.00 64.86 65.88 2x3l h ILE 234 Cb 0.03 0.59 -0.03 0.00 -0.74 0.00 0.00 36.82 36.67 2x3l h ILE 234 CO -0.10 0.11 0.36 0.40 0.00 0.00 0.00 178.15 178.92 2x3l h ILE 235 N 0.51 1.10 -0.25 -0.67 2.04 -0.97 -2.28 117.51 116.99 2x3l h ILE 235 Ca 0.14 -0.23 -0.19 0.00 1.00 0.00 0.00 64.86 65.58 2x3l h ILE 235 Cb -0.02 0.36 0.00 0.00 -0.74 0.00 0.00 36.82 36.43 2x3l h ILE 235 CO -0.03 0.12 -0.58 -0.08 0.00 0.00 0.00 178.15 177.59 2x3l h GLU 236 N 0.67 0.82 -0.18 2.37 4.57 -0.39 -3.24 114.58 119.20 2x3l h GLU 236 Ca 0.21 -0.56 -0.05 0.00 -1.18 0.00 0.00 59.36 57.78 2x3l h GLU 236 Cb 0.01 0.08 -0.01 0.00 -0.16 0.00 0.00 28.75 28.67 2x3l h GLU 236 CO -0.05 1.18 -0.12 1.88 -1.18 0.00 0.00 179.01 180.73 2x3l h TYR 237 N 0.58 0.30 -0.96 0.92 0.05 -0.81 -1.59 116.97 115.47 2x3l h TYR 237 Ca -0.00 -0.03 0.27 0.00 0.05 0.00 0.00 58.73 59.01 2x3l h TYR 237 Cb 1.19 -0.09 -0.05 0.00 1.01 0.00 0.00 36.73 38.80 2x3l h TYR 237 CO 0.08 0.41 0.68 -0.07 -1.05 0.00 0.00 178.16 178.20 2x3l h LEU 238 N 0.28 0.12 -0.69 3.88 3.38 -1.45 0.33 115.31 121.16 2x3l h LEU 238 Ca 0.06 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2x3l h LEU 238 Cb 0.38 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.13 2x3l h LEU 238 CO 0.02 0.04 -0.03 -1.54 0.09 0.00 0.00 178.44 177.01 2x3l n SER 239 N -4.33 1.11 -0.11 -0.43 3.41 -0.60 -2.63 113.62 110.03 2x3l n SER 239 Ca 0.21 -1.28 -0.24 0.00 -0.26 0.00 0.00 58.87 57.29 2x3l n SER 239 Cb 0.96 0.01 -0.11 0.00 -0.26 0.00 0.00 64.21 64.80 2x3l n SER 239 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 2x3l n TYR 240 N -0.20 0.38 1.16 7.33 0.53 0.98 -4.62 117.16 122.72 2x3l n TYR 240 Ca 0.19 0.13 0.13 0.00 -1.02 0.00 0.00 57.90 57.33 2x3l n TYR 240 Cb 0.31 -1.04 0.44 0.00 -1.03 0.00 0.00 39.34 38.02 2x3l n TYR 240 CO 0.00 0.00 0.00 1.19 -1.02 0.00 0.00 176.86 177.03 2x3l n PHE 241 N -3.98 0.00 -4.63 -0.72 3.01 -0.12 -4.74 117.46 106.28 2x3l n PHE 241 Ca -0.45 0.00 -0.33 0.00 1.01 0.00 0.00 57.45 57.68 2x3l n PHE 241 Cb 0.89 -0.26 -0.11 0.00 -0.01 0.00 0.00 39.48 39.99 2x3l n PHE 241 CO 0.00 0.00 0.00 -0.65 1.01 0.00 0.00 176.76 177.12 2x3l s GLN 242 N -2.77 2.59 0.52 -1.08 -0.21 -1.08 -4.91 119.66 112.73 2x3l s GLN 242 Ca 0.19 -0.66 -0.18 0.00 0.02 0.00 0.00 55.36 54.73 2x3l s GLN 242 Cb 0.19 -2.49 -0.14 0.00 1.00 0.00 0.00 33.01 31.56 2x3l s GLN 242 CO 0.57 0.63 -0.03 -2.37 -2.12 0.00 0.00 175.29 171.97 2x3l n THR 243 N 1.98 0.36 1.05 -0.19 5.66 -1.26 -4.77 114.28 117.10 2x3l n THR 243 Ca -0.17 -0.50 0.13 0.00 -3.05 0.00 0.00 64.05 60.46 2x3l n THR 243 Cb 0.53 -0.11 0.60 0.00 -1.55 0.00 0.00 70.33 69.79 2x3l n THR 243 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 2x3l n SER 244 N 2.19 0.00 -3.43 1.09 3.41 -1.26 -4.08 113.62 111.54 2x3l n SER 244 Ca 0.08 0.22 -0.30 0.00 -0.26 0.00 0.00 58.87 58.61 2x3l n SER 244 Cb 0.47 -0.40 -0.05 0.00 -0.26 0.00 0.00 64.21 63.97 2x3l n SER 244 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2x3l n SER 245 N -1.40 4.49 -4.77 4.04 7.64 -1.26 -5.05 113.62 117.31 2x3l n SER 245 Ca 0.09 -3.50 -0.38 0.00 1.01 0.00 0.00 58.87 56.09 2x3l n SER 245 Cb 0.25 -0.76 -0.03 0.00 -1.01 0.00 0.00 64.21 62.66 2x3l n SER 245 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2x3l s PRO 246 N -2.81 4.10 -0.06 1.43 0.04 -1.26 -4.96 135.00 131.47 2x3l s PRO 246 Ca 0.40 1.76 -0.30 0.00 0.04 0.00 0.00 61.00 62.90 2x3l s PRO 246 Cb 0.16 -2.66 -0.03 0.00 0.04 0.00 0.00 34.50 32.01 2x3l s PRO 246 CO -0.02 -0.26 1.13 0.45 0.04 0.00 0.00 177.00 178.34 2x3l s SER 247 N -1.23 7.13 0.36 6.66 0.15 -1.26 -4.93 113.70 120.58 2x3l s SER 247 Ca 0.57 1.73 0.19 0.00 0.70 0.00 0.00 55.95 59.13 2x3l s SER 247 Cb -0.29 -2.56 0.49 0.00 -1.71 0.00 0.00 66.02 61.95 2x3l s SER 247 CO 0.36 -0.52 1.64 1.88 1.20 0.00 0.00 173.24 177.80 2x3l h TYR 248 N 7.28 0.00 0.07 3.44 0.05 -1.87 -1.86 116.97 124.09 2x3l h TYR 248 Ca -0.34 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.44 2x3l h TYR 248 Cb 1.16 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.90 2x3l h TYR 248 CO 0.72 0.36 -0.03 -0.07 -1.05 0.00 0.00 178.16 178.09 2x3l h LEU 249 N 0.00 -0.08 -0.14 3.88 3.38 -1.92 -0.40 115.31 120.03 2x3l h LEU 249 Ca -0.00 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.81 2x3l h LEU 249 Cb 1.06 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.82 2x3l h LEU 249 CO 0.05 0.11 0.09 0.40 0.09 0.00 0.00 178.44 179.18 2x3l h ILE 250 N -0.27 1.05 -0.63 1.22 2.04 -1.93 -1.36 117.51 117.63 2x3l h ILE 250 Ca -0.01 -0.10 0.02 0.00 1.00 0.00 0.00 64.86 65.78 2x3l h ILE 250 Cb 0.23 0.85 -0.04 0.00 -0.74 0.00 0.00 36.82 37.13 2x3l h ILE 250 CO 0.02 0.04 0.40 0.24 0.00 0.00 0.00 178.15 178.84 2x3l h MET 251 N 0.18 0.77 -0.25 2.37 2.86 -1.34 -0.81 114.93 118.71 2x3l h MET 251 Ca 0.05 -0.05 -0.03 0.00 -2.06 0.00 0.00 59.70 57.62 2x3l h MET 251 Cb -0.01 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 31.46 2x3l h MET 251 CO -0.01 0.51 0.02 0.00 1.06 0.00 0.00 176.91 178.49 2x3l h ALA 252 N 1.26 1.57 -0.09 6.32 0.00 -0.91 -2.41 119.26 125.00 2x3l h ALA 252 Ca 0.24 -0.14 -0.16 0.00 0.00 0.00 0.00 54.91 54.86 2x3l h ALA 252 Cb -0.02 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2x3l h ALA 252 CO -0.08 0.32 -0.63 0.66 0.00 0.00 0.00 179.25 179.51 2x3l h SER 253 N 0.36 0.39 -0.34 0.00 4.64 -0.02 0.31 113.55 118.90 2x3l h SER 253 Ca 0.08 -0.23 0.02 0.00 -0.47 0.00 0.00 61.79 61.20 2x3l h SER 253 Cb 0.21 -0.11 -0.03 0.00 -0.31 0.00 0.00 62.40 62.16 2x3l h SER 253 CO 0.00 0.92 0.17 -0.07 -0.87 0.00 0.00 176.83 176.99 2x3l h LEU 254 N 0.25 0.26 -0.53 5.97 3.38 -1.02 0.62 115.31 124.24 2x3l h LEU 254 Ca -0.01 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2x3l h LEU 254 Cb 1.16 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.85 2x3l h LEU 254 CO 0.10 0.19 0.28 -0.08 0.09 0.00 0.00 178.44 179.02 2x3l h GLU 255 N 0.36 0.75 -0.52 1.13 4.81 -1.10 0.92 114.58 120.93 2x3l h GLU 255 Ca 0.14 -0.10 -0.05 0.00 -0.13 0.00 0.00 59.36 59.22 2x3l h GLU 255 Cb 0.05 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.27 2x3l h GLU 255 CO -0.10 0.59 0.12 1.03 -0.73 0.00 0.00 179.01 179.92 2x3l h SER 256 N 0.71 0.79 0.36 1.04 0.87 -0.85 -2.37 113.55 114.09 2x3l h SER 256 Ca 0.18 -0.24 -0.12 0.00 -1.23 0.00 0.00 61.79 60.39 2x3l h SER 256 Cb 0.08 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 61.81 2x3l h SER 256 CO -0.03 0.83 -0.49 0.00 -0.53 0.00 0.00 176.83 176.61 2x3l h ALA 257 N 1.00 1.05 -0.42 6.23 0.00 -0.54 -1.25 119.26 125.33 2x3l h ALA 257 Ca 0.16 -0.46 -0.08 0.00 0.00 0.00 0.00 54.91 54.52 2x3l h ALA 257 Cb 0.35 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2x3l h ALA 257 CO 0.00 0.64 -0.06 0.00 0.00 0.00 0.00 179.25 179.84 2x3l h ALA 258 N 1.36 0.58 -0.78 0.00 0.00 -0.72 -0.35 119.26 119.35 2x3l h ALA 258 Ca 0.00 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.57 2x3l h ALA 258 Cb 0.92 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 2x3l h ALA 258 CO 0.07 0.42 0.32 0.37 0.00 0.00 0.00 179.25 180.44 2x3l h GLN 259 N 0.61 1.14 -0.62 0.00 5.75 -1.15 -0.85 115.11 120.00 2x3l h GLN 259 Ca 0.11 -0.19 -0.01 0.00 -0.15 0.00 0.00 58.65 58.41 2x3l h GLN 259 Cb 0.57 -0.19 -0.03 0.00 1.07 0.00 0.00 27.48 28.90 2x3l h GLN 259 CO 0.03 0.92 0.33 0.35 -2.65 0.00 0.00 178.83 177.81 2x3l h PHE 260 N 1.12 0.85 -0.41 3.99 3.57 -1.05 -2.46 116.94 122.55 2x3l h PHE 260 Ca 0.26 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.73 2x3l h PHE 260 Cb 0.19 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 38.64 2x3l h PHE 260 CO 0.02 0.62 0.23 -0.92 -2.23 0.00 0.00 178.31 176.03 2x3l h TYR 261 N 0.84 0.56 -0.26 0.41 5.03 -0.79 -1.42 116.97 121.34 2x3l h TYR 261 Ca 0.22 -0.01 -0.00 0.00 2.58 0.00 0.00 58.73 61.52 2x3l h TYR 261 Cb 0.05 -0.18 -0.01 0.00 1.55 0.00 0.00 36.73 38.14 2x3l h TYR 261 CO -0.01 0.42 0.16 -0.22 -1.32 0.00 0.00 178.16 177.19 2x3l h LYS 262 N 0.54 0.34 -0.13 1.82 3.64 -0.94 -3.16 116.57 118.67 2x3l h LYS 262 Ca 0.15 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 2x3l h LYS 262 Cb 0.04 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.79 2x3l h LYS 262 CO -0.02 0.24 0.00 0.25 -2.27 0.00 0.00 179.45 177.65 2x3l n THR 263 N -4.48 0.87 -2.03 1.00 -2.24 -0.94 -5.04 114.28 101.40 2x3l n THR 263 Ca 0.01 -0.93 -0.41 0.00 -2.27 0.00 0.00 64.05 60.45 2x3l n THR 263 Cb 0.08 0.58 -0.02 0.00 -2.10 0.00 0.00 70.33 68.87 2x3l n THR 263 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2x3l s TYR 264 N -0.92 2.96 -0.13 4.78 5.04 -0.55 -5.03 117.35 123.51 2x3l s TYR 264 Ca 0.09 1.27 0.02 0.00 -2.44 0.00 0.00 57.07 56.01 2x3l s TYR 264 Cb 0.05 -3.78 -0.00 0.00 0.35 0.00 0.00 41.96 38.58 2x3l s TYR 264 CO 0.07 -2.26 -0.19 0.34 -1.34 0.00 0.00 175.55 172.16 2x3l s ASP 265 N -0.20 3.42 0.00 4.32 3.68 -1.26 -4.93 116.67 121.69 2x3l s ASP 265 Ca 0.52 -0.51 0.22 0.00 2.13 0.00 0.00 52.55 54.92 2x3l s ASP 265 Cb -0.41 -1.50 -0.03 0.00 -1.45 0.00 0.00 42.92 39.53 2x3l s ASP 265 CO 0.52 0.12 1.04 -1.54 0.13 0.00 0.00 175.17 175.44 2x3l n SER 266 N 3.83 0.90 -0.24 -0.34 3.41 -1.26 -4.41 113.62 115.51 2x3l n SER 266 Ca -0.19 -0.82 0.03 0.00 -0.26 0.00 0.00 58.87 57.63 2x3l n SER 266 Cb 0.52 0.79 0.12 0.00 -0.26 0.00 0.00 64.21 65.39 2x3l n SER 266 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 2x3l h THR 267 N 0.07 0.39 -0.37 6.66 2.02 -1.95 0.16 112.91 119.89 2x3l h THR 267 Ca 0.00 -0.03 -0.03 0.00 0.77 0.00 0.00 66.41 67.12 2x3l h THR 267 Cb 0.51 0.29 -0.02 0.00 -1.74 0.00 0.00 68.15 67.19 2x3l h THR 267 CO 0.00 0.02 0.11 0.25 0.37 0.00 0.00 175.52 176.26 2x3l h LEU 268 N 0.09 0.48 0.30 2.58 5.85 -1.89 -2.74 115.31 119.98 2x3l h LEU 268 Ca 0.37 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 59.01 2x3l h LEU 268 Cb 0.62 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.53 2x3l h LEU 268 CO -0.62 0.48 -0.14 0.15 -0.34 0.00 0.00 178.44 177.96 2x3l h PHE 269 N 0.52 -0.37 0.00 1.25 3.04 -0.89 -2.08 116.94 118.41 2x3l h PHE 269 Ca 0.13 -0.01 -0.02 0.00 3.98 0.00 0.00 57.97 62.05 2x3l h PHE 269 Cb 0.18 0.12 -0.00 0.00 2.56 0.00 0.00 35.95 38.80 2x3l h PHE 269 CO 0.01 -0.12 -0.10 0.74 -2.02 0.00 0.00 178.31 176.82 2x3l h PHE 270 N -0.57 0.00 0.00 0.41 0.04 -1.15 0.25 116.94 115.92 2x3l h PHE 270 Ca -0.04 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.73 2x3l h PHE 270 Cb 0.42 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.57 2x3l h PHE 270 CO -0.01 0.10 -0.00 0.00 -0.60 0.00 0.00 178.31 177.79 2x3l h ALA 271 N 1.90 -0.00 -0.39 2.45 0.00 -1.43 -2.70 119.26 119.09 2x3l h ALA 271 Ca -0.00 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.54 2x3l h ALA 271 Cb 0.19 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2x3l h ALA 271 CO 0.01 -0.18 0.03 0.87 0.00 0.00 0.00 179.25 179.98 2x3l h LYS 272 N -0.65 0.60 -0.56 0.00 1.57 -0.80 -1.55 116.57 115.17 2x3l h LYS 272 Ca -0.00 -0.13 0.01 0.00 -1.87 0.00 0.00 60.65 58.67 2x3l h LYS 272 Cb 0.64 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.84 2x3l h LYS 272 CO 0.00 0.60 0.36 -0.09 -0.57 0.00 0.00 179.45 179.75 2x3l h ARG 273 N 0.58 0.70 -0.36 3.15 2.43 -0.59 -1.13 114.38 119.16 2x3l h ARG 273 Ca 0.12 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.23 2x3l h ARG 273 Cb 0.32 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.70 2x3l h ARG 273 CO 0.01 0.47 0.13 0.00 -1.51 0.00 0.00 179.97 179.07 2x3l h ALA 274 N 1.22 0.47 -0.29 2.80 0.00 -1.04 -1.54 119.26 120.89 2x3l h ALA 274 Ca 0.22 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 55.03 2x3l h ALA 274 Cb -0.04 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.57 2x3l h ALA 274 CO -0.07 0.09 0.02 1.96 0.00 0.00 0.00 179.25 181.25 2x3l h GLN 275 N 0.44 0.11 -0.26 0.00 4.20 -1.18 -0.03 115.11 118.39 2x3l h GLN 275 Ca 0.12 -0.01 0.04 0.00 0.06 0.00 0.00 58.65 58.87 2x3l h GLN 275 Cb 0.21 -0.03 -0.04 0.00 0.30 0.00 0.00 27.48 27.93 2x3l h GLN 275 CO -0.01 0.07 0.01 1.25 -0.67 0.00 0.00 178.83 179.48 2x3l h LEU 276 N 0.11 -0.09 -0.19 1.46 5.85 -0.96 0.12 115.31 121.61 2x3l h LEU 276 Ca 0.14 0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.91 2x3l h LEU 276 Cb 0.17 0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 2x3l h LEU 276 CO -0.21 -0.01 0.12 0.40 -0.34 0.00 0.00 178.44 178.40 2x3l h ILE 277 N 0.09 1.08 -0.67 4.05 2.04 -1.10 -0.40 117.51 122.59 2x3l h ILE 277 Ca 0.12 -0.18 0.08 0.00 1.00 0.00 0.00 64.86 65.89 2x3l h ILE 277 Cb 0.15 0.85 -0.11 0.00 -0.74 0.00 0.00 36.82 36.97 2x3l h ILE 277 CO -0.20 0.07 -0.51 -0.33 0.00 0.00 0.00 178.15 177.18 2x3l h GLU 278 N 0.24 -0.19 0.00 2.37 5.08 -0.69 0.22 114.58 121.60 2x3l h GLU 278 Ca 0.07 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 2x3l h GLU 278 Cb 0.01 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.30 2x3l h GLU 278 CO -0.01 -0.13 -0.02 0.00 -1.00 0.00 0.00 179.01 177.85 2x3l h LEU 280 N -0.03 0.12 -0.78 0.00 3.38 -0.82 -2.84 115.31 114.34 2x3l h LEU 280 Ca 0.01 0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 2x3l h LEU 280 Cb 0.04 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 2x3l h LEU 280 CO -0.02 0.11 0.34 -0.33 0.09 0.00 0.00 178.44 178.63 2x3l h GLU 281 N 0.27 1.15 0.00 1.13 5.08 -0.16 -1.07 114.58 120.97 2x3l h GLU 281 Ca 0.16 -0.19 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2x3l h GLU 281 Cb 0.14 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.19 2x3l h GLU 281 CO -0.17 0.92 0.00 0.09 -1.00 0.00 0.00 179.01 178.85 2x3l n ASN 282 N -4.33 0.50 -0.17 1.42 3.02 -0.40 -1.33 115.26 113.99 2x3l n ASN 282 Ca 0.07 0.67 0.12 0.00 -0.03 0.00 0.00 54.58 55.41 2x3l n ASN 282 Cb 0.16 -0.76 0.25 0.00 -0.61 0.00 0.00 39.78 38.82 2x3l n ASN 282 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 2x3l n LYS 283 N -2.11 0.52 0.00 3.52 3.00 -0.45 -4.95 118.16 117.69 2x3l n LYS 283 Ca 0.01 -0.34 0.00 0.00 -0.00 0.00 0.00 58.31 57.98 2x3l n LYS 283 Cb 0.13 -1.49 0.00 0.00 0.00 0.00 0.00 35.03 33.67 2x3l n LYS 283 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2x3l n GLY 284 N 1.42 0.42 3.78 3.14 0.00 -0.44 -5.01 105.19 108.49 2x3l n GLY 284 Ca 0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.75 2x3l n GLY 284 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2x3l s PHE 285 N -2.00 2.87 -0.15 1.61 0.08 -0.92 -4.73 117.98 114.75 2x3l s PHE 285 Ca 0.00 1.56 0.02 0.00 0.12 0.00 0.00 56.93 58.63 2x3l s PHE 285 Cb 0.00 -3.23 0.01 0.00 -0.57 0.00 0.00 43.02 39.23 2x3l s PHE 285 CO 0.00 -1.25 -0.20 -1.21 -0.10 0.00 0.00 175.22 172.46 2x3l s GLU 286 N -3.04 2.88 -0.11 0.44 2.02 -0.35 -4.09 118.70 116.45 2x3l s GLU 286 Ca 0.67 -0.80 -0.04 0.00 0.02 0.00 0.00 54.97 54.83 2x3l s GLU 286 Cb -0.23 -2.39 -0.04 0.00 0.10 0.00 0.00 34.13 31.58 2x3l s GLU 286 CO 0.27 -0.08 0.04 -1.64 0.02 0.00 0.00 175.26 173.86 2x3l s MET 287 N 1.00 3.26 -0.32 1.61 -1.94 -1.26 0.26 119.30 121.90 2x3l s MET 287 Ca -0.03 -0.35 -0.14 0.00 -1.71 0.00 0.00 55.69 53.46 2x3l s MET 287 Cb -0.15 -2.94 -0.02 0.00 2.01 0.00 0.00 34.83 33.73 2x3l s MET 287 CO -0.05 0.63 0.33 -0.51 -0.01 0.00 0.00 175.02 175.42 2x3l s LEU 288 N -0.67 4.33 -0.37 -0.03 1.43 -0.78 -5.01 118.68 117.59 2x3l s LEU 288 Ca 0.11 -0.14 -0.29 0.00 -1.03 0.00 0.00 54.13 52.78 2x3l s LEU 288 Cb -0.12 -2.31 0.02 0.00 0.03 0.00 0.00 46.19 43.81 2x3l s LEU 288 CO 0.02 -0.27 1.16 -1.10 0.23 0.00 0.00 176.35 176.39 2x3l s GLN 289 N 1.97 3.89 0.62 1.70 -1.52 -1.26 -4.16 119.66 120.90 2x3l s GLN 289 Ca 0.11 0.93 0.04 0.00 -1.95 0.00 0.00 55.36 54.50 2x3l s GLN 289 Cb -0.16 -3.84 0.09 0.00 -0.22 0.00 0.00 33.01 28.88 2x3l s GLN 289 CO 0.11 -1.15 0.85 0.14 -0.25 0.00 0.00 175.29 175.00 2x3l s VAL 290 N 4.17 2.27 0.23 1.09 -7.23 -1.26 -5.02 120.40 114.65 2x3l s VAL 290 Ca 0.49 -0.80 -0.08 0.00 -1.81 0.00 0.00 61.98 59.78 2x3l s VAL 290 Cb -0.11 -2.46 0.21 0.00 0.56 0.00 0.00 36.38 34.57 2x3l s VAL 290 CO 0.23 0.00 1.88 0.44 -0.31 0.00 0.00 175.10 177.35 2x3l h ASP 291 N -0.08 1.06 -3.34 4.85 5.19 -1.89 -3.40 116.42 118.82 2x3l h ASP 291 Ca -0.34 -0.06 -0.59 0.00 -0.62 0.00 0.00 57.03 55.41 2x3l h ASP 291 Cb 1.28 -0.27 -0.09 0.00 0.18 0.00 0.00 39.33 40.43 2x3l h ASP 291 CO 0.42 0.81 0.53 -0.62 -3.12 0.00 0.00 179.24 177.26 2x3l s ASP 292 N -6.10 6.79 0.61 6.45 3.68 -0.73 -4.61 116.67 122.76 2x3l s ASP 292 Ca -0.13 0.89 0.39 0.00 2.13 0.00 0.00 52.55 55.83 2x3l s ASP 292 Cb 0.17 -2.45 1.88 0.00 -1.45 0.00 0.00 42.92 41.06 2x3l s ASP 292 CO 0.81 -0.64 2.17 -0.65 0.13 0.00 0.00 175.17 176.99 2x3l h PRO 293 N 7.94 0.00 0.00 4.34 0.11 -1.89 -2.76 132.00 139.74 2x3l h PRO 293 Ca -0.23 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.85 2x3l h PRO 293 Cb 1.09 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 2x3l h PRO 293 CO 0.92 0.01 -0.17 1.25 -0.21 0.00 0.00 178.00 179.79 2x3l h LEU 294 N 0.00 0.00 -8.73 2.35 5.85 -1.93 -3.42 115.31 109.43 2x3l h LEU 294 Ca -0.00 0.00 -0.67 0.00 0.84 0.00 0.00 57.88 58.05 2x3l h LEU 294 Cb 0.27 0.00 -0.19 0.00 0.37 0.00 0.00 40.66 41.11 2x3l h LEU 294 CO 0.00 0.17 -0.49 -0.54 -0.34 0.00 0.00 178.44 177.24 2x3l s LYS 295 N -3.95 3.56 -0.20 1.25 -0.14 -1.04 -0.69 119.74 118.54 2x3l s LYS 295 Ca -0.01 -0.59 -0.04 0.00 -1.36 0.00 0.00 55.97 53.96 2x3l s LYS 295 Cb 0.12 -3.76 -0.02 0.00 -1.68 0.00 0.00 37.83 32.49 2x3l s LYS 295 CO 0.61 -0.40 -0.03 -1.17 -0.76 0.00 0.00 175.35 173.60 2x3l s LEU 296 N 1.72 3.03 -0.26 3.17 2.96 -0.00 -4.58 118.68 124.72 2x3l s LEU 296 Ca 0.06 -0.30 -0.07 0.00 -0.22 0.00 0.00 54.13 53.60 2x3l s LEU 296 Cb -0.17 -1.76 -0.02 0.00 0.50 0.00 0.00 46.19 44.74 2x3l s LEU 296 CO 0.10 0.04 0.07 -0.76 -1.32 0.00 0.00 176.35 174.49 2x3l s LEU 297 N 1.12 3.54 -0.20 -0.68 1.43 -1.26 0.06 118.68 122.68 2x3l s LEU 297 Ca 0.02 -0.32 -0.05 0.00 -1.03 0.00 0.00 54.13 52.75 2x3l s LEU 297 Cb -0.15 -1.92 -0.03 0.00 0.03 0.00 0.00 46.19 44.13 2x3l s LEU 297 CO 0.00 -0.07 0.01 -0.63 0.23 0.00 0.00 176.35 175.89 2x3l s ILE 298 N 1.59 4.05 0.30 -0.59 1.01 0.62 -1.86 121.20 126.32 2x3l s ILE 298 Ca 0.06 -0.28 0.10 0.00 0.00 0.00 0.00 60.65 60.52 2x3l s ILE 298 Cb -0.16 -2.84 -0.05 0.00 0.01 0.00 0.00 42.46 39.43 2x3l s ILE 298 CO 0.03 0.42 -0.01 -0.54 0.00 0.00 0.00 174.94 174.85 2x3l s LYS 299 N 0.97 2.17 -0.24 2.79 1.02 0.14 -1.35 119.74 125.24 2x3l s LYS 299 Ca 0.02 -1.57 -0.03 0.00 0.02 0.00 0.00 55.97 54.40 2x3l s LYS 299 Cb -0.14 -2.05 0.13 0.00 -0.52 0.00 0.00 37.83 35.25 2x3l s LYS 299 CO 0.02 0.26 0.42 -0.47 -0.92 0.00 0.00 175.35 174.66 2x3l s TYR 300 N -2.41 -0.93 -0.08 3.18 5.04 -1.26 -1.21 117.35 119.67 2x3l s TYR 300 Ca 0.33 1.10 -0.38 0.00 -2.44 0.00 0.00 57.07 55.67 2x3l s TYR 300 Cb -0.04 0.15 -0.16 0.00 0.35 0.00 0.00 41.96 42.26 2x3l s TYR 300 CO 0.19 -0.69 1.52 0.39 -1.34 0.00 0.00 175.55 175.62 2x3l n GLU 301 N 5.38 1.14 -0.01 4.97 1.02 -1.26 -1.14 120.64 130.74 2x3l n GLU 301 Ca -0.04 0.41 0.00 0.00 -0.02 0.00 0.00 57.16 57.51 2x3l n GLU 301 Cb 0.50 -2.08 0.00 0.00 -0.02 0.00 0.00 31.44 29.85 2x3l n GLU 301 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2x3l n GLY 302 N 3.28 0.65 3.27 0.62 0.00 -1.07 -2.85 105.19 109.09 2x3l n GLY 302 Ca 0.22 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.10 2x3l n GLY 302 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2x3l s PHE 303 N -2.23 1.31 0.43 1.61 0.08 -0.29 -4.79 117.98 114.10 2x3l s PHE 303 Ca 0.00 -0.98 0.06 0.00 0.12 0.00 0.00 56.93 56.13 2x3l s PHE 303 Cb 0.00 -0.75 0.01 0.00 -0.57 0.00 0.00 43.02 41.71 2x3l s PHE 303 CO 0.00 -0.15 0.60 0.95 -0.10 0.00 0.00 175.22 176.52 2x3l s THR 304 N -3.57 3.24 0.28 0.64 -4.23 -1.26 -4.51 115.64 106.22 2x3l s THR 304 Ca 0.25 -0.89 -0.00 0.00 -1.18 0.00 0.00 61.69 59.86 2x3l s THR 304 Cb 0.06 -3.12 0.12 0.00 1.34 0.00 0.00 72.50 70.90 2x3l s THR 304 CO 0.05 -0.06 1.79 1.23 -0.54 0.00 0.00 174.62 177.09 2x3l h GLY 305 N 0.56 0.79 1.02 3.99 0.00 -1.42 -1.83 103.07 106.17 2x3l h GLY 305 Ca -0.42 -0.51 -0.03 0.00 0.00 0.00 0.00 47.33 46.37 2x3l h GLY 305 CO 0.49 0.47 0.38 0.45 0.00 0.00 0.00 176.54 178.34 2x3l h HIS 306 N 0.69 1.12 -0.40 5.60 3.86 -1.84 0.56 115.15 124.73 2x3l h HIS 306 Ca 0.14 -0.05 0.01 0.00 -1.16 0.00 0.00 60.37 59.30 2x3l h HIS 306 Cb 0.42 -0.35 -0.02 0.00 1.06 0.00 0.00 27.41 28.52 2x3l h HIS 306 CO 0.02 0.81 0.26 -0.44 0.86 0.00 0.00 177.93 179.45 2x3l h ASP 307 N 1.10 0.46 -0.41 2.45 3.32 -1.86 0.35 116.42 121.83 2x3l h ASP 307 Ca 0.27 -0.01 -0.13 0.00 0.02 0.00 0.00 57.03 57.18 2x3l h ASP 307 Cb 0.11 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 2x3l h ASP 307 CO -0.04 0.33 -0.26 0.40 -1.72 0.00 0.00 179.24 177.95 2x3l h ILE 308 N 0.54 1.28 -0.27 0.35 2.04 -0.80 -0.66 117.51 119.99 2x3l h ILE 308 Ca 0.15 -1.42 0.05 0.00 1.00 0.00 0.00 64.86 64.64 2x3l h ILE 308 Cb -0.06 1.29 -0.05 0.00 -0.74 0.00 0.00 36.82 37.26 2x3l h ILE 308 CO -0.04 0.48 -0.07 -0.61 0.00 0.00 0.00 178.15 177.91 2x3l h GLN 309 N 0.73 -0.01 -0.52 2.37 4.15 0.29 -2.02 115.11 120.10 2x3l h GLN 309 Ca 0.08 0.00 0.01 0.00 0.77 0.00 0.00 58.65 59.51 2x3l h GLN 309 Cb 0.84 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.51 2x3l h GLN 309 CO 0.07 -0.01 0.34 -0.91 -1.93 0.00 0.00 178.83 176.39 2x3l h ASN 310 N -0.01 0.58 -0.52 -0.69 2.35 -0.65 -1.39 115.58 115.26 2x3l h ASN 310 Ca 0.13 -0.01 0.05 0.00 -0.55 0.00 0.00 56.30 55.92 2x3l h ASN 310 Cb 0.21 -0.14 -0.05 0.00 0.05 0.00 0.00 38.32 38.39 2x3l h ASN 310 CO -0.28 0.42 0.25 -0.50 -1.65 0.00 0.00 177.43 175.67 2x3l h TRP 311 N 0.69 0.46 -0.38 1.19 6.55 -0.88 -0.84 115.95 122.74 2x3l h TRP 311 Ca 0.19 0.02 -0.05 0.00 0.95 0.00 0.00 58.89 60.00 2x3l h TRP 311 Cb -0.06 -0.13 -0.01 0.00 -0.86 0.00 0.00 29.16 28.09 2x3l h TRP 311 CO -0.04 0.22 0.03 0.74 -1.05 0.00 0.00 178.44 178.33 2x3l h PHE 312 N 0.49 0.71 -0.64 0.49 0.04 -1.20 -3.10 116.94 113.72 2x3l h PHE 312 Ca 0.23 -0.11 0.06 0.00 2.80 0.00 0.00 57.97 60.94 2x3l h PHE 312 Cb 0.15 -0.19 -0.05 0.00 2.20 0.00 0.00 35.95 38.06 2x3l h PHE 312 CO -0.11 0.72 0.35 1.98 -0.60 0.00 0.00 178.31 180.66 2x3l h MET 313 N 0.49 0.64 -0.30 1.51 4.05 -0.81 0.95 114.93 121.46 2x3l h MET 313 Ca 0.11 -0.04 0.09 0.00 -0.28 0.00 0.00 59.70 59.58 2x3l h MET 313 Cb 0.42 -0.14 -0.01 0.00 -0.80 0.00 0.00 31.60 31.06 2x3l h MET 313 CO 0.01 0.42 0.43 -0.91 0.23 0.00 0.00 176.91 177.10 2x3l h ASN 314 N 0.66 0.00 -0.61 1.39 2.35 -1.09 0.73 115.58 119.00 2x3l h ASN 314 Ca 0.29 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.04 2x3l h ASN 314 Cb 0.17 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.54 2x3l h ASN 314 CO -0.18 0.00 0.00 0.00 -1.65 0.00 0.00 177.43 175.60 2x3l n ALA 315 N -2.20 2.92 -2.31 -0.83 0.00 0.25 -4.95 120.51 113.40 2x3l n ALA 315 Ca 0.05 -1.39 -0.20 0.00 0.00 0.00 0.00 53.44 51.89 2x3l n ALA 315 Cb 0.57 -1.01 -0.02 0.00 0.00 0.00 0.00 19.45 18.99 2x3l n ALA 315 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2x3l n HIS 316 N 1.12 -0.87 -4.30 0.00 8.25 0.25 -4.92 115.22 114.75 2x3l n HIS 316 Ca 0.23 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.35 2x3l n HIS 316 Cb 0.78 -3.86 -0.12 0.00 1.12 0.00 0.00 29.99 27.90 2x3l n HIS 316 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2x3l s ILE 317 N -2.99 3.89 -0.34 1.59 1.01 -0.73 -0.81 121.20 122.81 2x3l s ILE 317 Ca 0.00 -0.35 -0.04 0.00 0.00 0.00 0.00 60.65 60.26 2x3l s ILE 317 Cb 0.00 -2.72 0.06 0.00 0.01 0.00 0.00 42.46 39.81 2x3l s ILE 317 CO 0.00 0.47 0.08 -0.31 0.00 0.00 0.00 174.94 175.19 2x3l s TYR 318 N 0.55 3.32 0.94 3.97 2.02 0.10 -2.26 117.35 125.99 2x3l s TYR 318 Ca -0.02 -1.79 -0.12 0.00 -0.37 0.00 0.00 57.07 54.76 2x3l s TYR 318 Cb -0.14 -2.39 0.15 0.00 -0.40 0.00 0.00 41.96 39.18 2x3l s TYR 318 CO 0.02 -0.81 1.12 -0.51 -1.57 0.00 0.00 175.55 173.80 2x3l s LEU 319 N 1.29 1.88 -0.08 -1.29 1.43 -1.26 -0.62 118.68 120.02 2x3l s LEU 319 Ca -0.01 1.07 -0.13 0.00 -1.03 0.00 0.00 54.13 54.02 2x3l s LEU 319 Cb -0.20 -3.35 -0.10 0.00 0.03 0.00 0.00 46.19 42.57 2x3l s LEU 319 CO -0.00 -2.75 0.45 -0.08 0.23 0.00 0.00 176.35 174.20 2x3l h GLU 320 N -1.63 -0.14 -3.15 1.70 4.57 -1.11 -3.42 114.58 111.39 2x3l h GLU 320 Ca -0.52 0.01 -0.05 0.00 -1.18 0.00 0.00 59.36 57.62 2x3l h GLU 320 Cb 1.33 0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 29.94 2x3l h GLU 320 CO 0.60 0.17 0.21 -0.48 -1.18 0.00 0.00 179.01 178.34 2x3l s LEU 321 N -8.69 0.13 0.05 1.64 0.05 -1.24 -5.00 118.68 105.63 2x3l s LEU 321 Ca -0.08 -1.17 -0.14 0.00 0.05 0.00 0.00 54.13 52.79 2x3l s LEU 321 Cb -0.00 2.67 0.02 0.00 -2.05 0.00 0.00 46.19 46.83 2x3l s LEU 321 CO 0.28 -1.63 0.32 0.00 -0.55 0.00 0.00 176.35 174.77 2x3l s ALA 322 N -2.46 -0.72 0.47 1.48 0.00 -1.26 -0.88 121.76 118.39 2x3l s ALA 322 Ca 0.17 -0.00 0.02 0.00 0.00 0.00 0.00 51.96 52.16 2x3l s ALA 322 Cb -0.05 0.37 -0.01 0.00 0.00 0.00 0.00 23.12 23.44 2x3l s ALA 322 CO 0.12 -0.45 0.09 -0.40 0.00 0.00 0.00 175.76 175.12 2x3l n ASP 323 N 0.44 2.19 0.02 0.00 5.68 -0.60 -4.85 116.55 119.42 2x3l n ASP 323 Ca -0.18 -3.29 0.20 0.00 -0.50 0.00 0.00 54.79 51.02 2x3l n ASP 323 Cb 0.60 0.78 0.70 0.00 -1.14 0.00 0.00 41.12 42.06 2x3l n ASP 323 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 2x3l h ASP 324 N 1.52 0.00 0.00 -1.12 3.32 -1.97 -2.63 116.42 115.54 2x3l h ASP 324 Ca -0.38 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.65 2x3l h ASP 324 Cb 1.30 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.84 2x3l h ASP 324 CO 0.61 0.00 -0.14 1.88 -1.72 0.00 0.00 179.24 179.87 2x3l h TYR 325 N 0.00 0.00 -3.40 4.55 -1.99 -1.94 -3.15 116.97 111.04 2x3l h TYR 325 Ca 0.24 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.95 2x3l h TYR 325 Cb 0.98 0.00 -0.07 0.00 2.00 0.00 0.00 36.73 39.64 2x3l h TYR 325 CO 0.00 0.99 0.02 1.14 -0.00 0.00 0.00 178.16 180.31 2x3l s GLN 326 N -2.20 1.69 0.11 4.88 1.03 -1.18 -4.22 119.66 119.76 2x3l s GLN 326 Ca -0.19 -1.19 0.06 0.00 0.04 0.00 0.00 55.36 54.08 2x3l s GLN 326 Cb -0.02 0.53 -0.04 0.00 0.03 0.00 0.00 33.01 33.51 2x3l s GLN 326 CO 0.64 -0.73 -0.02 0.00 -2.54 0.00 0.00 175.29 172.63 2x3l s ALA 327 N -3.85 3.20 -0.22 2.60 0.00 -0.46 -1.55 121.76 121.48 2x3l s ALA 327 Ca 0.18 -1.18 -0.04 0.00 0.00 0.00 0.00 51.96 50.92 2x3l s ALA 327 Cb -0.03 -1.09 -0.01 0.00 0.00 0.00 0.00 23.12 21.99 2x3l s ALA 327 CO 0.09 0.66 -0.03 -1.17 0.00 0.00 0.00 175.76 175.31 2x3l s LEU 328 N -2.37 2.98 -0.23 0.00 2.96 -0.05 -0.28 118.68 121.68 2x3l s LEU 328 Ca 0.25 -0.35 -0.11 0.00 -0.22 0.00 0.00 54.13 53.70 2x3l s LEU 328 Cb -0.11 -1.76 -0.05 0.00 0.50 0.00 0.00 46.19 44.76 2x3l s LEU 328 CO 0.17 -0.01 0.17 0.00 -1.32 0.00 0.00 176.35 175.36 2x3l s ALA 329 N 1.42 3.62 -0.46 5.97 0.00 0.11 -1.39 121.76 131.02 2x3l s ALA 329 Ca 0.05 -0.85 -0.17 0.00 0.00 0.00 0.00 51.96 50.99 2x3l s ALA 329 Cb -0.14 -2.32 0.04 0.00 0.00 0.00 0.00 23.12 20.70 2x3l s ALA 329 CO -0.02 -0.15 0.49 0.42 0.00 0.00 0.00 175.76 176.50 2x3l s ILE 330 N 0.97 5.06 0.60 0.00 1.01 -0.74 -0.82 121.20 127.27 2x3l s ILE 330 Ca 0.08 -0.55 -0.17 0.00 0.00 0.00 0.00 60.65 60.01 2x3l s ILE 330 Cb -0.13 -4.14 -0.03 0.00 0.01 0.00 0.00 42.46 38.17 2x3l s ILE 330 CO 0.04 -0.57 1.13 -0.76 0.00 0.00 0.00 174.94 174.77 2x3l s LEU 331 N 2.18 3.58 0.62 2.97 1.43 0.14 -4.16 118.68 125.43 2x3l s LEU 331 Ca 0.11 2.11 -0.16 0.00 -1.03 0.00 0.00 54.13 55.17 2x3l s LEU 331 Cb -0.19 -4.57 -0.02 0.00 0.03 0.00 0.00 46.19 41.44 2x3l s LEU 331 CO 0.12 -1.43 1.08 -2.84 0.23 0.00 0.00 176.35 173.51 2x3l s PRO 332 N -3.65 3.10 -1.39 1.29 0.02 -1.26 -4.93 135.00 128.18 2x3l s PRO 332 Ca 0.70 1.31 -0.10 0.00 0.02 0.00 0.00 61.00 62.93 2x3l s PRO 332 Cb -0.23 -2.00 0.08 0.00 0.02 0.00 0.00 34.50 32.38 2x3l s PRO 332 CO 0.34 -1.00 2.24 1.28 -0.33 0.00 0.00 177.00 179.53 2x3l n LEU 333 N -2.14 7.31 -4.51 -5.54 4.77 -1.26 -4.99 117.00 110.64 2x3l n LEU 333 Ca 0.10 -4.51 -0.46 0.00 -0.03 0.00 0.00 56.01 51.11 2x3l n LEU 333 Cb 0.52 -1.52 -0.02 0.00 -2.33 0.00 0.00 43.42 40.08 2x3l n LEU 333 CO 0.47 1.54 0.31 0.79 -1.33 0.00 0.00 177.39 179.17 2x3l n TRP 334 N 4.02 0.45 -4.07 -1.77 8.01 -1.26 -4.87 117.44 117.95 2x3l n TRP 334 Ca 0.53 0.80 -0.10 0.00 -1.31 0.00 0.00 57.50 57.42 2x3l n TRP 334 Cb 0.33 -2.12 -0.08 0.00 -2.01 0.00 0.00 31.31 27.43 2x3l n TRP 334 CO 0.00 0.00 0.00 -3.38 -1.01 0.00 0.00 177.69 173.30 2x3l s HIS 335 N -1.07 0.69 0.22 -5.99 -3.43 -1.26 -4.27 115.29 100.18 2x3l s HIS 335 Ca 0.61 -1.01 -0.08 0.00 -0.80 0.00 0.00 55.06 53.78 2x3l s HIS 335 Cb -0.78 -0.20 0.25 0.00 -1.43 0.00 0.00 32.58 30.42 2x3l s HIS 335 CO 0.58 -0.76 1.84 1.12 -2.00 0.00 0.00 174.74 175.52 2x3l h HIS 336 N 2.51 0.82 -0.81 0.38 2.07 -1.95 -2.67 115.15 115.51 2x3l h HIS 336 Ca -0.32 0.02 -0.42 0.00 -2.85 0.00 0.00 60.37 56.81 2x3l h HIS 336 Cb 1.24 -0.26 -0.25 0.00 2.57 0.00 0.00 27.41 30.71 2x3l h HIS 336 CO 0.38 0.43 0.53 -0.40 -3.07 0.00 0.00 177.93 175.80 2x3l n ASP 337 N -4.69 3.63 -4.93 3.10 5.75 -1.26 -4.98 116.55 113.17 2x3l n ASP 337 Ca 0.09 -3.30 -0.25 0.00 -0.01 0.00 0.00 54.79 51.32 2x3l n ASP 337 Cb 0.14 -0.77 0.02 0.00 -1.03 0.00 0.00 41.12 39.47 2x3l n ASP 337 CO 0.00 0.00 0.00 1.51 -0.11 0.00 0.00 177.20 178.60 2x3l s ASP 338 N -0.86 5.82 -0.29 -1.12 3.84 -1.01 -5.02 116.67 118.02 2x3l s ASP 338 Ca 0.46 0.59 0.08 0.00 -0.00 0.00 0.00 52.55 53.69 2x3l s ASP 338 Cb 0.39 -1.75 0.47 0.00 -1.38 0.00 0.00 42.92 40.65 2x3l s ASP 338 CO 0.09 -0.83 1.39 0.35 -0.00 0.00 0.00 175.17 176.17 2x3l n THR 339 N -2.33 2.52 -2.53 2.11 -2.24 -0.70 -5.02 114.28 106.10 2x3l n THR 339 Ca 0.02 -3.15 -0.40 0.00 -2.27 0.00 0.00 64.05 58.25 2x3l n THR 339 Cb 0.57 -0.48 -0.05 0.00 -2.10 0.00 0.00 70.33 68.27 2x3l n THR 339 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2x3l s TYR 340 N -3.34 3.62 -1.41 4.78 5.04 -1.26 -4.86 117.35 119.91 2x3l s TYR 340 Ca 0.45 1.73 -0.09 0.00 -2.44 0.00 0.00 57.07 56.73 2x3l s TYR 340 Cb 0.40 -3.22 0.06 0.00 0.35 0.00 0.00 41.96 39.56 2x3l s TYR 340 CO -0.01 -0.38 2.41 1.28 -1.34 0.00 0.00 175.55 177.50 2x3l n LEU 341 N 1.10 7.79 0.13 6.97 4.77 -1.26 -4.71 117.00 131.79 2x3l n LEU 341 Ca -0.01 -4.60 -0.14 0.00 -0.03 0.00 0.00 56.01 51.24 2x3l n LEU 341 Cb 0.46 -1.48 -0.08 0.00 -2.33 0.00 0.00 43.42 39.99 2x3l n LEU 341 CO 0.52 1.79 0.75 0.15 -1.33 0.00 0.00 177.39 179.27 2x3l h PHE 342 N 5.14 -0.27 -0.78 -1.77 3.04 -1.99 0.25 116.94 120.57 2x3l h PHE 342 Ca 0.67 -0.01 0.09 0.00 3.98 0.00 0.00 57.97 62.70 2x3l h PHE 342 Cb 0.41 0.09 -0.07 0.00 2.56 0.00 0.00 35.95 38.94 2x3l h PHE 342 CO 1.59 -0.09 0.43 -0.44 -2.02 0.00 0.00 178.31 177.77 2x3l h ASP 343 N -0.38 0.60 -0.07 0.41 3.32 -1.99 -0.13 116.42 118.17 2x3l h ASP 343 Ca -0.03 0.05 -0.11 0.00 0.02 0.00 0.00 57.03 56.96 2x3l h ASP 343 Cb 0.29 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 2x3l h ASP 343 CO 0.05 0.35 -0.31 0.28 -1.72 0.00 0.00 179.24 177.88 2x3l h SER 344 N 0.72 0.56 0.52 6.45 0.02 -1.88 0.22 113.55 120.16 2x3l h SER 344 Ca 0.37 -0.22 -0.02 0.00 -0.84 0.00 0.00 61.79 61.09 2x3l h SER 344 Cb 0.35 -0.15 -0.00 0.00 0.14 0.00 0.00 62.40 62.73 2x3l h SER 344 CO -0.25 0.84 -0.31 0.25 -1.14 0.00 0.00 176.83 176.22 2x3l h LEU 345 N 0.47 -0.77 -1.10 5.07 5.85 -0.14 0.73 115.31 125.41 2x3l h LEU 345 Ca 0.06 0.04 -0.06 0.00 0.84 0.00 0.00 57.88 58.76 2x3l h LEU 345 Cb 0.77 0.22 -0.02 0.00 0.37 0.00 0.00 40.66 42.01 2x3l h LEU 345 CO 0.06 -0.49 0.02 -0.07 -0.34 0.00 0.00 178.44 177.62 2x3l h LEU 346 N -0.78 0.62 -0.70 2.25 3.38 -0.84 -1.83 115.31 117.41 2x3l h LEU 346 Ca -0.06 -0.13 -0.14 0.00 0.09 0.00 0.00 57.88 57.65 2x3l h LEU 346 Cb 0.64 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 2x3l h LEU 346 CO 0.07 0.68 -0.51 -0.09 0.09 0.00 0.00 178.44 178.68 2x3l h ARG 347 N 0.63 0.37 -0.38 1.13 9.65 -0.49 -1.92 114.38 123.36 2x3l h ARG 347 Ca 0.13 -0.22 -0.15 0.00 -1.10 0.00 0.00 59.98 58.65 2x3l h ARG 347 Cb 0.36 0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 28.95 2x3l h ARG 347 CO 0.01 0.79 -0.35 0.87 2.80 0.00 0.00 179.97 184.09 2x3l h LYS 348 N 0.29 0.89 -0.50 0.20 1.57 -0.27 -2.81 116.57 115.95 2x3l h LYS 348 Ca 0.01 -0.45 -0.07 0.00 -1.87 0.00 0.00 60.65 58.27 2x3l h LYS 348 Cb 0.99 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.29 2x3l h LYS 348 CO 0.09 1.09 0.03 0.82 -0.57 0.00 0.00 179.45 180.91 2x3l h ILE 349 N 0.74 1.26 -0.58 1.86 2.04 -1.25 -2.78 117.51 118.80 2x3l h ILE 349 Ca 0.07 -1.04 -0.00 0.00 1.00 0.00 0.00 64.86 64.89 2x3l h ILE 349 Cb 0.93 0.94 -0.03 0.00 -0.74 0.00 0.00 36.82 37.92 2x3l h ILE 349 CO 0.09 0.37 0.35 -0.33 0.00 0.00 0.00 178.15 178.63 2x3l h GLU 350 N 0.74 0.79 -0.00 2.37 5.08 -1.26 -2.88 114.58 119.41 2x3l h GLU 350 Ca 0.15 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 2x3l h GLU 350 Cb 0.48 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.57 2x3l h GLU 350 CO 0.02 0.56 -0.18 -0.25 -1.00 0.00 0.00 179.01 178.16 2x3l n ASP 351 N -4.64 0.25 -4.63 1.42 10.43 -1.07 -4.90 116.55 113.42 2x3l n ASP 351 Ca 0.04 0.04 -0.44 0.00 2.57 0.00 0.00 54.79 56.99 2x3l n ASP 351 Cb 0.05 -0.17 -0.02 0.00 1.84 0.00 0.00 41.12 42.83 2x3l n ASP 351 CO 0.00 0.00 0.00 0.80 -1.07 0.00 0.00 177.20 176.93 2x3l n MET 352 N -1.39 1.68 -3.71 -1.24 1.56 -1.05 -4.97 117.12 107.99 2x3l n MET 352 Ca 0.08 0.59 -0.38 0.00 -0.27 0.00 0.00 57.70 57.72 2x3l n MET 352 Cb 0.32 -2.08 -0.12 0.00 2.15 0.00 0.00 33.22 33.49 2x3l n MET 352 CO 0.00 0.00 0.00 -1.50 -0.73 0.00 0.00 175.97 173.74 2x3l s ILE 353 N -0.81 4.01 0.15 1.12 1.10 -1.26 -5.07 121.20 120.43 2x3l s ILE 353 Ca 0.61 -1.04 0.05 0.00 -0.51 0.00 0.00 60.65 59.77 2x3l s ILE 353 Cb -0.67 -3.25 -0.04 0.00 0.15 0.00 0.00 42.46 38.65 2x3l s ILE 353 CO 0.58 -0.18 0.08 -0.76 -2.11 0.00 0.00 174.94 172.55 2x3l s LEU 354 N 1.45 3.62 1.03 8.50 1.43 -1.26 -5.12 118.68 128.33 2x3l s LEU 354 Ca -0.00 -0.20 -0.12 0.00 -1.03 0.00 0.00 54.13 52.77 2x3l s LEU 354 Cb -0.19 -2.26 0.21 0.00 0.03 0.00 0.00 46.19 43.97 2x3l s LEU 354 CO 0.04 0.10 1.07 -2.84 0.23 0.00 0.00 176.35 174.95 2x3l s PRO 355 N -2.90 0.15 0.00 1.29 0.02 -1.26 -4.91 135.00 127.39 2x3l s PRO 355 Ca 0.29 0.69 0.18 0.00 0.02 0.00 0.00 61.00 62.19 2x3l s PRO 355 Cb -0.10 -1.69 1.04 0.00 0.02 0.00 0.00 34.50 33.77 2x3l s PRO 355 CO 0.21 -2.97 1.52 1.63 -0.33 0.00 0.00 177.00 177.07 2x3l n LYS 356 N -4.36 0.47 -0.27 5.54 5.02 -1.26 -4.96 118.16 118.34 2x3l n LYS 356 Ca 0.05 0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.38 2x3l n LYS 356 Cb 0.56 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.07 2x3l n LYS 356 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2x3l n LYS 357 N -1.10 -0.64 -0.57 1.97 4.81 -1.26 -5.13 118.16 116.23 2x3l n LYS 357 Ca 0.12 0.50 0.00 0.00 -0.87 0.00 0.00 58.31 58.06 2x3l n LYS 357 Cb 0.09 -0.51 0.00 0.00 0.02 0.00 0.00 35.03 34.64 2x3l n LYS 357 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 2x3l n SER 358 N -0.32 0.00 0.00 3.14 2.88 -1.13 -4.99 113.62 113.19 2x3l n SER 358 Ca 0.00 -0.36 0.00 0.00 -1.33 0.00 0.00 58.87 57.18 2x3l n SER 358 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2x3l n SER 358 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2x3l n VAL 359 N 0.00 0.00 -3.15 2.46 0.31 -1.26 -2.58 118.33 114.10 2x3l n VAL 359 Ca 0.00 0.00 0.05 0.00 -0.01 0.00 0.00 64.34 64.38 2x3l n VAL 359 Cb 0.00 0.00 -0.00 0.00 -0.91 0.00 0.00 33.84 32.93 2x3l n VAL 359 CO 0.00 0.00 0.00 -1.58 -1.32 0.00 0.00 176.83 173.93 2x3l s GLN 366 N 0.00 0.40 0.62 5.55 0.74 -1.26 -4.98 119.66 120.72 2x3l s GLN 366 Ca 0.00 0.48 -0.13 0.00 0.05 0.00 0.00 55.36 55.76 2x3l s GLN 366 Cb 0.00 0.24 -0.03 0.00 1.10 0.00 0.00 33.01 34.32 2x3l s GLN 366 CO 0.00 -0.66 1.04 -0.51 -0.55 0.00 0.00 175.29 174.61 2x3l s LEU 367 N 2.89 3.33 0.04 3.68 1.43 -1.26 -5.00 118.68 123.78 2x3l s LEU 367 Ca 0.15 1.59 -0.30 0.00 -1.03 0.00 0.00 54.13 54.54 2x3l s LEU 367 Cb -0.09 -4.50 -0.06 0.00 0.03 0.00 0.00 46.19 41.58 2x3l s LEU 367 CO -0.23 -1.06 1.31 -0.22 0.23 0.00 0.00 176.35 176.38 2x3l s LEU 368 N -4.95 4.34 -0.01 1.79 2.96 -1.26 -4.91 118.68 116.64 2x3l s LEU 368 Ca 0.58 2.09 0.12 0.00 -0.22 0.00 0.00 54.13 56.71 2x3l s LEU 368 Cb -0.13 -3.57 -0.15 0.00 0.50 0.00 0.00 46.19 42.84 2x3l s LEU 368 CO 0.46 -0.61 0.40 0.35 -1.32 0.00 0.00 176.35 175.63 2x3l n THR 369 N 4.26 0.00 -1.53 3.68 -2.24 -1.26 -4.83 114.28 112.36 2x3l n THR 369 Ca 0.11 -0.25 -0.31 0.00 -2.27 0.00 0.00 64.05 61.33 2x3l n THR 369 Cb 0.44 0.66 0.06 0.00 -2.10 0.00 0.00 70.33 69.39 2x3l n THR 369 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2x3l s THR 370 N -2.43 3.71 0.91 4.28 -4.23 -1.26 -1.28 115.64 115.34 2x3l s THR 370 Ca 0.00 0.60 -0.12 0.00 -1.18 0.00 0.00 61.69 60.99 2x3l s THR 370 Cb 0.08 -3.21 0.14 0.00 1.34 0.00 0.00 72.50 70.85 2x3l s THR 370 CO 0.49 -0.68 1.10 -1.83 -0.54 0.00 0.00 174.62 173.15 2x3l s GLU 371 N -4.83 1.11 -0.19 3.99 -1.05 -1.26 -4.64 118.70 111.83 2x3l s GLU 371 Ca 0.60 0.68 -0.30 0.00 -0.15 0.00 0.00 54.97 55.80 2x3l s GLU 371 Cb -0.16 -1.80 0.14 0.00 -0.44 0.00 0.00 34.13 31.87 2x3l s GLU 371 CO 0.52 -2.30 1.08 0.20 0.95 0.00 0.00 175.26 175.71 2x3l s GLY 372 N -3.53 -0.18 0.36 -3.83 0.00 -0.90 -4.95 107.32 94.29 2x3l s GLY 372 Ca 0.64 2.24 -0.26 0.00 0.00 0.00 0.00 44.72 47.34 2x3l s GLY 372 CO 0.57 1.09 1.06 0.21 0.00 0.00 0.00 173.10 176.02 2x3l s ASN 373 N -1.02 6.93 -0.09 1.64 3.84 -1.26 0.65 114.94 125.64 2x3l s ASN 373 Ca 0.01 2.09 0.04 0.00 0.21 0.00 0.00 52.86 55.21 2x3l s ASN 373 Cb -0.01 -2.60 -0.00 0.00 -0.55 0.00 0.00 41.25 38.09 2x3l s ASN 373 CO -0.01 -0.37 -0.22 -0.47 -2.79 0.00 0.00 177.10 173.24 2x3l s TYR 374 N -1.51 2.35 -0.08 0.43 5.04 -0.32 -3.54 117.35 119.72 2x3l s TYR 374 Ca 0.53 -0.90 0.03 0.00 -2.44 0.00 0.00 57.07 54.29 2x3l s TYR 374 Cb -0.25 -1.58 -0.02 0.00 0.35 0.00 0.00 41.96 40.46 2x3l s TYR 374 CO 0.31 -0.35 -0.15 0.15 -1.34 0.00 0.00 175.55 174.17 2x3l s LYS 375 N 0.28 2.82 0.00 4.97 1.02 0.39 -1.92 119.74 127.30 2x3l s LYS 375 Ca -0.15 -0.72 0.00 0.00 0.02 0.00 0.00 55.97 55.12 2x3l s LYS 375 Cb -0.17 -2.44 0.00 0.00 -0.52 0.00 0.00 37.83 34.70 2x3l s LYS 375 CO 0.07 0.45 0.88 -0.35 -0.92 0.00 0.00 175.35 175.48 2x3l n PRO 376 N 2.82 0.90 0.00 -1.68 -0.04 -1.26 -4.39 135.00 131.34 2x3l n PRO 376 Ca -0.18 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.28 2x3l n PRO 376 Cb 0.52 -1.06 0.00 0.00 -0.04 0.00 0.00 33.50 32.92 2x3l n PRO 376 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2x3l n LYS 377 N 0.54 -1.30 0.00 0.54 4.81 -1.26 -4.81 118.16 116.68 2x3l n LYS 377 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 2x3l n LYS 377 Cb 0.44 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.49 2x3l n LYS 377 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2x3l n TYR 381 N -2.65 0.00 -4.18 5.64 4.01 -1.26 -4.90 117.16 113.82 2x3l n TYR 381 Ca 0.00 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.63 2x3l n TYR 381 Cb 0.00 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 38.93 2x3l n TYR 381 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 2x3l s VAL 382 N 0.00 0.52 -0.09 -0.72 -7.23 -1.26 -5.05 120.40 106.58 2x3l s VAL 382 Ca 0.00 -1.93 -0.25 0.00 -1.81 0.00 0.00 61.98 57.99 2x3l s VAL 382 Cb 0.00 -1.86 0.06 0.00 0.56 0.00 0.00 36.38 35.14 2x3l s VAL 382 CO 0.00 -0.70 0.59 0.28 -0.31 0.00 0.00 175.10 174.96 2x3l s THR 383 N -3.75 0.01 0.01 5.32 -1.32 -0.98 -5.00 115.64 109.94 2x3l s THR 383 Ca 0.17 -0.09 -0.28 0.00 -1.21 0.00 0.00 61.69 60.27 2x3l s THR 383 Cb 0.06 -0.89 -0.04 0.00 -1.51 0.00 0.00 72.50 70.13 2x3l s THR 383 CO -0.02 -0.05 0.90 0.26 -2.21 0.00 0.00 174.62 173.50 2x3l s TRP 384 N -0.85 3.68 -0.01 9.09 0.52 -1.26 -1.69 118.94 128.41 2x3l s TRP 384 Ca -0.09 1.61 0.05 0.00 0.02 0.00 0.00 56.10 57.69 2x3l s TRP 384 Cb -0.02 -3.02 -0.01 0.00 -1.15 0.00 0.00 33.47 29.27 2x3l s TRP 384 CO 0.07 0.07 -0.16 0.00 0.02 0.00 0.00 176.95 176.95 2x3l n ASP 386 N 2.66 2.90 -0.09 0.00 10.43 -1.26 -0.46 116.55 130.72 2x3l n ASP 386 Ca -0.15 1.20 -0.07 0.00 2.57 0.00 0.00 54.79 58.35 2x3l n ASP 386 Cb 0.54 -1.50 -0.01 0.00 1.84 0.00 0.00 41.12 42.00 2x3l n ASP 386 CO 0.00 0.00 0.00 -0.07 -1.07 0.00 0.00 177.20 176.06 2x3l h LEU 387 N 2.76 -0.76 -1.78 0.64 3.38 -1.93 -0.29 115.31 117.33 2x3l h LEU 387 Ca -0.46 0.15 0.24 0.00 0.09 0.00 0.00 57.88 57.90 2x3l h LEU 387 Cb 1.28 0.38 -0.05 0.00 0.09 0.00 0.00 40.66 42.36 2x3l h LEU 387 CO 0.64 -0.26 0.63 0.11 0.09 0.00 0.00 178.44 179.65 2x3l h LYS 388 N -0.19 0.16 -0.24 1.13 1.57 -1.92 -0.76 116.57 116.32 2x3l h LYS 388 Ca 0.17 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.94 2x3l h LYS 388 Cb 0.45 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.73 2x3l h LYS 388 CO -0.44 0.11 0.00 1.63 -0.57 0.00 0.00 179.45 180.17 2x3l n LYS 389 N -4.38 2.32 0.00 3.15 5.02 -0.21 -4.34 118.16 119.72 2x3l n LYS 389 Ca 0.19 -2.09 0.12 0.00 -2.02 0.00 0.00 58.31 54.52 2x3l n LYS 389 Cb 0.87 -1.47 0.17 0.00 -0.02 0.00 0.00 35.03 34.59 2x3l n LYS 389 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2x3l n ALA 390 N 1.36 2.96 -1.76 7.82 0.00 -0.29 -4.92 120.51 125.68 2x3l n ALA 390 Ca 0.16 -0.59 -0.39 0.00 0.00 0.00 0.00 53.44 52.62 2x3l n ALA 390 Cb 0.58 -0.91 0.01 0.00 0.00 0.00 0.00 19.45 19.13 2x3l n ALA 390 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2x3l s LYS 391 N -2.25 3.71 0.00 0.00 2.20 -1.25 -2.48 119.74 119.67 2x3l s LYS 391 Ca 0.26 2.16 0.00 0.00 -0.36 0.00 0.00 55.97 58.02 2x3l s LYS 391 Cb 0.19 -2.58 0.00 0.00 -1.51 0.00 0.00 37.83 33.94 2x3l s LYS 391 CO 0.44 -0.71 0.00 0.41 -0.36 0.00 0.00 175.35 175.13 2x3l n GLY 392 N 0.63 0.94 3.84 5.54 0.00 0.52 -4.96 105.19 111.71 2x3l n GLY 392 Ca 0.06 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.87 2x3l n GLY 392 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2x3l s LYS 393 N -0.04 2.79 -0.17 1.61 1.02 -1.04 -4.75 119.74 119.17 2x3l s LYS 393 Ca 0.00 -1.22 -0.19 0.00 0.02 0.00 0.00 55.97 54.58 2x3l s LYS 393 Cb 0.00 -2.51 -0.03 0.00 -0.52 0.00 0.00 37.83 34.77 2x3l s LYS 393 CO 0.00 0.19 0.54 0.08 -0.92 0.00 0.00 175.35 175.24 2x3l s VAL 394 N -2.25 5.11 0.16 3.17 1.01 -1.26 -0.27 120.40 126.07 2x3l s VAL 394 Ca 0.38 1.03 -0.30 0.00 0.00 0.00 0.00 61.98 63.09 2x3l s VAL 394 Cb -0.06 -3.87 -0.08 0.00 0.00 0.00 0.00 36.38 32.37 2x3l s VAL 394 CO 0.26 0.21 1.31 -0.22 0.00 0.00 0.00 175.10 176.66 2x3l s LEU 395 N 1.33 4.40 0.00 3.92 2.96 0.69 -4.47 118.68 127.52 2x3l s LEU 395 Ca 0.26 2.32 0.12 0.00 -0.22 0.00 0.00 54.13 56.62 2x3l s LEU 395 Cb -0.16 -3.60 0.13 0.00 0.50 0.00 0.00 46.19 43.06 2x3l s LEU 395 CO 0.11 -0.54 0.94 0.00 -1.32 0.00 0.00 176.35 175.54 2x3l n ALA 396 N 3.09 2.44 -3.54 5.97 0.00 -0.63 0.35 120.51 128.19 2x3l n ALA 396 Ca 0.08 -0.67 -0.14 0.00 0.00 0.00 0.00 53.44 52.71 2x3l n ALA 396 Cb 0.43 -0.43 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 2x3l n ALA 396 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2x3l s ARG 397 N -1.04 0.76 0.45 0.00 3.52 -1.26 -4.91 118.95 116.47 2x3l s ARG 397 Ca 0.16 0.86 -0.24 0.00 -0.13 0.00 0.00 55.73 56.38 2x3l s ARG 397 Cb 0.11 0.37 -0.09 0.00 -1.56 0.00 0.00 34.95 33.77 2x3l s ARG 397 CO 0.16 -0.10 1.14 0.72 -0.81 0.00 0.00 175.30 176.41 2x3l n HIS 398 N 2.65 1.62 -3.49 5.12 8.25 -1.26 -4.53 115.22 123.58 2x3l n HIS 398 Ca -0.14 0.51 -0.39 0.00 -0.26 0.00 0.00 57.72 57.44 2x3l n HIS 398 Cb 0.56 -2.29 -0.10 0.00 1.12 0.00 0.00 29.99 29.27 2x3l n HIS 398 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2x3l s ILE 399 N -1.26 5.24 -0.31 1.59 1.01 -0.11 -3.79 121.20 123.57 2x3l s ILE 399 Ca 0.64 0.23 0.01 0.00 0.00 0.00 0.00 60.65 61.53 2x3l s ILE 399 Cb -0.51 -3.65 0.09 0.00 0.01 0.00 0.00 42.46 38.40 2x3l s ILE 399 CO 0.56 0.13 0.05 -0.69 0.00 0.00 0.00 174.94 175.00 2x3l s VAL 400 N 1.90 1.53 0.25 2.92 1.01 -0.71 -1.74 120.40 125.57 2x3l s VAL 400 Ca 0.10 -1.74 -0.25 0.00 0.00 0.00 0.00 61.98 60.09 2x3l s VAL 400 Cb -0.16 -2.09 -0.09 0.00 0.00 0.00 0.00 36.38 34.04 2x3l s VAL 400 CO 0.11 -0.55 0.86 -2.16 0.00 0.00 0.00 175.10 173.35 2x3l s PRO 401 N 1.30 4.55 -0.30 2.72 0.04 -1.26 -1.44 135.00 140.61 2x3l s PRO 401 Ca 0.08 1.21 -0.01 0.00 0.04 0.00 0.00 61.00 62.32 2x3l s PRO 401 Cb -0.18 -2.99 0.06 0.00 0.04 0.00 0.00 34.50 31.43 2x3l s PRO 401 CO -0.15 0.40 -0.01 0.71 0.04 0.00 0.00 177.00 177.99 2x3l s TYR 402 N -1.43 3.31 0.69 0.56 2.02 0.30 0.18 117.35 122.97 2x3l s TYR 402 Ca 0.44 -2.05 -0.10 0.00 -0.37 0.00 0.00 57.07 54.99 2x3l s TYR 402 Cb -0.20 -2.17 0.02 0.00 -0.40 0.00 0.00 41.96 39.21 2x3l s TYR 402 CO 0.25 -0.84 1.07 -1.25 -1.57 0.00 0.00 175.55 173.21 2x3l s PRO 403 N 1.20 2.79 -0.14 -1.71 0.04 -1.26 -3.63 135.00 132.28 2x3l s PRO 403 Ca -0.05 0.33 0.16 0.00 0.04 0.00 0.00 61.00 61.49 2x3l s PRO 403 Cb -0.20 -2.06 0.71 0.00 0.04 0.00 0.00 34.50 32.99 2x3l s PRO 403 CO -0.02 -1.02 1.61 -0.35 0.04 0.00 0.00 177.00 177.26 2x3l n PRO 404 N -2.95 3.94 -2.32 0.56 -0.04 -1.06 -4.91 135.00 128.22 2x3l n PRO 404 Ca 0.07 -2.78 -0.13 0.00 -0.04 0.00 0.00 63.50 60.61 2x3l n PRO 404 Cb 0.58 -1.98 -0.00 0.00 -0.04 0.00 0.00 33.50 32.05 2x3l n PRO 404 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2x3l n GLY 405 N 0.94 -0.15 3.28 0.55 0.00 0.13 -4.87 105.19 105.07 2x3l n GLY 405 Ca 0.25 -0.32 -0.16 0.00 0.00 0.00 0.00 46.02 45.79 2x3l n GLY 405 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2x3l s ILE 406 N -2.69 1.37 0.15 -0.61 -5.25 -1.26 -4.97 121.20 107.94 2x3l s ILE 406 Ca 0.03 -2.10 -0.30 0.00 -0.99 0.00 0.00 60.65 57.29 2x3l s ILE 406 Cb -0.01 -1.90 -0.07 0.00 2.95 0.00 0.00 42.46 43.43 2x3l s ILE 406 CO 0.04 -0.68 1.20 -2.84 -1.79 0.00 0.00 174.94 170.87 2x3l s PRO 407 N -3.65 4.48 -0.13 0.37 0.02 -1.26 -4.03 135.00 130.79 2x3l s PRO 407 Ca 0.18 1.84 0.17 0.00 0.02 0.00 0.00 61.00 63.21 2x3l s PRO 407 Cb 0.01 -3.27 -0.24 0.00 0.02 0.00 0.00 34.50 31.02 2x3l s PRO 407 CO 0.03 -0.14 0.31 0.44 -0.33 0.00 0.00 177.00 177.31 2x3l n ILE 408 N 2.95 1.36 -3.97 2.83 -5.35 -0.71 -4.91 119.36 111.56 2x3l n ILE 408 Ca 0.06 -0.81 -0.20 0.00 -0.27 0.00 0.00 62.75 61.52 2x3l n ILE 408 Cb 0.45 -0.61 -0.17 0.00 -1.74 0.00 0.00 39.64 37.57 2x3l n ILE 408 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 2x3l s ILE 409 N -2.61 0.41 0.26 7.28 1.01 -1.22 -4.69 121.20 121.64 2x3l s ILE 409 Ca -0.08 0.01 -0.00 0.00 0.00 0.00 0.00 60.65 60.58 2x3l s ILE 409 Cb 0.07 -0.50 -0.04 0.00 0.01 0.00 0.00 42.46 42.01 2x3l s ILE 409 CO 0.83 0.22 0.45 -0.36 0.00 0.00 0.00 174.94 176.09 2x3l s PHE 410 N 1.33 3.48 0.24 3.97 0.08 -1.26 -0.93 117.98 124.89 2x3l s PHE 410 Ca -0.05 0.34 -0.30 0.00 0.12 0.00 0.00 56.93 57.05 2x3l s PHE 410 Cb -0.13 -1.87 -0.09 0.00 -0.57 0.00 0.00 43.02 40.36 2x3l s PHE 410 CO -0.02 0.29 1.31 -1.59 -0.10 0.00 0.00 175.22 175.11 2x3l s LYS 411 N -3.69 4.38 0.00 0.44 -2.85 -1.26 -2.48 119.74 114.28 2x3l s LYS 411 Ca 0.39 2.11 0.00 0.00 -1.00 0.00 0.00 55.97 57.47 2x3l s LYS 411 Cb -0.10 -3.16 0.00 0.00 -2.06 0.00 0.00 37.83 32.51 2x3l s LYS 411 CO 0.31 -0.23 0.00 0.41 0.10 0.00 0.00 175.35 175.94 2x3l n GLY 412 N 1.92 2.74 3.82 0.59 0.00 0.15 -4.89 105.19 109.53 2x3l n GLY 412 Ca 0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 2x3l n GLY 412 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2x3l s GLU 413 N -0.55 3.98 -0.13 1.61 2.02 -1.04 -0.46 118.70 124.14 2x3l s GLU 413 Ca 0.00 1.14 -0.22 0.00 0.02 0.00 0.00 54.97 55.91 2x3l s GLU 413 Cb 0.00 -2.14 -0.03 0.00 0.10 0.00 0.00 34.13 32.06 2x3l s GLU 413 CO 0.00 -0.25 0.65 0.99 0.02 0.00 0.00 175.26 176.67 2x3l s THR 414 N -2.27 5.05 0.07 3.63 2.01 -1.23 -0.22 115.64 122.67 2x3l s THR 414 Ca 0.63 1.28 -0.30 0.00 0.31 0.00 0.00 61.69 63.60 2x3l s THR 414 Cb -0.11 -3.98 -0.06 0.00 0.01 0.00 0.00 72.50 68.36 2x3l s THR 414 CO 0.21 0.19 1.17 -0.63 -0.69 0.00 0.00 174.62 174.87 2x3l s ILE 415 N 1.30 4.10 0.41 1.82 1.01 0.63 -4.90 121.20 125.57 2x3l s ILE 415 Ca 0.32 1.53 0.07 0.00 0.00 0.00 0.00 60.65 62.58 2x3l s ILE 415 Cb -0.16 -3.98 -0.06 0.00 0.01 0.00 0.00 42.46 38.26 2x3l s ILE 415 CO 0.13 0.13 0.13 0.42 0.00 0.00 0.00 174.94 175.75 2x3l s THR 416 N 0.92 2.23 0.15 2.92 -4.23 -1.26 -0.35 115.64 116.01 2x3l s THR 416 Ca 0.57 -1.79 -0.23 0.00 -1.18 0.00 0.00 61.69 59.06 2x3l s THR 416 Cb -0.29 -2.99 0.01 0.00 1.34 0.00 0.00 72.50 70.57 2x3l s THR 416 CO 0.30 -0.01 1.63 -0.33 -0.54 0.00 0.00 174.62 175.67 2x3l h GLU 417 N 1.54 -0.27 -0.72 3.99 5.08 -2.00 -2.45 114.58 119.75 2x3l h GLU 417 Ca -0.43 0.02 0.04 0.00 -1.00 0.00 0.00 59.36 57.99 2x3l h GLU 417 Cb 1.25 0.06 -0.05 0.00 0.50 0.00 0.00 28.75 30.51 2x3l h GLU 417 CO 0.73 -0.18 0.44 -0.91 -1.00 0.00 0.00 179.01 178.09 2x3l h ASN 418 N -0.28 0.70 -0.25 1.42 2.35 -2.00 -2.27 115.58 115.25 2x3l h ASN 418 Ca 0.12 0.01 -0.00 0.00 -0.55 0.00 0.00 56.30 55.88 2x3l h ASN 418 Cb 0.47 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.70 2x3l h ASN 418 CO -0.37 0.47 0.14 0.24 -1.65 0.00 0.00 177.43 176.26 2x3l h MET 419 N 0.83 0.34 -1.00 0.81 2.86 -1.91 -2.22 114.93 114.64 2x3l h MET 419 Ca 0.30 -0.04 0.03 0.00 -2.06 0.00 0.00 59.70 57.93 2x3l h MET 419 Cb 0.09 -0.07 -0.06 0.00 0.06 0.00 0.00 31.60 31.63 2x3l h MET 419 CO -0.14 0.30 0.66 0.82 1.06 0.00 0.00 176.91 179.61 2x3l h ILE 420 N 0.29 1.21 0.80 -1.22 2.04 -1.15 -0.73 117.51 118.75 2x3l h ILE 420 Ca 0.09 -0.45 -0.04 0.00 1.00 0.00 0.00 64.86 65.46 2x3l h ILE 420 Cb 0.05 -0.21 0.01 0.00 -0.74 0.00 0.00 36.82 35.93 2x3l h ILE 420 CO -0.01 0.24 -0.38 -0.33 0.00 0.00 0.00 178.15 177.66 2x3l h GLU 421 N 1.30 -1.04 -0.98 2.37 4.39 -1.12 0.54 114.58 120.05 2x3l h GLU 421 Ca 0.39 0.07 0.13 0.00 0.34 0.00 0.00 59.36 60.29 2x3l h GLU 421 Cb -0.06 0.24 -0.08 0.00 -0.10 0.00 0.00 28.75 28.74 2x3l h GLU 421 CO -0.11 -0.68 0.62 1.25 -1.16 0.00 0.00 179.01 178.93 2x3l h LEU 422 N -1.18 0.85 -0.52 1.33 5.85 -1.34 0.22 115.31 120.53 2x3l h LEU 422 Ca -0.11 0.05 -0.13 0.00 0.84 0.00 0.00 57.88 58.53 2x3l h LEU 422 Cb 0.84 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.73 2x3l h LEU 422 CO 0.18 0.44 -0.17 0.58 -0.34 0.00 0.00 178.44 179.13 2x3l h VAL 423 N 0.91 1.27 -0.54 1.05 2.07 -0.93 -0.76 116.25 119.31 2x3l h VAL 423 Ca 0.49 -1.34 -0.08 0.00 0.82 0.00 0.00 66.70 66.59 2x3l h VAL 423 Cb 0.57 1.05 -0.02 0.00 -1.52 0.00 0.00 31.29 31.38 2x3l h VAL 423 CO -0.26 0.47 0.01 0.78 0.02 0.00 0.00 177.57 178.58 2x3l h ASN 424 N 0.89 0.93 -0.50 0.57 2.35 0.14 -2.24 115.58 117.72 2x3l h ASN 424 Ca 0.12 -0.30 0.07 0.00 -0.55 0.00 0.00 56.30 55.64 2x3l h ASN 424 Cb 0.75 -0.25 -0.06 0.00 0.05 0.00 0.00 38.32 38.81 2x3l h ASN 424 CO 0.06 1.00 0.16 -0.33 -1.65 0.00 0.00 177.43 176.68 2x3l h GLU 425 N 0.83 0.32 -0.07 0.81 5.08 -0.39 0.38 114.58 121.54 2x3l h GLU 425 Ca 0.15 -0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.53 2x3l h GLU 425 Cb 0.52 -0.07 -0.06 0.00 0.50 0.00 0.00 28.75 29.64 2x3l h GLU 425 CO 0.03 0.21 -0.41 1.88 -1.00 0.00 0.00 179.01 179.72 2x3l h TYR 426 N 0.33 -1.16 -0.65 4.33 0.99 -1.02 -2.18 116.97 117.61 2x3l h TYR 426 Ca 0.24 0.04 -0.04 0.00 2.00 0.00 0.00 58.73 60.97 2x3l h TYR 426 Cb 0.28 0.52 -0.03 0.00 1.00 0.00 0.00 36.73 38.49 2x3l h TYR 426 CO -0.18 -0.48 0.23 -0.07 -0.00 0.00 0.00 178.16 177.67 2x3l h LEU 427 N -0.52 0.90 -1.63 3.88 3.38 -0.68 -1.56 115.31 119.09 2x3l h LEU 427 Ca 0.06 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.90 2x3l h LEU 427 Cb 0.63 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 2x3l h LEU 427 CO -0.35 0.82 0.22 -0.08 0.09 0.00 0.00 178.44 179.14 2x3l h GLU 428 N 0.95 0.47 -0.00 1.13 4.81 -0.10 -2.56 114.58 119.28 2x3l h GLU 428 Ca 0.22 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.42 2x3l h GLU 428 Cb 0.22 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.50 2x3l h GLU 428 CO -0.01 0.32 -0.24 0.25 -0.73 0.00 0.00 179.01 178.60 2x3l n THR 429 N -4.47 0.00 -0.97 0.32 -2.24 -0.63 -4.95 114.28 101.34 2x3l n THR 429 Ca 0.02 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 2x3l n THR 429 Cb 0.07 0.08 0.00 0.00 -2.10 0.00 0.00 70.33 68.38 2x3l n THR 429 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2x3l n GLY 430 N 1.38 0.45 3.71 3.38 0.00 -0.95 -5.03 105.19 108.13 2x3l n GLY 430 Ca 0.10 -0.97 -0.42 0.00 0.00 0.00 0.00 46.02 44.74 2x3l n GLY 430 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2x3l s MET 431 N -1.95 4.46 0.32 1.61 -1.94 -1.01 -5.01 119.30 115.77 2x3l s MET 431 Ca 0.00 1.64 -0.29 0.00 -1.71 0.00 0.00 55.69 55.32 2x3l s MET 431 Cb 0.00 -3.42 -0.11 0.00 2.01 0.00 0.00 34.83 33.31 2x3l s MET 431 CO 0.00 -0.22 1.53 0.42 -0.01 0.00 0.00 175.02 176.74 2x3l s ILE 432 N 1.24 2.14 -0.27 2.53 -1.09 -1.24 -4.55 121.20 119.97 2x3l s ILE 432 Ca 0.56 0.13 -0.02 0.00 -2.23 0.00 0.00 60.65 59.09 2x3l s ILE 432 Cb -0.26 -3.08 0.12 0.00 -1.58 0.00 0.00 42.46 37.66 2x3l s ILE 432 CO 0.27 0.02 0.25 0.68 -1.23 0.00 0.00 174.94 174.94 2x3l s VAL 433 N -0.45 -0.33 0.43 2.92 -7.23 -1.26 -0.54 120.40 113.93 2x3l s VAL 433 Ca 0.59 -0.43 -0.15 0.00 -1.81 0.00 0.00 61.98 60.18 2x3l s VAL 433 Cb -0.46 -0.90 -0.08 0.00 0.56 0.00 0.00 36.38 35.49 2x3l s VAL 433 CO 0.53 -0.43 0.86 -1.61 -0.31 0.00 0.00 175.10 174.14 2x3l s GLU 434 N 2.32 3.96 0.00 4.82 2.02 -0.52 -3.43 118.70 127.87 2x3l s GLU 434 Ca 0.09 0.79 0.00 0.00 0.02 0.00 0.00 54.97 55.86 2x3l s GLU 434 Cb -0.15 -2.28 0.00 0.00 0.10 0.00 0.00 34.13 31.80 2x3l s GLU 434 CO -0.28 -0.07 0.00 0.41 0.02 0.00 0.00 175.26 175.34 2x3l n GLY 435 N -1.07 0.76 3.01 -1.39 0.00 -1.25 -1.73 105.19 103.52 2x3l n GLY 435 Ca 0.05 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.86 2x3l n GLY 435 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2x3l s ILE 436 N -2.76 0.86 -0.03 -0.61 1.01 -1.22 -4.18 121.20 114.26 2x3l s ILE 436 Ca 0.00 -0.39 -0.03 0.00 0.00 0.00 0.00 60.65 60.23 2x3l s ILE 436 Cb 0.00 -0.77 0.01 0.00 0.01 0.00 0.00 42.46 41.70 2x3l s ILE 436 CO 0.00 0.27 0.08 -0.54 0.00 0.00 0.00 174.94 174.75 2x3l s LYS 437 N 0.29 0.14 -1.75 2.79 1.02 -0.98 -4.88 119.74 116.37 2x3l s LYS 437 Ca -0.05 0.04 -0.20 0.00 0.02 0.00 0.00 55.97 55.78 2x3l s LYS 437 Cb -0.10 0.06 0.18 0.00 -0.52 0.00 0.00 37.83 37.45 2x3l s LYS 437 CO 0.01 -0.02 0.75 0.09 -0.92 0.00 0.00 175.35 175.26 2x3l n ASN 438 N 2.84 -3.01 -3.32 2.83 3.02 -1.26 -0.24 115.26 116.11 2x3l n ASN 438 Ca -0.14 -1.06 -0.24 0.00 -0.03 0.00 0.00 54.58 53.11 2x3l n ASN 438 Cb 0.59 -2.51 0.02 0.00 -0.61 0.00 0.00 39.78 37.27 2x3l n ASN 438 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2x3l n ASN 439 N -2.61 -4.97 -4.29 6.41 3.02 -1.26 -5.00 115.26 106.56 2x3l n ASN 439 Ca 0.09 -0.41 -0.16 0.00 -0.03 0.00 0.00 54.58 54.06 2x3l n ASN 439 Cb 0.48 -4.03 -0.10 0.00 -0.61 0.00 0.00 39.78 35.52 2x3l n ASN 439 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2x3l s LYS 440 N -5.99 1.17 0.01 3.52 1.02 0.66 -3.77 119.74 116.36 2x3l s LYS 440 Ca 0.41 -1.49 0.07 0.00 0.02 0.00 0.00 55.97 54.97 2x3l s LYS 440 Cb -0.20 -0.86 -0.02 0.00 -0.52 0.00 0.00 37.83 36.23 2x3l s LYS 440 CO 0.51 0.13 -0.20 -1.50 -0.92 0.00 0.00 175.35 173.36 2x3l s ILE 441 N -3.08 1.61 0.03 2.17 2.07 0.39 -2.33 121.20 122.06 2x3l s ILE 441 Ca 0.19 -1.01 -0.30 0.00 -1.41 0.00 0.00 60.65 58.12 2x3l s ILE 441 Cb 0.01 -1.37 -0.04 0.00 0.13 0.00 0.00 42.46 41.19 2x3l s ILE 441 CO 0.03 0.33 0.97 -0.22 -1.91 0.00 0.00 174.94 174.15 2x3l s LEU 442 N -0.79 4.40 0.00 8.50 2.96 -1.26 -0.97 118.68 131.52 2x3l s LEU 442 Ca 0.07 1.69 0.00 0.00 -0.22 0.00 0.00 54.13 55.67 2x3l s LEU 442 Cb -0.08 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 43.04 2x3l s LEU 442 CO 0.00 -0.21 0.00 0.52 -1.32 0.00 0.00 176.35 175.35